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merge=lfs -text +Plants/Q9AYG8/Q9AYG8.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9C672/Q9C672.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9C6E9/Q9C6E9.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9C7R7/Q9C7R7.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9C7W1/Q9C7W1.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9C7Y9/Q9C7Y9.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9FGU5/Q9FGU5.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9FH00/Q9FH00.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9FLJ3/Q9FLJ3.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9FM74/Q9FM74.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9FNP3/Q9FNP3.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9FNV0/Q9FNV0.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9FNW1/Q9FNW1.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9FP55/Q9FP55.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9FP91/Q9FP91.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9FR31/Q9FR31.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9FRH1/Q9FRH1.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9FS23/Q9FS23.dcd filter=lfs diff=lfs merge=lfs -text +Plants/Q9FSY9/Q9FSY9.dcd filter=lfs diff=lfs merge=lfs -text diff --git a/Plants/Q84JE6/Q84JE6.dcd b/Plants/Q84JE6/Q84JE6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..611999a4a9399882f1ceee9f2b0e12ae8131dce5 --- /dev/null +++ b/Plants/Q84JE6/Q84JE6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:96d1b4e3f8c885d32bf686feec6a17d3d817d9c978b30b7509d46f0ae8e722f8 +size 17600276 diff --git a/Plants/Q84JE6/top.pdb b/Plants/Q84JE6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..b2e46d5eadbc57558492a7a972038ec62e72f8cf --- /dev/null +++ b/Plants/Q84JE6/top.pdb @@ -0,0 +1,144 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 235.597 280.114 243.074 1.00 0.00 C +ATOM 2 CA TRP A 2 233.588 283.275 242.379 1.00 0.00 C +ATOM 3 CA GLY A 3 229.901 284.235 242.294 1.00 0.00 C +ATOM 4 CA ILE A 4 227.606 287.269 242.490 1.00 0.00 C +ATOM 5 CA GLU A 5 225.231 287.981 239.597 1.00 0.00 C +ATOM 6 CA THR A 6 226.846 290.117 236.887 1.00 0.00 C +ATOM 7 CA LEU A 7 224.161 292.324 235.325 1.00 0.00 C +ATOM 8 CA MET A 8 225.058 295.933 236.156 1.00 0.00 C +ATOM 9 CA SER A 9 225.864 297.259 239.635 1.00 0.00 C +ATOM 10 CA ARG A 10 229.648 296.962 239.971 1.00 0.00 C +ATOM 11 CA THR A 11 233.028 296.274 238.353 1.00 0.00 C +ATOM 12 CA GLU A 12 235.486 299.090 239.094 1.00 0.00 C +ATOM 13 CA ALA A 13 237.657 301.937 237.791 1.00 0.00 C +ATOM 14 CA GLY A 14 236.305 303.766 234.734 1.00 0.00 C +ATOM 15 CA PRO A 15 233.305 304.999 232.735 1.00 0.00 C +ATOM 16 CA ARG A 16 231.618 302.370 230.553 1.00 0.00 C +ATOM 17 CA ALA A 17 232.768 299.197 228.785 1.00 0.00 C +ATOM 18 CA ARG A 18 232.350 295.940 226.853 1.00 0.00 C +ATOM 19 CA GLY A 19 231.139 292.368 226.310 1.00 0.00 C +ATOM 20 CA GLY A 20 229.903 289.138 227.907 1.00 0.00 C +ATOM 21 CA ARG A 21 228.277 285.973 226.544 1.00 0.00 C +ATOM 22 CA LYS A 22 226.231 283.306 224.751 1.00 0.00 C +ATOM 23 CA GLY A 23 226.015 279.931 226.506 1.00 0.00 C +ATOM 24 CA GLY A 24 229.434 278.264 226.734 1.00 0.00 C +ATOM 25 CA ARG A 25 232.616 277.689 228.748 1.00 0.00 C +ATOM 26 CA PRO A 26 234.070 279.136 231.959 1.00 0.00 C +ATOM 27 CA ALA A 27 236.292 282.179 231.393 1.00 0.00 C +ATOM 28 CA GLY A 28 239.425 282.039 233.556 1.00 0.00 C +ATOM 29 CA ASP A 29 241.219 278.821 232.585 1.00 0.00 C +ATOM 30 CA GLY A 30 242.304 276.493 235.398 1.00 0.00 C +ATOM 31 CA ARG A 31 243.150 277.002 239.078 1.00 0.00 C +ATOM 32 CA ARG A 32 243.394 280.665 240.098 1.00 0.00 C +ATOM 33 CA GLY A 33 244.064 284.190 241.379 1.00 0.00 C +ATOM 34 CA ARG A 34 241.460 286.951 241.717 1.00 0.00 C +ATOM 35 CA ARG A 35 239.085 289.553 243.167 1.00 0.00 C +ATOM 36 CA ARG A 36 241.325 292.493 244.090 1.00 0.00 C +ATOM 37 CA ASP A 37 243.654 291.635 246.981 1.00 0.00 C +ATOM 38 CA ASP A 38 246.723 291.720 249.237 1.00 0.00 C +ATOM 39 CA GLY A 39 248.417 288.346 249.748 1.00 0.00 C +ATOM 40 CA SER A 40 251.544 288.683 251.900 1.00 0.00 C +ATOM 41 CA SER A 41 254.715 288.382 249.810 1.00 0.00 C +ATOM 42 CA TYR A 42 258.509 288.729 249.753 1.00 0.00 C +ATOM 43 CA ARG A 43 259.628 292.371 249.792 1.00 0.00 C +ATOM 44 CA GLY A 44 257.677 295.287 251.277 1.00 0.00 C +ATOM 45 CA ARG A 45 255.084 297.883 252.304 1.00 0.00 C +ATOM 46 CA GLU A 46 253.948 297.305 255.894 1.00 0.00 C +ATOM 47 CA ALA A 47 253.510 296.224 259.521 1.00 0.00 C +ATOM 48 CA GLY A 48 252.528 292.993 261.285 1.00 0.00 C +ATOM 49 CA GLU A 49 250.289 291.982 264.198 1.00 0.00 C +ATOM 50 CA ARG A 50 248.142 292.000 267.345 1.00 0.00 C +ATOM 51 CA GLU A 51 249.737 290.876 270.618 1.00 0.00 C +ATOM 52 CA GLY A 52 252.999 292.253 272.025 1.00 0.00 C +ATOM 53 CA GLY A 53 254.352 289.679 274.487 1.00 0.00 C +ATOM 54 CA ARG A 54 258.161 289.597 274.459 1.00 0.00 C +ATOM 55 CA TRP A 55 259.175 287.042 271.820 1.00 0.00 C +ATOM 56 CA ARG A 56 256.544 285.933 269.298 1.00 0.00 C +ATOM 57 CA PRO A 57 258.514 284.287 266.483 1.00 0.00 C +ATOM 58 CA MET A 58 260.504 281.601 264.655 1.00 0.00 C +ATOM 59 CA LEU A 59 259.774 278.200 263.100 1.00 0.00 C +ATOM 60 CA GLY A 60 258.046 275.196 261.517 1.00 0.00 C +ATOM 61 CA ARG A 61 258.975 271.805 262.983 1.00 0.00 C +ATOM 62 CA ARG A 62 257.424 269.201 260.674 1.00 0.00 C +ATOM 63 CA ARG A 63 254.089 268.829 258.870 1.00 0.00 C +ATOM 64 CA PRO A 64 252.227 265.975 257.166 1.00 0.00 C +ATOM 65 CA VAL A 65 248.684 265.092 258.254 1.00 0.00 C +ATOM 66 CA MET A 66 247.257 262.492 255.862 1.00 0.00 C +ATOM 67 CA ALA A 67 244.174 260.417 256.700 1.00 0.00 C +ATOM 68 CA ASP A 68 241.356 260.474 254.136 1.00 0.00 C +ATOM 69 CA ALA A 69 242.064 257.619 251.714 1.00 0.00 C +ATOM 70 CA GLY A 70 244.784 255.424 253.231 1.00 0.00 C +ATOM 71 CA GLU A 71 247.083 252.613 252.081 1.00 0.00 C +ATOM 72 CA GLY A 72 249.068 249.642 253.405 1.00 0.00 C +ATOM 73 CA GLU A 73 252.854 250.001 253.182 1.00 0.00 C +ATOM 74 CA THR A 74 254.461 252.903 251.308 1.00 0.00 C +ATOM 75 CA MET A 75 258.223 253.504 251.347 1.00 0.00 C +ATOM 76 CA GLY A 76 261.620 253.698 253.062 1.00 0.00 C +ATOM 77 CA PRO A 77 264.550 253.792 250.628 1.00 0.00 C +ATOM 78 CA PRO A 78 263.621 254.904 247.104 1.00 0.00 C +ATOM 79 CA THR A 79 264.124 251.863 244.864 1.00 0.00 C +ATOM 80 CA ALA A 80 264.349 248.067 244.623 1.00 0.00 C +ATOM 81 CA GLY A 81 266.933 246.690 242.186 1.00 0.00 C +ATOM 82 CA ALA A 82 268.140 244.256 239.515 1.00 0.00 C +ATOM 83 CA ARG A 83 269.440 241.112 241.230 1.00 0.00 C +ATOM 84 CA ARG A 84 268.133 237.926 239.600 1.00 0.00 C +ATOM 85 CA GLU A 85 266.859 235.255 241.999 1.00 0.00 C +ATOM 86 CA ARG A 86 268.031 233.927 245.372 1.00 0.00 C +ATOM 87 CA GLY A 87 269.651 232.618 248.563 1.00 0.00 C +ATOM 88 CA ARG A 88 267.425 230.429 250.748 1.00 0.00 C +ATOM 89 CA ALA A 89 267.134 226.880 249.395 1.00 0.00 C +ATOM 90 CA ALA A 90 268.211 223.226 249.488 1.00 0.00 C +ATOM 91 CA GLY A 91 268.412 219.895 247.650 1.00 0.00 C +ATOM 92 CA GLY A 92 268.863 216.226 248.574 1.00 0.00 C +ATOM 93 CA GLY A 93 268.016 214.190 245.467 1.00 0.00 C +ATOM 94 CA ALA A 94 267.467 215.207 241.837 1.00 0.00 C +ATOM 95 CA GLY A 95 268.787 217.795 239.372 1.00 0.00 C +ATOM 96 CA ARG A 96 266.640 217.381 236.252 1.00 0.00 C +ATOM 97 CA ARG A 97 262.842 217.411 236.549 1.00 0.00 C +ATOM 98 CA TRP A 98 259.708 219.524 236.067 1.00 0.00 C +ATOM 99 CA ALA A 99 256.594 221.384 234.901 1.00 0.00 C +ATOM 100 CA GLY A 100 254.690 222.382 238.046 1.00 0.00 C +ATOM 101 CA ASP A 101 254.031 222.123 241.790 1.00 0.00 C +ATOM 102 CA GLY A 102 251.139 221.249 244.111 1.00 0.00 C +ATOM 103 CA GLY A 103 252.545 219.226 247.018 1.00 0.00 C +ATOM 104 CA ARG A 104 253.948 216.717 249.518 1.00 0.00 C +ATOM 105 CA ARG A 105 253.430 214.279 252.400 1.00 0.00 C +ATOM 106 CA TRP A 106 252.589 213.669 256.065 1.00 0.00 C +ATOM 107 CA GLY A 107 253.580 210.748 258.301 1.00 0.00 C +ATOM 108 CA GLU A 108 256.639 210.637 260.569 1.00 0.00 C +ATOM 109 CA LEU A 109 260.151 209.257 261.100 1.00 0.00 C +ATOM 110 CA ARG A 110 262.706 207.378 258.988 1.00 0.00 C +ATOM 111 CA LYS A 111 266.113 206.841 257.369 1.00 0.00 C +ATOM 112 CA GLN A 112 269.723 207.921 257.932 1.00 0.00 C +ATOM 113 CA THR A 113 271.520 209.458 254.944 1.00 0.00 C +ATOM 114 CA HIS A 114 274.448 207.768 253.187 1.00 0.00 C +ATOM 115 CA GLY A 115 273.774 204.259 251.866 1.00 0.00 C +ATOM 116 CA PRO A 116 271.458 202.613 254.405 1.00 0.00 C +ATOM 117 CA THR A 117 270.739 199.377 256.283 1.00 0.00 C +ATOM 118 CA GLN A 118 269.630 196.118 254.650 1.00 0.00 C +ATOM 119 CA ALA A 119 267.608 193.255 253.157 1.00 0.00 C +ATOM 120 CA ARG A 120 267.132 191.029 250.102 1.00 0.00 C +ATOM 121 CA LEU A 121 263.906 189.041 250.497 1.00 0.00 C +ATOM 122 CA LEU A 122 261.428 187.898 253.155 1.00 0.00 C +ATOM 123 CA PRO A 123 257.974 186.765 254.297 1.00 0.00 C +ATOM 124 CA CYS A 124 256.080 189.245 256.482 1.00 0.00 C +ATOM 125 CA ARG A 125 252.828 190.838 257.667 1.00 0.00 C +ATOM 126 CA GLU A 126 253.763 193.873 259.770 1.00 0.00 C +ATOM 127 CA LEU A 127 252.027 196.899 261.303 1.00 0.00 C +ATOM 128 CA ARG A 128 248.542 196.966 262.841 1.00 0.00 C +ATOM 129 CA LYS A 129 247.969 194.460 265.653 1.00 0.00 C +ATOM 130 CA GLN A 130 245.056 195.519 267.869 1.00 0.00 C +ATOM 131 CA THR A 131 241.706 193.902 268.691 1.00 0.00 C +ATOM 132 CA GLN A 132 238.915 191.310 268.625 1.00 0.00 C +ATOM 133 CA ALA A 133 235.940 190.907 270.971 1.00 0.00 C +ATOM 134 CA LEU A 134 232.370 192.106 270.389 1.00 0.00 C +ATOM 135 CA ALA A 135 231.453 191.437 266.752 1.00 0.00 C +ATOM 136 CA SER A 136 228.461 189.086 266.559 1.00 0.00 C +ATOM 137 CA GLY A 137 226.980 186.237 268.610 1.00 0.00 C +ATOM 138 CA SER A 138 225.921 184.439 271.797 1.00 0.00 C +ATOM 139 CA GLY A 139 223.959 181.176 271.936 1.00 0.00 C +ATOM 140 CA GLU A 140 221.261 178.502 272.236 1.00 0.00 C +TER 141 GLU A 140 +END diff --git a/Plants/Q84JY8/Q84JY8.dcd b/Plants/Q84JY8/Q84JY8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..062054ec5090446a7ed42ebf2e5c5e08b9f7c690 --- /dev/null +++ b/Plants/Q84JY8/Q84JY8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:23608f95b4033095883d2d1c38a3783e9a516f0c2b41df5db7844790f41b959e +size 17960276 diff --git a/Plants/Q84JY8/top.pdb b/Plants/Q84JY8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..c9cc7b9e9b845aad13b6a073ca5f8f4f42a1e545 --- /dev/null +++ b/Plants/Q84JY8/top.pdb @@ -0,0 +1,147 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 192.536 297.009 242.546 1.00 0.00 C +ATOM 2 CA ALA A 2 191.179 300.482 243.329 1.00 0.00 C +ATOM 3 CA PRO A 3 191.228 303.503 245.651 1.00 0.00 C +ATOM 4 CA ALA A 4 193.941 304.258 248.217 1.00 0.00 C +ATOM 5 CA ALA A 5 196.059 307.415 248.466 1.00 0.00 C +ATOM 6 CA ARG A 6 198.384 308.933 245.857 1.00 0.00 C +ATOM 7 CA ARG A 7 200.726 311.937 245.742 1.00 0.00 C +ATOM 8 CA SER A 8 200.592 313.344 242.204 1.00 0.00 C +ATOM 9 CA HIS A 9 203.642 312.299 240.174 1.00 0.00 C +ATOM 10 CA GLY A 10 204.358 308.752 238.981 1.00 0.00 C +ATOM 11 CA GLY A 11 206.106 305.377 238.717 1.00 0.00 C +ATOM 12 CA GLY A 12 209.804 305.827 237.916 1.00 0.00 C +ATOM 13 CA ALA A 13 213.259 307.410 238.184 1.00 0.00 C +ATOM 14 CA HIS A 14 214.778 308.656 241.448 1.00 0.00 C +ATOM 15 CA ALA A 15 216.834 306.336 243.663 1.00 0.00 C +ATOM 16 CA ALA A 16 214.797 305.139 246.652 1.00 0.00 C +ATOM 17 CA ALA A 17 211.101 304.865 247.537 1.00 0.00 C +ATOM 18 CA ALA A 18 208.056 304.568 249.808 1.00 0.00 C +ATOM 19 CA GLN A 19 204.975 302.368 249.386 1.00 0.00 C +ATOM 20 CA SER A 20 203.327 301.063 246.208 1.00 0.00 C +ATOM 21 CA ASP A 21 206.135 299.320 244.313 1.00 0.00 C +ATOM 22 CA ASP A 22 207.318 295.760 243.650 1.00 0.00 C +ATOM 23 CA ARG A 23 208.111 292.033 243.663 1.00 0.00 C +ATOM 24 CA ARG A 24 208.993 289.742 246.576 1.00 0.00 C +ATOM 25 CA ARG A 25 211.301 286.824 245.754 1.00 0.00 C +ATOM 26 CA ARG A 26 212.449 284.514 242.950 1.00 0.00 C +ATOM 27 CA ARG A 27 213.873 280.980 242.984 1.00 0.00 C +ATOM 28 CA ALA A 28 214.783 277.575 241.538 1.00 0.00 C +ATOM 29 CA ALA A 29 218.327 276.191 241.329 1.00 0.00 C +ATOM 30 CA ALA A 30 220.790 277.491 243.929 1.00 0.00 C +ATOM 31 CA ARG A 31 221.647 276.811 247.578 1.00 0.00 C +ATOM 32 CA GLY A 32 220.748 277.179 251.262 1.00 0.00 C +ATOM 33 CA GLU A 33 220.683 277.953 254.992 1.00 0.00 C +ATOM 34 CA GLU A 34 222.848 276.448 257.743 1.00 0.00 C +ATOM 35 CA GLY A 35 224.646 273.426 256.278 1.00 0.00 C +ATOM 36 CA GLU A 36 225.526 270.032 254.787 1.00 0.00 C +ATOM 37 CA LYS A 37 225.366 268.149 251.478 1.00 0.00 C +ATOM 38 CA LYS A 38 223.170 270.100 249.053 1.00 0.00 C +ATOM 39 CA GLY A 39 219.365 270.074 248.844 1.00 0.00 C +ATOM 40 CA GLY A 40 217.391 267.069 250.107 1.00 0.00 C +ATOM 41 CA ASP A 41 215.945 268.228 253.436 1.00 0.00 C +ATOM 42 CA ALA A 42 217.811 267.865 256.738 1.00 0.00 C +ATOM 43 CA SER A 43 216.072 267.195 260.061 1.00 0.00 C +ATOM 44 CA PRO A 44 217.691 265.630 263.135 1.00 0.00 C +ATOM 45 CA ARG A 45 217.424 264.446 266.746 1.00 0.00 C +ATOM 46 CA VAL A 46 216.589 260.790 267.423 1.00 0.00 C +ATOM 47 CA ALA A 47 218.591 259.789 270.506 1.00 0.00 C +ATOM 48 CA GLY A 48 219.630 260.253 274.142 1.00 0.00 C +ATOM 49 CA ALA A 49 221.681 257.600 275.952 1.00 0.00 C +ATOM 50 CA GLU A 50 223.979 255.436 278.086 1.00 0.00 C +ATOM 51 CA GLU A 51 227.084 254.411 280.042 1.00 0.00 C +ATOM 52 CA GLY A 52 230.370 254.631 278.126 1.00 0.00 C +ATOM 53 CA ASP A 53 234.083 255.209 278.750 1.00 0.00 C +ATOM 54 CA GLY A 54 236.048 252.145 277.622 1.00 0.00 C +ATOM 55 CA GLY A 55 239.824 251.638 277.623 1.00 0.00 C +ATOM 56 CA ARG A 56 242.560 249.337 276.307 1.00 0.00 C +ATOM 57 CA ARG A 57 246.287 248.545 276.264 1.00 0.00 C +ATOM 58 CA ARG A 58 249.012 248.085 273.642 1.00 0.00 C +ATOM 59 CA GLN A 59 250.837 251.060 272.113 1.00 0.00 C +ATOM 60 CA ALA A 60 253.940 251.955 274.135 1.00 0.00 C +ATOM 61 CA THR A 61 257.188 252.289 272.172 1.00 0.00 C +ATOM 62 CA GLY A 62 259.365 251.293 269.208 1.00 0.00 C +ATOM 63 CA GLY A 63 262.475 251.631 267.033 1.00 0.00 C +ATOM 64 CA ARG A 64 263.497 248.615 264.942 1.00 0.00 C +ATOM 65 CA ARG A 65 264.169 244.882 265.307 1.00 0.00 C +ATOM 66 CA ARG A 66 263.364 241.608 263.531 1.00 0.00 C +ATOM 67 CA LEU A 67 260.887 242.584 260.806 1.00 0.00 C +ATOM 68 CA ALA A 68 257.126 242.641 260.201 1.00 0.00 C +ATOM 69 CA ASP A 69 254.148 240.362 260.879 1.00 0.00 C +ATOM 70 CA GLU A 70 250.900 238.458 260.299 1.00 0.00 C +ATOM 71 CA LEU A 71 249.879 235.750 262.778 1.00 0.00 C +ATOM 72 CA ARG A 72 252.425 234.777 265.440 1.00 0.00 C +ATOM 73 CA ARG A 73 253.900 235.320 268.911 1.00 0.00 C +ATOM 74 CA ALA A 74 254.988 231.913 270.224 1.00 0.00 C +ATOM 75 CA LEU A 75 256.596 228.612 271.242 1.00 0.00 C +ATOM 76 CA ARG A 76 254.231 227.096 273.815 1.00 0.00 C +ATOM 77 CA LYS A 77 251.556 224.884 272.245 1.00 0.00 C +ATOM 78 CA GLU A 78 249.967 222.846 269.445 1.00 0.00 C +ATOM 79 CA LYS A 79 250.674 219.128 269.880 1.00 0.00 C +ATOM 80 CA ILE A 80 253.813 217.225 270.900 1.00 0.00 C +ATOM 81 CA GLY A 81 254.350 213.871 272.626 1.00 0.00 C +ATOM 82 CA ILE A 82 251.468 211.706 273.858 1.00 0.00 C +ATOM 83 CA ARG A 83 249.701 208.587 275.150 1.00 0.00 C +ATOM 84 CA GLU A 84 251.625 205.326 275.573 1.00 0.00 C +ATOM 85 CA ARG A 85 252.929 201.887 274.578 1.00 0.00 C +ATOM 86 CA GLU A 86 256.183 200.800 272.921 1.00 0.00 C +ATOM 87 CA MET A 87 259.623 199.377 272.106 1.00 0.00 C +ATOM 88 CA ASP A 88 261.238 197.180 274.766 1.00 0.00 C +ATOM 89 CA HIS A 89 259.802 194.299 276.804 1.00 0.00 C +ATOM 90 CA GLY A 90 259.620 190.627 275.805 1.00 0.00 C +ATOM 91 CA ASP A 91 261.451 188.890 272.950 1.00 0.00 C +ATOM 92 CA ARG A 92 261.881 191.596 270.303 1.00 0.00 C +ATOM 93 CA ASP A 93 264.601 194.247 270.014 1.00 0.00 C +ATOM 94 CA PRO A 94 263.938 197.591 268.312 1.00 0.00 C +ATOM 95 CA TRP A 95 265.664 198.510 265.042 1.00 0.00 C +ATOM 96 CA PRO A 96 269.302 199.416 264.364 1.00 0.00 C +ATOM 97 CA LYS A 97 272.932 199.475 265.521 1.00 0.00 C +ATOM 98 CA ALA A 98 275.941 201.775 265.938 1.00 0.00 C +ATOM 99 CA ALA A 99 275.949 204.819 263.647 1.00 0.00 C +ATOM 100 CA VAL A 100 276.242 206.284 260.142 1.00 0.00 C +ATOM 101 CA GLU A 101 277.903 209.177 258.301 1.00 0.00 C +ATOM 102 CA VAL A 102 279.629 207.677 255.254 1.00 0.00 C +ATOM 103 CA ALA A 103 280.400 210.630 252.973 1.00 0.00 C +ATOM 104 CA LEU A 104 284.094 210.485 252.053 1.00 0.00 C +ATOM 105 CA THR A 105 285.791 209.164 248.908 1.00 0.00 C +ATOM 106 CA ARG A 106 289.223 210.682 248.250 1.00 0.00 C +ATOM 107 CA ALA A 107 289.746 211.031 244.492 1.00 0.00 C +ATOM 108 CA ARG A 108 287.145 211.201 241.713 1.00 0.00 C +ATOM 109 CA GLY A 109 285.738 213.488 239.011 1.00 0.00 C +ATOM 110 CA ASP A 110 284.586 217.082 238.485 1.00 0.00 C +ATOM 111 CA GLU A 111 286.955 220.065 238.434 1.00 0.00 C +ATOM 112 CA GLY A 112 288.767 223.186 237.214 1.00 0.00 C +ATOM 113 CA SER A 113 286.346 225.933 236.161 1.00 0.00 C +ATOM 114 CA GLY A 114 284.845 227.250 232.916 1.00 0.00 C +ATOM 115 CA ASP A 115 281.605 227.858 231.005 1.00 0.00 C +ATOM 116 CA GLU A 116 280.464 225.112 228.623 1.00 0.00 C +ATOM 117 CA PRO A 117 279.143 224.492 225.103 1.00 0.00 C +ATOM 118 CA ARG A 118 276.626 224.291 222.250 1.00 0.00 C +ATOM 119 CA ARG A 119 273.837 226.701 223.216 1.00 0.00 C +ATOM 120 CA ARG A 120 272.567 229.502 225.465 1.00 0.00 C +ATOM 121 CA ARG A 121 274.504 232.600 224.385 1.00 0.00 C +ATOM 122 CA GLY A 122 274.811 236.328 223.657 1.00 0.00 C +ATOM 123 CA GLY A 123 277.282 237.048 220.848 1.00 0.00 C +ATOM 124 CA ARG A 124 281.083 237.138 220.598 1.00 0.00 C +ATOM 125 CA GLY A 125 283.453 239.713 219.090 1.00 0.00 C +ATOM 126 CA GLY A 126 284.750 242.616 221.189 1.00 0.00 C +ATOM 127 CA PRO A 127 288.139 244.331 220.887 1.00 0.00 C +ATOM 128 CA ARG A 128 288.924 247.076 218.364 1.00 0.00 C +ATOM 129 CA PRO A 129 290.509 250.498 217.824 1.00 0.00 C +ATOM 130 CA ARG A 130 289.462 253.823 219.362 1.00 0.00 C +ATOM 131 CA GLU A 131 286.505 256.102 218.599 1.00 0.00 C +ATOM 132 CA ALA A 132 284.826 256.165 215.180 1.00 0.00 C +ATOM 133 CA ASN A 133 286.047 258.554 212.474 1.00 0.00 C +ATOM 134 CA GLY A 134 289.475 258.574 210.811 1.00 0.00 C +ATOM 135 CA GLY A 135 292.911 259.483 212.184 1.00 0.00 C +ATOM 136 CA ASP A 136 295.781 260.913 214.242 1.00 0.00 C +ATOM 137 CA GLY A 137 299.270 259.455 214.710 1.00 0.00 C +ATOM 138 CA VAL A 138 302.348 258.112 212.910 1.00 0.00 C +ATOM 139 CA ARG A 139 302.998 258.951 209.251 1.00 0.00 C +ATOM 140 CA ARG A 140 305.715 260.175 206.878 1.00 0.00 C +ATOM 141 CA ARG A 141 308.204 262.793 205.665 1.00 0.00 C +ATOM 142 CA ARG A 142 311.966 263.181 205.203 1.00 0.00 C +ATOM 143 CA ALA A 143 315.428 261.722 205.837 1.00 0.00 C +TER 144 ALA A 143 +END diff --git a/Plants/Q84K92/Q84K92.dcd b/Plants/Q84K92/Q84K92.dcd new file mode 100644 index 0000000000000000000000000000000000000000..2398c542cfb4ec6626e5ae1e83dd550e20d60f7e --- /dev/null +++ b/Plants/Q84K92/Q84K92.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:905b47ac324dbe2fbc65b7f6182a554cd4614b5e6b8ed252a6e9c6010c67139f +size 8360276 diff --git a/Plants/Q84K92/top.pdb b/Plants/Q84K92/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..e2c169e11c9f8565137c3d79b7df6bab4df69ee2 --- /dev/null +++ b/Plants/Q84K92/top.pdb @@ -0,0 +1,67 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 255.540 206.056 223.749 1.00 0.00 C +ATOM 2 CA ALA A 2 258.162 203.833 225.390 1.00 0.00 C +ATOM 3 CA ASP A 3 259.871 205.540 228.336 1.00 0.00 C +ATOM 4 CA LYS A 4 261.403 209.020 228.579 1.00 0.00 C +ATOM 5 CA GLY A 5 261.284 211.402 231.551 1.00 0.00 C +ATOM 6 CA ARG A 6 261.088 212.561 235.175 1.00 0.00 C +ATOM 7 CA PRO A 7 262.984 214.924 237.486 1.00 0.00 C +ATOM 8 CA LEU A 8 262.568 218.506 236.257 1.00 0.00 C +ATOM 9 CA PRO A 9 259.318 220.487 236.430 1.00 0.00 C +ATOM 10 CA LYS A 10 257.192 222.636 238.749 1.00 0.00 C +ATOM 11 CA PHE A 11 259.478 224.786 240.909 1.00 0.00 C +ATOM 12 CA GLY A 12 262.239 226.738 242.666 1.00 0.00 C +ATOM 13 CA GLU A 13 260.796 228.527 245.705 1.00 0.00 C +ATOM 14 CA TRP A 14 260.108 231.794 247.540 1.00 0.00 C +ATOM 15 CA ASP A 15 257.411 234.486 247.571 1.00 0.00 C +ATOM 16 CA VAL A 16 254.719 236.866 246.306 1.00 0.00 C +ATOM 17 CA ASN A 17 252.755 239.798 244.871 1.00 0.00 C +ATOM 18 CA ASP A 18 250.686 242.823 243.829 1.00 0.00 C +ATOM 19 CA PRO A 19 249.232 245.940 242.189 1.00 0.00 C +ATOM 20 CA SER A 20 247.103 246.116 239.034 1.00 0.00 C +ATOM 21 CA SER A 21 247.892 248.519 236.185 1.00 0.00 C +ATOM 22 CA ALA A 22 249.274 251.686 234.579 1.00 0.00 C +ATOM 23 CA GLU A 23 250.451 255.156 235.624 1.00 0.00 C +ATOM 24 CA GLY A 24 254.182 255.922 235.684 1.00 0.00 C +ATOM 25 CA PHE A 25 257.266 258.035 234.946 1.00 0.00 C +ATOM 26 CA THR A 26 259.167 261.178 235.959 1.00 0.00 C +ATOM 27 CA VAL A 27 258.599 263.479 238.942 1.00 0.00 C +ATOM 28 CA ILE A 28 256.284 262.093 241.631 1.00 0.00 C +ATOM 29 CA PHE A 29 252.633 261.596 240.660 1.00 0.00 C +ATOM 30 CA ASN A 30 251.983 261.403 236.911 1.00 0.00 C +ATOM 31 CA LYS A 31 249.036 263.706 236.182 1.00 0.00 C +ATOM 32 CA ALA A 32 246.607 265.094 238.768 1.00 0.00 C +ATOM 33 CA ARG A 33 243.062 264.669 240.099 1.00 0.00 C +ATOM 34 CA ASN A 34 242.880 264.014 243.848 1.00 0.00 C +ATOM 35 CA GLU A 35 244.535 262.119 246.708 1.00 0.00 C +ATOM 36 CA LYS A 36 246.286 258.885 245.710 1.00 0.00 C +ATOM 37 CA LYS A 37 248.902 257.191 247.901 1.00 0.00 C +ATOM 38 CA GLY A 38 251.481 259.075 249.978 1.00 0.00 C +ATOM 39 CA GLY A 39 255.124 260.085 249.502 1.00 0.00 C +ATOM 40 CA GLY A 40 257.064 263.115 248.248 1.00 0.00 C +ATOM 41 CA LYS A 41 256.986 266.441 250.104 1.00 0.00 C +ATOM 42 CA SER A 42 256.138 267.554 253.648 1.00 0.00 C +ATOM 43 CA ASP A 43 254.722 269.352 256.694 1.00 0.00 C +ATOM 44 CA SER A 44 254.253 270.846 260.167 1.00 0.00 C +ATOM 45 CA PRO A 45 254.636 268.166 262.848 1.00 0.00 C +ATOM 46 CA GLY A 46 253.260 264.615 262.729 1.00 0.00 C +ATOM 47 CA LYS A 47 252.762 260.848 262.455 1.00 0.00 C +ATOM 48 CA ASP A 48 249.726 258.664 261.727 1.00 0.00 C +ATOM 49 CA GLU A 49 246.400 259.840 260.286 1.00 0.00 C +ATOM 50 CA PRO A 50 243.716 262.431 261.058 1.00 0.00 C +ATOM 51 CA GLY A 51 241.926 264.003 264.032 1.00 0.00 C +ATOM 52 CA TYR A 52 241.511 265.381 267.559 1.00 0.00 C +ATOM 53 CA ASN A 53 241.957 264.113 271.124 1.00 0.00 C +ATOM 54 CA LYS A 54 242.392 267.011 273.560 1.00 0.00 C +ATOM 55 CA ASN A 55 240.573 267.361 276.889 1.00 0.00 C +ATOM 56 CA GLY A 56 238.290 267.118 279.930 1.00 0.00 C +ATOM 57 CA GLU A 57 235.867 264.189 280.193 1.00 0.00 C +ATOM 58 CA VAL A 58 232.823 261.918 279.887 1.00 0.00 C +ATOM 59 CA LEU A 59 232.805 258.591 278.031 1.00 0.00 C +ATOM 60 CA GLU A 60 230.060 258.326 275.401 1.00 0.00 C +ATOM 61 CA LYS A 61 226.255 258.487 275.509 1.00 0.00 C +ATOM 62 CA PRO A 62 224.362 260.992 277.668 1.00 0.00 C +ATOM 63 CA ALA A 63 221.935 263.894 278.114 1.00 0.00 C +TER 64 ALA A 63 +END diff --git a/Plants/Q84KH2/Q84KH2.dcd b/Plants/Q84KH2/Q84KH2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..f9c739cd22cb36bfbd6ba6d3ec5f1bd5cd7c8ccf --- /dev/null +++ b/Plants/Q84KH2/Q84KH2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:3c033537fddb10f20bd52789030badc5825cf9ab115183f36fe2bbab1be7497a +size 9560276 diff --git a/Plants/Q84KH2/top.pdb b/Plants/Q84KH2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a0ab282cca37e3e8557ff818da81d66b55e1ebd5 --- /dev/null +++ b/Plants/Q84KH2/top.pdb @@ -0,0 +1,77 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA GLU A 1 226.570 259.123 262.459 1.00 0.00 C +ATOM 2 CA ASP A 2 228.199 256.027 260.950 1.00 0.00 C +ATOM 3 CA ALA A 3 230.743 254.043 262.977 1.00 0.00 C +ATOM 4 CA LEU A 4 232.840 251.631 260.904 1.00 0.00 C +ATOM 5 CA GLY A 5 236.449 252.836 261.099 1.00 0.00 C +ATOM 6 CA GLU A 6 239.585 251.280 259.595 1.00 0.00 C +ATOM 7 CA GLY A 7 243.318 251.752 258.994 1.00 0.00 C +ATOM 8 CA PRO A 8 243.813 254.968 257.012 1.00 0.00 C +ATOM 9 CA ALA A 9 242.778 258.567 256.310 1.00 0.00 C +ATOM 10 CA SER A 10 243.407 260.380 259.601 1.00 0.00 C +ATOM 11 CA ARG A 11 245.987 260.574 262.398 1.00 0.00 C +ATOM 12 CA SER A 12 246.409 257.768 264.941 1.00 0.00 C +ATOM 13 CA PRO A 13 249.274 255.260 264.813 1.00 0.00 C +ATOM 14 CA SER A 14 250.701 254.091 268.146 1.00 0.00 C +ATOM 15 CA HIS A 15 249.076 255.950 271.047 1.00 0.00 C +ATOM 16 CA ILE A 16 248.304 254.458 274.467 1.00 0.00 C +ATOM 17 CA PRO A 17 246.768 251.271 275.881 1.00 0.00 C +ATOM 18 CA GLY A 18 247.443 248.116 273.854 1.00 0.00 C +ATOM 19 CA GLY A 19 246.588 248.040 270.142 1.00 0.00 C +ATOM 20 CA ALA A 20 246.892 244.560 268.620 1.00 0.00 C +ATOM 21 CA ASN A 21 246.552 243.519 264.971 1.00 0.00 C +ATOM 22 CA LYS A 22 247.214 240.955 262.232 1.00 0.00 C +ATOM 23 CA LYS A 23 249.972 238.349 262.576 1.00 0.00 C +ATOM 24 CA ALA A 24 253.360 239.854 261.697 1.00 0.00 C +ATOM 25 CA SER A 25 256.104 242.003 263.236 1.00 0.00 C +ATOM 26 CA THR A 26 257.191 245.404 264.567 1.00 0.00 C +ATOM 27 CA VAL A 27 258.943 247.251 261.733 1.00 0.00 C +ATOM 28 CA GLY A 28 262.473 248.283 262.727 1.00 0.00 C +ATOM 29 CA HIS A 29 264.303 251.559 263.390 1.00 0.00 C +ATOM 30 CA PHE A 30 261.892 254.265 262.215 1.00 0.00 C +ATOM 31 CA LYS A 31 258.435 255.828 261.862 1.00 0.00 C +ATOM 32 CA ASP A 32 256.837 258.312 259.455 1.00 0.00 C +ATOM 33 CA SER A 33 255.381 258.900 255.984 1.00 0.00 C +ATOM 34 CA ALA A 34 251.983 260.050 254.701 1.00 0.00 C +ATOM 35 CA ASN A 35 249.311 260.164 251.988 1.00 0.00 C +ATOM 36 CA LEU A 36 246.625 260.106 249.286 1.00 0.00 C +ATOM 37 CA SER A 37 243.454 262.075 248.524 1.00 0.00 C +ATOM 38 CA LYS A 38 241.938 264.631 246.140 1.00 0.00 C +ATOM 39 CA VAL A 39 243.682 267.924 246.935 1.00 0.00 C +ATOM 40 CA GLU A 40 242.317 271.467 247.257 1.00 0.00 C +ATOM 41 CA ASP A 41 238.994 272.216 245.550 1.00 0.00 C +ATOM 42 CA GLY A 42 236.369 269.543 246.241 1.00 0.00 C +ATOM 43 CA HIS A 43 232.986 269.942 244.534 1.00 0.00 C +ATOM 44 CA MET A 44 230.981 269.337 241.351 1.00 0.00 C +ATOM 45 CA ASP A 45 230.509 265.858 239.872 1.00 0.00 C +ATOM 46 CA ARG A 46 233.253 263.630 241.295 1.00 0.00 C +ATOM 47 CA SER A 47 233.815 259.875 240.982 1.00 0.00 C +ATOM 48 CA ILE A 48 236.863 257.848 239.924 1.00 0.00 C +ATOM 49 CA GLY A 49 240.485 257.116 240.851 1.00 0.00 C +ATOM 50 CA VAL A 50 244.082 256.177 241.687 1.00 0.00 C +ATOM 51 CA LYS A 51 247.192 254.016 241.267 1.00 0.00 C +ATOM 52 CA LYS A 52 246.272 251.265 238.797 1.00 0.00 C +ATOM 53 CA PRO A 53 246.964 248.718 236.050 1.00 0.00 C +ATOM 54 CA ARG A 54 247.474 245.004 236.733 1.00 0.00 C +ATOM 55 CA TYR A 55 247.786 242.606 233.789 1.00 0.00 C +ATOM 56 CA SER A 56 249.635 243.547 230.594 1.00 0.00 C +ATOM 57 CA ALA A 57 252.615 241.353 229.687 1.00 0.00 C +ATOM 58 CA ASP A 58 255.165 241.864 226.903 1.00 0.00 C +ATOM 59 CA GLU A 59 258.445 240.264 227.997 1.00 0.00 C +ATOM 60 CA GLY A 60 260.884 238.774 225.477 1.00 0.00 C +ATOM 61 CA PRO A 61 260.729 235.239 224.066 1.00 0.00 C +ATOM 62 CA SER A 62 263.238 232.375 224.210 1.00 0.00 C +ATOM 63 CA LEU A 63 265.440 231.760 227.258 1.00 0.00 C +ATOM 64 CA THR A 64 269.019 230.937 228.273 1.00 0.00 C +ATOM 65 CA GLU A 65 269.601 230.323 231.988 1.00 0.00 C +ATOM 66 CA LEU A 66 271.044 228.172 234.782 1.00 0.00 C +ATOM 67 CA SER A 67 269.827 225.159 236.770 1.00 0.00 C +ATOM 68 CA GLY A 68 269.280 225.547 240.520 1.00 0.00 C +ATOM 69 CA TYR A 69 267.692 228.565 242.219 1.00 0.00 C +ATOM 70 CA ASN A 70 270.285 231.356 242.228 1.00 0.00 C +ATOM 71 CA ALA A 71 270.094 234.816 243.812 1.00 0.00 C +ATOM 72 CA LYS A 72 269.706 237.557 241.195 1.00 0.00 C +ATOM 73 CA ARG A 73 270.163 237.646 237.414 1.00 0.00 C +TER 74 ARG A 73 +END diff --git a/Plants/Q84M72/Q84M72.dcd b/Plants/Q84M72/Q84M72.dcd new file mode 100644 index 0000000000000000000000000000000000000000..97ddf99be9ba1618f17764f3cdddf05ea17e19ed --- /dev/null +++ b/Plants/Q84M72/Q84M72.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:6475ed01a7d89548321dba74a605f0891023e1cfab2a5ef4a340844aff91735a +size 5600276 diff --git a/Plants/Q84M72/top.pdb b/Plants/Q84M72/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..7eea6e9a14a610343f857ee5ca40e83a5f8d304f --- /dev/null +++ b/Plants/Q84M72/top.pdb @@ -0,0 +1,44 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 260.619 251.174 216.842 1.00 0.00 C +ATOM 2 CA GLU A 2 262.061 254.327 218.421 1.00 0.00 C +ATOM 3 CA ARG A 3 261.272 256.711 221.287 1.00 0.00 C +ATOM 4 CA LYS A 4 259.874 260.097 222.334 1.00 0.00 C +ATOM 5 CA ARG A 5 259.401 263.427 220.543 1.00 0.00 C +ATOM 6 CA VAL A 6 255.978 265.026 221.031 1.00 0.00 C +ATOM 7 CA LEU A 7 252.369 264.217 221.947 1.00 0.00 C +ATOM 8 CA LEU A 8 248.706 264.948 221.193 1.00 0.00 C +ATOM 9 CA ALA A 9 246.547 262.330 222.924 1.00 0.00 C +ATOM 10 CA MET A 10 243.915 259.982 224.365 1.00 0.00 C +ATOM 11 CA GLY A 11 245.225 258.685 227.699 1.00 0.00 C +ATOM 12 CA LYS A 12 243.793 255.954 229.936 1.00 0.00 C +ATOM 13 CA GLU A 13 241.274 253.793 231.808 1.00 0.00 C +ATOM 14 CA SER A 14 242.630 252.074 234.926 1.00 0.00 C +ATOM 15 CA TRP A 15 244.130 250.026 237.767 1.00 0.00 C +ATOM 16 CA GLU A 16 246.481 247.234 238.860 1.00 0.00 C +ATOM 17 CA GLY A 17 244.159 244.468 240.073 1.00 0.00 C +ATOM 18 CA GLU A 18 242.058 244.314 243.248 1.00 0.00 C +ATOM 19 CA GLY A 19 239.596 246.518 245.145 1.00 0.00 C +ATOM 20 CA THR A 20 238.345 244.870 248.344 1.00 0.00 C +ATOM 21 CA GLU A 21 240.308 244.461 251.583 1.00 0.00 C +ATOM 22 CA GLU A 22 242.191 245.302 254.787 1.00 0.00 C +ATOM 23 CA GLU A 23 245.288 245.322 257.006 1.00 0.00 C +ATOM 24 CA GLY A 24 246.673 242.314 258.890 1.00 0.00 C +ATOM 25 CA ALA A 25 247.819 242.310 262.524 1.00 0.00 C +ATOM 26 CA GLY A 26 246.524 244.087 265.635 1.00 0.00 C +ATOM 27 CA LYS A 27 245.988 242.370 268.994 1.00 0.00 C +ATOM 28 CA GLU A 28 243.666 242.488 272.012 1.00 0.00 C +ATOM 29 CA PRO A 29 243.376 242.749 275.802 1.00 0.00 C +ATOM 30 CA TRP A 30 244.499 239.852 278.006 1.00 0.00 C +ATOM 31 CA GLU A 31 246.709 240.265 281.082 1.00 0.00 C +ATOM 32 CA GLY A 32 250.086 241.308 279.659 1.00 0.00 C +ATOM 33 CA GLU A 33 253.442 242.408 281.090 1.00 0.00 C +ATOM 34 CA GLY A 34 256.049 244.734 279.571 1.00 0.00 C +ATOM 35 CA ASP A 35 256.007 248.186 277.957 1.00 0.00 C +ATOM 36 CA GLY A 36 256.766 248.045 274.226 1.00 0.00 C +ATOM 37 CA VAL A 37 259.528 250.011 272.486 1.00 0.00 C +ATOM 38 CA ARG A 38 262.736 249.105 274.330 1.00 0.00 C +ATOM 39 CA ARG A 39 265.733 250.800 272.699 1.00 0.00 C +ATOM 40 CA GLY A 40 268.177 253.710 272.969 1.00 0.00 C +TER 41 GLY A 40 +END diff --git a/Plants/Q84MF8/Q84MF8.dcd b/Plants/Q84MF8/Q84MF8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..21ad00555a59eb238aa44635893d7d57859406c9 --- /dev/null +++ b/Plants/Q84MF8/Q84MF8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:07128f000b22d6c3f792ae113dd469d4d1deb1b13bccfec621b3e6ba1ed36ae0 +size 17720276 diff --git a/Plants/Q84MF8/top.pdb b/Plants/Q84MF8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..fce662c5597e3db916dbf0ca6d18c75b2f1655ba --- /dev/null +++ b/Plants/Q84MF8/top.pdb @@ -0,0 +1,145 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 323.693 206.875 237.684 1.00 0.00 C +ATOM 2 CA GLY A 2 322.655 210.276 236.315 1.00 0.00 C +ATOM 3 CA GLY A 3 320.242 213.141 237.010 1.00 0.00 C +ATOM 4 CA GLY A 4 320.396 216.830 237.951 1.00 0.00 C +ATOM 5 CA ARG A 5 321.311 219.235 235.141 1.00 0.00 C +ATOM 6 CA GLU A 6 324.637 220.815 234.164 1.00 0.00 C +ATOM 7 CA TRP A 7 326.193 223.743 236.041 1.00 0.00 C +ATOM 8 CA ARG A 8 327.979 222.251 239.058 1.00 0.00 C +ATOM 9 CA ARG A 9 325.853 219.225 239.975 1.00 0.00 C +ATOM 10 CA SER A 10 324.640 218.485 243.510 1.00 0.00 C +ATOM 11 CA SER A 11 326.281 218.314 246.944 1.00 0.00 C +ATOM 12 CA CYS A 12 327.170 219.487 250.458 1.00 0.00 C +ATOM 13 CA SER A 13 327.208 223.283 250.779 1.00 0.00 C +ATOM 14 CA SER A 14 324.365 224.806 248.751 1.00 0.00 C +ATOM 15 CA SER A 15 320.945 224.267 250.341 1.00 0.00 C +ATOM 16 CA SER A 16 317.275 224.956 249.582 1.00 0.00 C +ATOM 17 CA PRO A 17 314.380 227.181 250.668 1.00 0.00 C +ATOM 18 CA PRO A 18 310.801 227.611 249.432 1.00 0.00 C +ATOM 19 CA ALA A 19 307.977 230.018 248.570 1.00 0.00 C +ATOM 20 CA ALA A 20 304.735 231.552 247.284 1.00 0.00 C +ATOM 21 CA SER A 21 301.255 232.311 248.636 1.00 0.00 C +ATOM 22 CA SER A 22 299.053 235.147 247.361 1.00 0.00 C +ATOM 23 CA CYS A 23 297.815 238.647 248.214 1.00 0.00 C +ATOM 24 CA CYS A 24 295.519 241.114 249.992 1.00 0.00 C +ATOM 25 CA SER A 25 293.798 244.070 248.315 1.00 0.00 C +ATOM 26 CA THR A 26 290.365 245.724 248.278 1.00 0.00 C +ATOM 27 CA SER A 27 287.143 243.894 247.392 1.00 0.00 C +ATOM 28 CA SER A 28 286.310 240.366 248.566 1.00 0.00 C +ATOM 29 CA THR A 29 283.383 238.363 247.175 1.00 0.00 C +ATOM 30 CA SER A 30 282.040 235.051 248.495 1.00 0.00 C +ATOM 31 CA ALA A 31 281.172 232.455 245.846 1.00 0.00 C +ATOM 32 CA VAL A 32 278.600 233.427 243.209 1.00 0.00 C +ATOM 33 CA ALA A 33 274.948 234.318 243.834 1.00 0.00 C +ATOM 34 CA ARG A 34 272.168 232.756 245.919 1.00 0.00 C +ATOM 35 CA SER A 35 271.301 229.063 245.565 1.00 0.00 C +ATOM 36 CA SER A 36 271.399 226.820 248.644 1.00 0.00 C +ATOM 37 CA SER A 37 268.082 224.957 248.842 1.00 0.00 C +ATOM 38 CA GLY A 38 264.782 225.447 250.683 1.00 0.00 C +ATOM 39 CA GLN A 39 265.503 224.361 254.263 1.00 0.00 C +ATOM 40 CA THR A 40 268.821 222.898 255.434 1.00 0.00 C +ATOM 41 CA ALA A 41 270.605 220.973 258.195 1.00 0.00 C +ATOM 42 CA ALA A 42 268.068 220.011 260.870 1.00 0.00 C +ATOM 43 CA SER A 43 265.557 222.776 261.622 1.00 0.00 C +ATOM 44 CA GLU A 44 266.711 226.353 260.996 1.00 0.00 C +ATOM 45 CA CYS A 45 266.024 230.089 261.283 1.00 0.00 C +ATOM 46 CA GLY A 46 263.983 232.137 258.801 1.00 0.00 C +ATOM 47 CA GLY A 47 263.151 229.934 255.806 1.00 0.00 C +ATOM 48 CA ALA A 48 259.662 230.717 254.492 1.00 0.00 C +ATOM 49 CA ARG A 49 257.648 231.947 257.483 1.00 0.00 C +ATOM 50 CA GLY A 50 256.137 229.364 259.840 1.00 0.00 C +ATOM 51 CA LEU A 51 256.151 229.553 263.646 1.00 0.00 C +ATOM 52 CA VAL A 52 253.401 230.391 266.145 1.00 0.00 C +ATOM 53 CA GLY A 53 249.927 231.938 266.388 1.00 0.00 C +ATOM 54 CA GLU A 54 246.925 232.319 264.074 1.00 0.00 C +ATOM 55 CA GLY A 55 246.489 235.959 263.037 1.00 0.00 C +ATOM 56 CA ARG A 56 243.023 237.284 262.172 1.00 0.00 C +ATOM 57 CA VAL A 57 241.405 240.625 263.031 1.00 0.00 C +ATOM 58 CA SER A 58 239.297 243.793 263.212 1.00 0.00 C +ATOM 59 CA SER A 59 239.143 245.902 260.043 1.00 0.00 C +ATOM 60 CA ASN A 60 235.549 247.126 259.733 1.00 0.00 C +ATOM 61 CA GLY A 61 232.700 249.173 258.245 1.00 0.00 C +ATOM 62 CA LEU A 62 229.039 250.123 257.784 1.00 0.00 C +ATOM 63 CA ALA A 63 225.818 249.899 259.806 1.00 0.00 C +ATOM 64 CA SER A 64 223.261 252.220 258.194 1.00 0.00 C +ATOM 65 CA ARG A 65 219.577 252.667 257.331 1.00 0.00 C +ATOM 66 CA LEU A 66 218.700 252.099 253.667 1.00 0.00 C +ATOM 67 CA PRO A 67 220.590 252.762 250.426 1.00 0.00 C +ATOM 68 CA LEU A 68 219.962 256.380 249.410 1.00 0.00 C +ATOM 69 CA PRO A 69 217.767 259.401 248.652 1.00 0.00 C +ATOM 70 CA PRO A 70 217.691 259.876 244.873 1.00 0.00 C +ATOM 71 CA LYS A 71 218.106 257.014 242.392 1.00 0.00 C +ATOM 72 CA PRO A 72 217.927 253.412 241.164 1.00 0.00 C +ATOM 73 CA LEU A 73 219.412 250.025 240.248 1.00 0.00 C +ATOM 74 CA ARG A 74 222.779 250.658 238.580 1.00 0.00 C +ATOM 75 CA PRO A 75 224.901 247.496 238.472 1.00 0.00 C +ATOM 76 CA ALA A 76 228.688 247.415 238.062 1.00 0.00 C +ATOM 77 CA PRO A 77 231.826 248.798 236.402 1.00 0.00 C +ATOM 78 CA ALA A 78 232.218 252.574 236.720 1.00 0.00 C +ATOM 79 CA ASP A 79 230.156 255.771 236.938 1.00 0.00 C +ATOM 80 CA ARG A 80 231.375 259.185 238.109 1.00 0.00 C +ATOM 81 CA CYS A 81 230.895 262.624 239.678 1.00 0.00 C +ATOM 82 CA ARG A 82 234.077 264.708 239.457 1.00 0.00 C +ATOM 83 CA SER A 83 233.619 267.201 236.612 1.00 0.00 C +ATOM 84 CA ARG A 84 236.469 269.729 236.551 1.00 0.00 C +ATOM 85 CA MET A 85 239.939 271.120 237.285 1.00 0.00 C +ATOM 86 CA PRO A 86 241.210 274.118 239.263 1.00 0.00 C +ATOM 87 CA PRO A 87 243.337 273.889 242.416 1.00 0.00 C +ATOM 88 CA SER A 88 245.163 270.546 242.462 1.00 0.00 C +ATOM 89 CA LEU A 89 243.522 267.859 244.607 1.00 0.00 C +ATOM 90 CA ARG A 90 240.874 265.124 244.748 1.00 0.00 C +ATOM 91 CA SER A 91 239.790 262.309 247.075 1.00 0.00 C +ATOM 92 CA ARG A 92 241.158 262.425 250.629 1.00 0.00 C +ATOM 93 CA ARG A 93 242.706 261.511 253.988 1.00 0.00 C +ATOM 94 CA LEU A 94 241.106 258.388 255.472 1.00 0.00 C +ATOM 95 CA SER A 95 239.669 255.755 257.821 1.00 0.00 C +ATOM 96 CA PRO A 96 237.788 254.786 260.990 1.00 0.00 C +ATOM 97 CA GLY A 97 234.655 255.046 263.141 1.00 0.00 C +ATOM 98 CA LEU A 98 234.307 253.948 266.773 1.00 0.00 C +ATOM 99 CA PRO A 99 231.664 252.019 268.725 1.00 0.00 C +ATOM 100 CA THR A 100 228.195 252.172 267.158 1.00 0.00 C +ATOM 101 CA VAL A 101 224.886 252.997 268.857 1.00 0.00 C +ATOM 102 CA ALA A 102 225.409 256.382 270.525 1.00 0.00 C +ATOM 103 CA PRO A 103 228.348 258.324 269.072 1.00 0.00 C +ATOM 104 CA LEU A 104 228.216 258.203 265.267 1.00 0.00 C +ATOM 105 CA ALA A 105 225.949 259.472 262.480 1.00 0.00 C +ATOM 106 CA THR A 106 226.431 262.632 260.406 1.00 0.00 C +ATOM 107 CA ARG A 107 228.263 263.274 257.128 1.00 0.00 C +ATOM 108 CA HIS A 108 232.065 263.262 256.874 1.00 0.00 C +ATOM 109 CA LEU A 109 235.665 263.720 258.033 1.00 0.00 C +ATOM 110 CA LEU A 110 238.457 265.290 260.097 1.00 0.00 C +ATOM 111 CA PRO A 111 239.539 268.938 259.897 1.00 0.00 C +ATOM 112 CA ALA A 112 239.732 270.290 263.454 1.00 0.00 C +ATOM 113 CA ALA A 113 236.791 271.692 265.430 1.00 0.00 C +ATOM 114 CA GLY A 114 233.384 273.061 264.414 1.00 0.00 C +ATOM 115 CA LEU A 115 232.632 272.116 260.800 1.00 0.00 C +ATOM 116 CA PRO A 116 231.359 272.498 257.230 1.00 0.00 C +ATOM 117 CA SER A 117 232.692 270.977 254.001 1.00 0.00 C +ATOM 118 CA PRO A 118 231.185 271.546 250.548 1.00 0.00 C +ATOM 119 CA LYS A 119 227.569 272.630 250.035 1.00 0.00 C +ATOM 120 CA LYS A 120 224.883 273.895 247.647 1.00 0.00 C +ATOM 121 CA ILE A 121 221.606 272.889 245.985 1.00 0.00 C +ATOM 122 CA ARG A 122 218.625 275.027 244.956 1.00 0.00 C +ATOM 123 CA GLU A 123 217.228 275.779 241.492 1.00 0.00 C +ATOM 124 CA LYS A 124 213.768 276.561 240.102 1.00 0.00 C +ATOM 125 CA ARG A 125 210.148 277.054 239.020 1.00 0.00 C +ATOM 126 CA LEU A 126 208.147 280.008 237.685 1.00 0.00 C +ATOM 127 CA LYS A 127 209.052 283.124 239.682 1.00 0.00 C +ATOM 128 CA ARG A 128 209.660 284.177 243.293 1.00 0.00 C +ATOM 129 CA ARG A 129 208.376 287.102 245.369 1.00 0.00 C +ATOM 130 CA GLU A 130 207.281 285.981 248.841 1.00 0.00 C +ATOM 131 CA ALA A 131 203.608 285.018 249.163 1.00 0.00 C +ATOM 132 CA GLU A 132 200.079 286.369 248.678 1.00 0.00 C +ATOM 133 CA GLU A 133 198.879 284.999 245.332 1.00 0.00 C +ATOM 134 CA LYS A 134 195.579 284.789 243.439 1.00 0.00 C +ATOM 135 CA SER A 135 192.365 282.771 243.097 1.00 0.00 C +ATOM 136 CA ARG A 136 190.980 279.538 241.633 1.00 0.00 C +ATOM 137 CA GLY A 137 190.582 277.690 238.325 1.00 0.00 C +ATOM 138 CA ARG A 138 187.671 275.765 236.796 1.00 0.00 C +ATOM 139 CA LEU A 139 187.768 272.531 234.784 1.00 0.00 C +ATOM 140 CA THR A 140 185.794 270.235 232.472 1.00 0.00 C +ATOM 141 CA PHE A 141 185.662 266.441 232.145 1.00 0.00 C +TER 142 PHE A 141 +END diff --git a/Plants/Q84MR0/Q84MR0.dcd b/Plants/Q84MR0/Q84MR0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..9f56a427d1d0fdb5a3a10968a0df80e598d45a4e --- /dev/null +++ b/Plants/Q84MR0/Q84MR0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:b8f7fc70a803d8840f248de42bf7facaaa346f3cf2ba271624667105f4e2f9f0 +size 5960276 diff --git a/Plants/Q84MR0/top.pdb b/Plants/Q84MR0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..f796a1eb11224d4c2e5ff47d12ce61725c0bd6c9 --- /dev/null +++ b/Plants/Q84MR0/top.pdb @@ -0,0 +1,47 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 280.527 230.500 240.493 1.00 0.00 C +ATOM 2 CA PRO A 2 283.982 230.762 242.075 1.00 0.00 C +ATOM 3 CA PRO A 3 286.239 227.758 242.707 1.00 0.00 C +ATOM 4 CA ASN A 4 284.883 225.492 245.454 1.00 0.00 C +ATOM 5 CA LEU A 5 281.442 226.468 246.768 1.00 0.00 C +ATOM 6 CA THR A 6 278.210 228.225 247.759 1.00 0.00 C +ATOM 7 CA GLY A 7 274.700 229.001 246.497 1.00 0.00 C +ATOM 8 CA MET A 8 274.850 230.973 243.240 1.00 0.00 C +ATOM 9 CA GLU A 9 271.918 232.341 241.229 1.00 0.00 C +ATOM 10 CA VAL A 10 270.485 235.845 241.661 1.00 0.00 C +ATOM 11 CA ALA A 11 266.965 237.239 242.087 1.00 0.00 C +ATOM 12 CA GLU A 12 267.247 240.980 242.750 1.00 0.00 C +ATOM 13 CA ARG A 13 265.962 244.566 242.698 1.00 0.00 C +ATOM 14 CA GLU A 14 263.210 246.676 244.277 1.00 0.00 C +ATOM 15 CA PRO A 15 259.627 247.870 244.775 1.00 0.00 C +ATOM 16 CA GLY A 16 258.437 248.482 248.343 1.00 0.00 C +ATOM 17 CA PRO A 17 256.484 249.161 251.543 1.00 0.00 C +ATOM 18 CA THR A 18 254.203 246.310 252.632 1.00 0.00 C +ATOM 19 CA VAL A 19 253.103 244.212 249.648 1.00 0.00 C +ATOM 20 CA GLU A 20 250.197 241.944 250.612 1.00 0.00 C +ATOM 21 CA PRO A 21 246.812 242.192 252.343 1.00 0.00 C +ATOM 22 CA PRO A 22 246.097 244.705 255.116 1.00 0.00 C +ATOM 23 CA ARG A 23 245.917 246.159 258.633 1.00 0.00 C +ATOM 24 CA ASP A 24 244.341 249.627 258.559 1.00 0.00 C +ATOM 25 CA GLY A 25 243.970 253.350 259.278 1.00 0.00 C +ATOM 26 CA GLU A 26 243.594 256.135 261.850 1.00 0.00 C +ATOM 27 CA GLU A 27 242.104 259.094 263.733 1.00 0.00 C +ATOM 28 CA MET A 28 239.578 261.428 262.094 1.00 0.00 C +ATOM 29 CA LYS A 29 236.637 263.365 260.639 1.00 0.00 C +ATOM 30 CA GLU A 30 233.832 261.390 258.982 1.00 0.00 C +ATOM 31 CA GLY A 31 232.399 258.841 256.540 1.00 0.00 C +ATOM 32 CA LYS A 32 232.237 259.640 252.818 1.00 0.00 C +ATOM 33 CA GLU A 33 229.394 260.922 250.631 1.00 0.00 C +ATOM 34 CA GLU A 34 227.611 258.715 248.087 1.00 0.00 C +ATOM 35 CA GLU A 35 224.739 260.575 246.413 1.00 0.00 C +ATOM 36 CA LEU A 36 222.691 263.788 246.464 1.00 0.00 C +ATOM 37 CA VAL A 37 221.680 264.260 250.107 1.00 0.00 C +ATOM 38 CA ALA A 38 224.463 265.586 252.347 1.00 0.00 C +ATOM 39 CA ASP A 39 225.216 269.243 251.592 1.00 0.00 C +ATOM 40 CA MET A 40 223.437 272.451 250.564 1.00 0.00 C +ATOM 41 CA PRO A 41 224.749 275.512 248.712 1.00 0.00 C +ATOM 42 CA PHE A 42 226.280 278.846 247.684 1.00 0.00 C +ATOM 43 CA PHE A 43 229.551 279.372 249.566 1.00 0.00 C +TER 44 PHE A 43 +END diff --git a/Plants/Q84MX9/Q84MX9.dcd b/Plants/Q84MX9/Q84MX9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..67fd87671e5777fdcd8659dc413bd0cfe4442cea --- /dev/null +++ b/Plants/Q84MX9/Q84MX9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:a060d0e65d96f0ad7d02f206537ef857859c9ee3b555bc6cba1bdc00d477793a +size 12080276 diff --git a/Plants/Q84MX9/top.pdb b/Plants/Q84MX9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..bd0dc8583067e76c1b3352ee68fb9c7fbd2789ed --- /dev/null +++ b/Plants/Q84MX9/top.pdb @@ -0,0 +1,98 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 245.956 252.830 238.266 1.00 0.00 C +ATOM 2 CA VAL A 2 249.004 253.683 236.145 1.00 0.00 C +ATOM 3 CA ALA A 3 251.504 253.199 233.310 1.00 0.00 C +ATOM 4 CA GLY A 4 254.292 253.447 230.726 1.00 0.00 C +ATOM 5 CA VAL A 5 257.849 253.332 229.365 1.00 0.00 C +ATOM 6 CA ALA A 6 260.113 255.925 227.731 1.00 0.00 C +ATOM 7 CA SER A 7 261.854 258.737 229.621 1.00 0.00 C +ATOM 8 CA SER A 8 259.861 260.300 232.467 1.00 0.00 C +ATOM 9 CA SER A 9 258.293 262.264 235.331 1.00 0.00 C +ATOM 10 CA SER A 10 255.314 263.614 237.286 1.00 0.00 C +ATOM 11 CA SER A 11 256.125 266.292 239.872 1.00 0.00 C +ATOM 12 CA THR A 12 256.860 267.296 243.473 1.00 0.00 C +ATOM 13 CA LEU A 13 256.291 268.939 246.863 1.00 0.00 C +ATOM 14 CA PRO A 14 254.069 270.746 249.376 1.00 0.00 C +ATOM 15 CA SER A 15 254.367 274.533 249.083 1.00 0.00 C +ATOM 16 CA SER A 16 254.389 276.282 252.467 1.00 0.00 C +ATOM 17 CA PRO A 17 257.557 277.146 254.399 1.00 0.00 C +ATOM 18 CA LEU A 18 260.507 278.192 252.227 1.00 0.00 C +ATOM 19 CA SER A 19 261.022 275.943 249.195 1.00 0.00 C +ATOM 20 CA PRO A 20 261.415 272.230 249.953 1.00 0.00 C +ATOM 21 CA GLY A 21 264.083 269.514 250.124 1.00 0.00 C +ATOM 22 CA GLY A 22 265.621 268.809 246.711 1.00 0.00 C +ATOM 23 CA GLY A 23 268.854 270.625 245.836 1.00 0.00 C +ATOM 24 CA GLY A 24 272.060 268.711 246.594 1.00 0.00 C +ATOM 25 CA GLY A 25 273.554 267.310 249.807 1.00 0.00 C +ATOM 26 CA GLY A 26 274.414 263.600 249.895 1.00 0.00 C +ATOM 27 CA CYS A 27 273.345 261.293 252.733 1.00 0.00 C +ATOM 28 CA SER A 28 274.288 257.749 251.702 1.00 0.00 C +ATOM 29 CA VAL A 29 271.205 255.538 251.346 1.00 0.00 C +ATOM 30 CA ALA A 30 268.395 256.527 248.970 1.00 0.00 C +ATOM 31 CA TYR A 31 266.631 253.975 246.758 1.00 0.00 C +ATOM 32 CA SER A 32 265.176 251.450 244.304 1.00 0.00 C +ATOM 33 CA SER A 33 264.595 247.840 243.232 1.00 0.00 C +ATOM 34 CA ALA A 34 264.836 244.086 243.839 1.00 0.00 C +ATOM 35 CA ILE A 35 265.802 241.805 246.733 1.00 0.00 C +ATOM 36 CA LEU A 36 267.219 238.419 247.754 1.00 0.00 C +ATOM 37 CA PRO A 37 267.331 235.012 249.457 1.00 0.00 C +ATOM 38 CA SER A 38 267.148 231.226 249.072 1.00 0.00 C +ATOM 39 CA GLY A 39 266.378 228.596 251.718 1.00 0.00 C +ATOM 40 CA PRO A 40 267.167 226.804 254.986 1.00 0.00 C +ATOM 41 CA SER A 41 264.920 226.398 258.036 1.00 0.00 C +ATOM 42 CA LEU A 42 261.914 226.258 260.373 1.00 0.00 C +ATOM 43 CA PRO A 43 258.275 227.373 260.194 1.00 0.00 C +ATOM 44 CA VAL A 44 257.414 229.623 263.146 1.00 0.00 C +ATOM 45 CA GLU A 45 256.273 233.257 263.089 1.00 0.00 C +ATOM 46 CA GLU A 46 253.143 234.725 261.486 1.00 0.00 C +ATOM 47 CA ASP A 47 250.257 232.665 260.091 1.00 0.00 C +ATOM 48 CA ARG A 48 248.734 231.775 256.714 1.00 0.00 C +ATOM 49 CA SER A 49 246.263 234.212 255.142 1.00 0.00 C +ATOM 50 CA GLY A 50 246.821 235.866 251.755 1.00 0.00 C +ATOM 51 CA ARG A 51 246.777 238.478 248.981 1.00 0.00 C +ATOM 52 CA PRO A 52 249.066 240.580 246.777 1.00 0.00 C +ATOM 53 CA ASP A 53 247.690 243.450 244.683 1.00 0.00 C +ATOM 54 CA PRO A 54 245.185 245.750 242.964 1.00 0.00 C +ATOM 55 CA MET A 55 241.793 245.014 241.393 1.00 0.00 C +ATOM 56 CA ALA A 56 238.193 245.833 242.332 1.00 0.00 C +ATOM 57 CA THR A 57 236.743 242.712 243.968 1.00 0.00 C +ATOM 58 CA THR A 58 235.053 239.298 243.973 1.00 0.00 C +ATOM 59 CA GLU A 59 236.352 235.998 245.366 1.00 0.00 C +ATOM 60 CA ARG A 60 239.135 236.500 247.918 1.00 0.00 C +ATOM 61 CA THR A 61 240.447 239.396 250.019 1.00 0.00 C +ATOM 62 CA ALA A 62 239.622 239.473 253.738 1.00 0.00 C +ATOM 63 CA GLY A 63 241.376 238.139 256.845 1.00 0.00 C +ATOM 64 CA PRO A 64 241.020 238.552 260.616 1.00 0.00 C +ATOM 65 CA PRO A 65 243.350 236.169 262.464 1.00 0.00 C +ATOM 66 CA ARG A 66 242.715 233.902 265.459 1.00 0.00 C +ATOM 67 CA SER A 67 242.065 232.486 268.936 1.00 0.00 C +ATOM 68 CA GLY A 68 239.145 234.547 270.257 1.00 0.00 C +ATOM 69 CA SER A 69 236.385 236.330 268.329 1.00 0.00 C +ATOM 70 CA ASP A 70 235.627 237.347 264.736 1.00 0.00 C +ATOM 71 CA SER A 71 233.160 236.774 261.890 1.00 0.00 C +ATOM 72 CA GLY A 72 233.430 239.880 259.701 1.00 0.00 C +ATOM 73 CA GLU A 73 234.290 242.717 262.094 1.00 0.00 C +ATOM 74 CA ASP A 74 231.077 243.912 263.757 1.00 0.00 C +ATOM 75 CA HIS A 75 229.444 246.577 261.578 1.00 0.00 C +ATOM 76 CA GLY A 76 226.844 246.250 258.812 1.00 0.00 C +ATOM 77 CA GLY A 77 224.980 249.567 258.608 1.00 0.00 C +ATOM 78 CA HIS A 78 226.740 252.011 256.274 1.00 0.00 C +ATOM 79 CA GLN A 79 229.908 252.740 254.287 1.00 0.00 C +ATOM 80 CA GLN A 80 228.932 254.676 251.154 1.00 0.00 C +ATOM 81 CA ARG A 81 226.825 257.596 249.909 1.00 0.00 C +ATOM 82 CA TRP A 82 225.721 260.587 247.823 1.00 0.00 C +ATOM 83 CA GLN A 83 226.447 262.921 244.901 1.00 0.00 C +ATOM 84 CA PRO A 84 229.690 264.228 243.388 1.00 0.00 C +ATOM 85 CA PHE A 85 232.894 263.656 245.369 1.00 0.00 C +ATOM 86 CA SER A 86 236.420 264.646 246.421 1.00 0.00 C +ATOM 87 CA TYR A 87 239.680 263.283 247.846 1.00 0.00 C +ATOM 88 CA ALA A 88 239.857 259.547 247.122 1.00 0.00 C +ATOM 89 CA SER A 89 242.761 257.264 248.057 1.00 0.00 C +ATOM 90 CA ALA A 90 244.062 254.331 246.003 1.00 0.00 C +ATOM 91 CA SER A 91 245.991 251.179 246.931 1.00 0.00 C +ATOM 92 CA SER A 92 248.421 249.324 249.204 1.00 0.00 C +ATOM 93 CA PRO A 93 251.660 249.272 251.210 1.00 0.00 C +ATOM 94 CA GLN A 94 254.269 251.136 249.152 1.00 0.00 C +TER 95 GLN A 94 +END diff --git a/Plants/Q84N45/Q84N45.dcd b/Plants/Q84N45/Q84N45.dcd new file mode 100644 index 0000000000000000000000000000000000000000..2085d060f4b9e61f79a60b774507e9039ea12212 --- /dev/null +++ b/Plants/Q84N45/Q84N45.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:472283f99f816fe98d280a4765e481df4fd37e606007a27b57260d7db05e4720 +size 12920276 diff --git a/Plants/Q84N45/top.pdb b/Plants/Q84N45/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..53ac62241940769aecf31139c48583b40db89cc4 --- /dev/null +++ b/Plants/Q84N45/top.pdb @@ -0,0 +1,105 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 244.640 260.812 221.935 1.00 0.00 C +ATOM 2 CA GLU A 2 246.319 263.476 219.790 1.00 0.00 C +ATOM 3 CA GLY A 3 246.511 266.698 221.813 1.00 0.00 C +ATOM 4 CA TYR A 4 248.894 266.431 224.774 1.00 0.00 C +ATOM 5 CA GLY A 5 250.126 262.849 225.185 1.00 0.00 C +ATOM 6 CA ASN A 6 250.712 260.430 228.069 1.00 0.00 C +ATOM 7 CA HIS A 7 250.307 260.922 231.826 1.00 0.00 C +ATOM 8 CA GLN A 8 250.486 261.223 235.620 1.00 0.00 C +ATOM 9 CA HIS A 9 250.243 264.044 238.169 1.00 0.00 C +ATOM 10 CA HIS A 10 247.802 265.997 240.347 1.00 0.00 C +ATOM 11 CA ASN A 11 248.997 268.851 242.570 1.00 0.00 C +ATOM 12 CA VAL A 12 249.462 267.265 246.002 1.00 0.00 C +ATOM 13 CA ASP A 13 250.045 268.696 249.485 1.00 0.00 C +ATOM 14 CA GLU A 14 248.630 266.281 252.068 1.00 0.00 C +ATOM 15 CA TYR A 15 250.806 266.520 255.186 1.00 0.00 C +ATOM 16 CA GLY A 16 253.108 265.281 257.958 1.00 0.00 C +ATOM 17 CA ASN A 17 256.002 264.514 260.314 1.00 0.00 C +ATOM 18 CA PRO A 18 256.009 263.148 263.870 1.00 0.00 C +ATOM 19 CA LEU A 19 253.998 263.215 267.105 1.00 0.00 C +ATOM 20 CA PRO A 20 255.989 261.291 269.722 1.00 0.00 C +ATOM 21 CA VAL A 21 255.369 262.840 273.148 1.00 0.00 C +ATOM 22 CA GLY A 22 252.845 262.330 275.955 1.00 0.00 C +ATOM 23 CA TYR A 23 253.902 264.215 279.093 1.00 0.00 C +ATOM 24 CA GLY A 24 254.368 265.752 282.548 1.00 0.00 C +ATOM 25 CA GLU A 25 256.465 266.033 285.717 1.00 0.00 C +ATOM 26 CA GLY A 26 258.902 268.961 285.797 1.00 0.00 C +ATOM 27 CA TYR A 27 258.052 272.669 285.995 1.00 0.00 C +ATOM 28 CA GLY A 28 254.787 274.564 286.510 1.00 0.00 C +ATOM 29 CA HIS A 29 254.634 275.136 290.274 1.00 0.00 C +ATOM 30 CA GLN A 30 252.064 273.492 292.556 1.00 0.00 C +ATOM 31 CA ASN A 31 249.500 271.342 294.378 1.00 0.00 C +ATOM 32 CA MET A 32 247.612 268.264 293.162 1.00 0.00 C +ATOM 33 CA GLN A 33 248.508 264.608 292.571 1.00 0.00 C +ATOM 34 CA ARG A 34 249.788 263.754 289.085 1.00 0.00 C +ATOM 35 CA PRO A 35 250.351 261.115 286.395 1.00 0.00 C +ATOM 36 CA GLY A 36 247.006 260.118 284.869 1.00 0.00 C +ATOM 37 CA GLU A 37 244.247 259.233 282.395 1.00 0.00 C +ATOM 38 CA TYR A 38 242.411 262.073 280.640 1.00 0.00 C +ATOM 39 CA TYR A 39 243.221 264.601 277.907 1.00 0.00 C +ATOM 40 CA GLY A 40 242.542 263.050 274.493 1.00 0.00 C +ATOM 41 CA ASN A 41 241.258 260.457 272.014 1.00 0.00 C +ATOM 42 CA GLN A 42 241.431 258.057 269.060 1.00 0.00 C +ATOM 43 CA GLY A 43 241.702 258.652 265.306 1.00 0.00 C +ATOM 44 CA TYR A 44 240.637 259.156 261.683 1.00 0.00 C +ATOM 45 CA GLY A 45 238.503 261.953 260.219 1.00 0.00 C +ATOM 46 CA GLY A 46 235.999 261.176 257.454 1.00 0.00 C +ATOM 47 CA HIS A 47 236.781 262.742 254.070 1.00 0.00 C +ATOM 48 CA GLN A 48 240.339 263.293 252.824 1.00 0.00 C +ATOM 49 CA HIS A 49 241.668 263.604 249.267 1.00 0.00 C +ATOM 50 CA GLY A 50 242.750 266.850 247.591 1.00 0.00 C +ATOM 51 CA ALA A 51 239.778 268.684 246.068 1.00 0.00 C +ATOM 52 CA TYR A 52 238.361 271.328 243.720 1.00 0.00 C +ATOM 53 CA SER A 53 236.836 269.722 240.620 1.00 0.00 C +ATOM 54 CA GLY A 54 233.204 269.343 239.534 1.00 0.00 C +ATOM 55 CA PRO A 55 232.511 266.247 237.425 1.00 0.00 C +ATOM 56 CA GLY A 56 235.329 263.735 236.914 1.00 0.00 C +ATOM 57 CA TYR A 57 235.286 262.696 233.248 1.00 0.00 C +ATOM 58 CA GLN A 58 237.941 262.533 230.521 1.00 0.00 C +ATOM 59 CA GLN A 59 238.928 258.860 230.300 1.00 0.00 C +ATOM 60 CA ASP A 60 238.975 255.502 228.500 1.00 0.00 C +ATOM 61 CA TYR A 61 239.708 251.981 229.758 1.00 0.00 C +ATOM 62 CA GLY A 62 240.802 248.900 231.714 1.00 0.00 C +ATOM 63 CA SER A 63 238.930 246.017 233.358 1.00 0.00 C +ATOM 64 CA GLY A 64 236.515 245.864 236.301 1.00 0.00 C +ATOM 65 CA PRO A 65 233.844 246.143 239.004 1.00 0.00 C +ATOM 66 CA ARG A 66 231.125 245.255 241.520 1.00 0.00 C +ATOM 67 CA LEU A 67 228.995 242.612 243.250 1.00 0.00 C +ATOM 68 CA GLN A 68 229.826 240.042 245.936 1.00 0.00 C +ATOM 69 CA ARG A 69 232.319 239.071 248.650 1.00 0.00 C +ATOM 70 CA SER A 70 233.594 235.540 248.005 1.00 0.00 C +ATOM 71 CA GLY A 71 235.281 232.267 248.986 1.00 0.00 C +ATOM 72 CA SER A 72 237.034 230.282 251.725 1.00 0.00 C +ATOM 73 CA SER A 73 239.895 227.983 250.706 1.00 0.00 C +ATOM 74 CA THR A 74 243.195 226.275 249.861 1.00 0.00 C +ATOM 75 CA SER A 75 243.536 225.296 246.194 1.00 0.00 C +ATOM 76 CA SER A 76 246.044 222.680 245.020 1.00 0.00 C +ATOM 77 CA GLU A 77 249.555 222.759 243.543 1.00 0.00 C +ATOM 78 CA ASP A 78 252.157 225.338 242.496 1.00 0.00 C +ATOM 79 CA ASP A 79 255.410 223.866 241.167 1.00 0.00 C +ATOM 80 CA GLY A 80 258.001 222.581 243.647 1.00 0.00 C +ATOM 81 CA TYR A 81 260.738 220.005 243.026 1.00 0.00 C +ATOM 82 CA GLY A 82 264.433 220.738 242.455 1.00 0.00 C +ATOM 83 CA GLY A 83 265.311 218.983 239.190 1.00 0.00 C +ATOM 84 CA ARG A 84 263.244 217.989 236.148 1.00 0.00 C +ATOM 85 CA ARG A 85 262.524 214.981 233.923 1.00 0.00 C +ATOM 86 CA LYS A 86 265.031 212.135 233.558 1.00 0.00 C +ATOM 87 CA LYS A 87 267.214 210.588 230.845 1.00 0.00 C +ATOM 88 CA GLY A 88 270.832 211.557 230.148 1.00 0.00 C +ATOM 89 CA LEU A 89 274.290 212.950 230.933 1.00 0.00 C +ATOM 90 CA LYS A 90 274.987 214.680 234.256 1.00 0.00 C +ATOM 91 CA ASN A 91 273.479 217.714 235.999 1.00 0.00 C +ATOM 92 CA ARG A 92 270.853 219.416 233.826 1.00 0.00 C +ATOM 93 CA ILE A 93 268.882 220.907 230.926 1.00 0.00 C +ATOM 94 CA MET A 94 268.565 224.676 230.463 1.00 0.00 C +ATOM 95 CA GLU A 95 266.216 227.407 229.221 1.00 0.00 C +ATOM 96 CA ASN A 96 268.247 230.630 229.204 1.00 0.00 C +ATOM 97 CA LEU A 97 267.775 233.484 226.723 1.00 0.00 C +ATOM 98 CA PRO A 98 270.511 235.768 225.378 1.00 0.00 C +ATOM 99 CA GLY A 99 273.419 236.716 227.650 1.00 0.00 C +ATOM 100 CA ARG A 100 276.187 235.701 230.064 1.00 0.00 C +ATOM 101 CA ARG A 101 277.616 235.542 233.592 1.00 0.00 C +TER 102 ARG A 101 +END diff --git a/Plants/Q84NK9/Q84NK9.dcd b/Plants/Q84NK9/Q84NK9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..d42eb25b27c1525d78b3809047c4c5ea15a882ea --- /dev/null +++ b/Plants/Q84NK9/Q84NK9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:b23acef0d40a5269009be2f439c929b673afbf6f4136117096138a3fcc353a6c +size 15320276 diff --git a/Plants/Q84NK9/top.pdb b/Plants/Q84NK9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..cc42b94e38556ac620c2a3257ec5ae79c5fdc825 --- /dev/null +++ b/Plants/Q84NK9/top.pdb @@ -0,0 +1,125 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 270.783 246.096 230.741 1.00 0.00 C +ATOM 2 CA PRO A 2 270.221 245.983 226.974 1.00 0.00 C +ATOM 3 CA PRO A 3 268.988 245.404 223.416 1.00 0.00 C +ATOM 4 CA THR A 4 265.795 245.570 221.343 1.00 0.00 C +ATOM 5 CA GLY A 5 262.567 247.213 220.161 1.00 0.00 C +ATOM 6 CA ARG A 6 261.313 250.600 221.372 1.00 0.00 C +ATOM 7 CA GLU A 7 259.232 251.207 224.505 1.00 0.00 C +ATOM 8 CA GLY A 8 257.603 254.236 226.146 1.00 0.00 C +ATOM 9 CA ALA A 9 255.046 256.921 227.020 1.00 0.00 C +ATOM 10 CA ALA A 10 252.023 255.559 228.897 1.00 0.00 C +ATOM 11 CA ALA A 11 250.522 252.160 229.737 1.00 0.00 C +ATOM 12 CA GLY A 12 247.664 250.468 227.871 1.00 0.00 C +ATOM 13 CA LEU A 13 244.024 250.608 228.989 1.00 0.00 C +ATOM 14 CA VAL A 14 241.644 251.618 231.787 1.00 0.00 C +ATOM 15 CA ALA A 15 240.296 248.861 234.045 1.00 0.00 C +ATOM 16 CA ALA A 16 239.139 245.462 235.319 1.00 0.00 C +ATOM 17 CA PRO A 17 236.982 243.948 238.070 1.00 0.00 C +ATOM 18 CA ASN A 18 236.840 240.237 238.922 1.00 0.00 C +ATOM 19 CA SER A 19 235.809 238.860 242.322 1.00 0.00 C +ATOM 20 CA ALA A 20 235.206 241.600 244.901 1.00 0.00 C +ATOM 21 CA ALA A 21 232.389 243.839 243.652 1.00 0.00 C +ATOM 22 CA SER A 22 228.727 244.793 244.099 1.00 0.00 C +ATOM 23 CA ARG A 23 225.432 243.109 245.004 1.00 0.00 C +ATOM 24 CA ARG A 24 222.363 240.936 245.619 1.00 0.00 C +ATOM 25 CA HIS A 25 219.442 241.694 243.292 1.00 0.00 C +ATOM 26 CA THR A 26 218.215 241.283 239.709 1.00 0.00 C +ATOM 27 CA GLY A 27 215.341 238.787 239.877 1.00 0.00 C +ATOM 28 CA SER A 28 214.232 236.784 236.831 1.00 0.00 C +ATOM 29 CA ALA A 29 213.351 233.258 235.688 1.00 0.00 C +ATOM 30 CA THR A 30 210.360 232.944 233.348 1.00 0.00 C +ATOM 31 CA ARG A 31 210.724 235.775 230.825 1.00 0.00 C +ATOM 32 CA ARG A 32 214.194 235.797 229.252 1.00 0.00 C +ATOM 33 CA SER A 33 216.228 238.771 228.015 1.00 0.00 C +ATOM 34 CA THR A 34 218.553 241.789 228.068 1.00 0.00 C +ATOM 35 CA PRO A 35 221.834 240.469 229.486 1.00 0.00 C +ATOM 36 CA VAL A 36 223.881 237.915 231.437 1.00 0.00 C +ATOM 37 CA GLU A 37 226.436 236.896 234.073 1.00 0.00 C +ATOM 38 CA ALA A 38 229.880 236.155 232.623 1.00 0.00 C +ATOM 39 CA ARG A 39 231.593 233.630 234.904 1.00 0.00 C +ATOM 40 CA ARG A 40 232.466 235.086 238.315 1.00 0.00 C +ATOM 41 CA CYS A 41 229.381 235.999 240.356 1.00 0.00 C +ATOM 42 CA ARG A 42 225.579 235.798 240.493 1.00 0.00 C +ATOM 43 CA ARG A 43 224.066 239.181 239.607 1.00 0.00 C +ATOM 44 CA GLN A 44 226.640 241.870 238.797 1.00 0.00 C +ATOM 45 CA GLY A 45 226.746 245.564 237.869 1.00 0.00 C +ATOM 46 CA GLU A 46 230.258 247.039 237.953 1.00 0.00 C +ATOM 47 CA ARG A 47 232.933 249.657 238.665 1.00 0.00 C +ATOM 48 CA VAL A 48 235.711 251.539 240.469 1.00 0.00 C +ATOM 49 CA PRO A 49 237.084 255.051 239.921 1.00 0.00 C +ATOM 50 CA PRO A 50 236.535 258.398 241.656 1.00 0.00 C +ATOM 51 CA LEU A 51 235.105 261.872 241.022 1.00 0.00 C +ATOM 52 CA LEU A 52 235.352 265.154 239.103 1.00 0.00 C +ATOM 53 CA ASP A 53 236.707 268.020 241.217 1.00 0.00 C +ATOM 54 CA PRO A 54 240.245 267.355 242.465 1.00 0.00 C +ATOM 55 CA GLY A 55 242.311 264.999 244.631 1.00 0.00 C +ATOM 56 CA ARG A 56 244.708 264.561 247.560 1.00 0.00 C +ATOM 57 CA ALA A 57 245.892 261.155 248.791 1.00 0.00 C +ATOM 58 CA GLY A 58 244.158 257.769 249.005 1.00 0.00 C +ATOM 59 CA LEU A 59 244.885 254.797 246.734 1.00 0.00 C +ATOM 60 CA ALA A 60 242.401 255.034 243.855 1.00 0.00 C +ATOM 61 CA GLY A 61 244.118 253.921 240.641 1.00 0.00 C +ATOM 62 CA ARG A 62 244.065 250.225 239.718 1.00 0.00 C +ATOM 63 CA ALA A 63 245.706 248.390 242.626 1.00 0.00 C +ATOM 64 CA THR A 64 246.329 245.499 245.028 1.00 0.00 C +ATOM 65 CA ALA A 65 249.912 245.181 246.284 1.00 0.00 C +ATOM 66 CA ARG A 66 252.868 243.386 244.684 1.00 0.00 C +ATOM 67 CA TYR A 67 256.659 243.763 244.721 1.00 0.00 C +ATOM 68 CA ALA A 68 258.999 243.567 241.721 1.00 0.00 C +ATOM 69 CA LEU A 69 259.671 247.083 240.417 1.00 0.00 C +ATOM 70 CA THR A 70 260.333 250.734 239.552 1.00 0.00 C +ATOM 71 CA THR A 71 259.520 254.416 240.103 1.00 0.00 C +ATOM 72 CA PRO A 72 256.613 254.569 242.560 1.00 0.00 C +ATOM 73 CA LEU A 73 256.736 251.464 244.765 1.00 0.00 C +ATOM 74 CA PRO A 74 259.817 250.108 246.549 1.00 0.00 C +ATOM 75 CA PRO A 75 261.908 249.313 249.634 1.00 0.00 C +ATOM 76 CA PRO A 76 263.246 250.398 253.032 1.00 0.00 C +ATOM 77 CA GLN A 77 263.380 252.993 255.818 1.00 0.00 C +ATOM 78 CA GLU A 78 264.709 254.340 259.125 1.00 0.00 C +ATOM 79 CA ARG A 79 268.431 253.530 259.094 1.00 0.00 C +ATOM 80 CA GLY A 80 270.830 255.426 261.367 1.00 0.00 C +ATOM 81 CA GLU A 81 269.419 256.981 264.546 1.00 0.00 C +ATOM 82 CA ARG A 82 267.955 258.506 267.716 1.00 0.00 C +ATOM 83 CA ARG A 83 264.191 259.094 267.653 1.00 0.00 C +ATOM 84 CA ARG A 84 260.713 260.426 266.846 1.00 0.00 C +ATOM 85 CA GLY A 85 257.855 258.012 266.124 1.00 0.00 C +ATOM 86 CA LYS A 86 254.110 258.328 265.504 1.00 0.00 C +ATOM 87 CA GLU A 87 252.059 258.289 268.715 1.00 0.00 C +ATOM 88 CA ALA A 88 251.050 261.255 270.883 1.00 0.00 C +ATOM 89 CA PRO A 89 250.860 264.688 272.525 1.00 0.00 C +ATOM 90 CA ALA A 90 250.277 267.296 269.810 1.00 0.00 C +ATOM 91 CA ALA A 91 247.885 270.257 269.978 1.00 0.00 C +ATOM 92 CA GLY A 92 247.104 271.645 273.439 1.00 0.00 C +ATOM 93 CA SER A 93 244.906 270.818 276.439 1.00 0.00 C +ATOM 94 CA PRO A 94 244.045 267.309 277.646 1.00 0.00 C +ATOM 95 CA LYS A 95 246.460 264.878 279.313 1.00 0.00 C +ATOM 96 CA GLU A 96 248.007 261.411 278.993 1.00 0.00 C +ATOM 97 CA GLU A 97 248.725 258.209 277.058 1.00 0.00 C +ATOM 98 CA ALA A 98 251.517 255.715 276.348 1.00 0.00 C +ATOM 99 CA GLY A 99 252.787 253.814 273.300 1.00 0.00 C +ATOM 100 CA VAL A 100 250.620 250.890 272.174 1.00 0.00 C +ATOM 101 CA ARG A 101 252.861 247.911 271.387 1.00 0.00 C +ATOM 102 CA THR A 102 256.353 249.320 270.807 1.00 0.00 C +ATOM 103 CA ARG A 103 259.457 250.472 272.692 1.00 0.00 C +ATOM 104 CA GLU A 104 262.519 251.159 274.852 1.00 0.00 C +ATOM 105 CA ARG A 105 264.325 247.950 275.829 1.00 0.00 C +ATOM 106 CA ILE A 106 268.063 247.221 275.703 1.00 0.00 C +ATOM 107 CA ARG A 107 270.708 244.514 275.270 1.00 0.00 C +ATOM 108 CA GLU A 108 273.587 244.692 277.759 1.00 0.00 C +ATOM 109 CA ARG A 109 276.157 242.700 279.745 1.00 0.00 C +ATOM 110 CA ALA A 110 279.773 243.302 280.783 1.00 0.00 C +ATOM 111 CA ALA A 111 282.752 241.415 279.340 1.00 0.00 C +ATOM 112 CA GLN A 112 284.314 242.054 275.924 1.00 0.00 C +ATOM 113 CA MET A 113 286.272 242.202 272.659 1.00 0.00 C +ATOM 114 CA SER A 114 288.978 244.484 271.249 1.00 0.00 C +ATOM 115 CA GLU A 115 288.815 247.724 269.252 1.00 0.00 C +ATOM 116 CA THR A 116 289.993 251.324 268.838 1.00 0.00 C +ATOM 117 CA GLN A 117 292.477 253.231 266.668 1.00 0.00 C +ATOM 118 CA CYS A 118 295.211 251.362 264.784 1.00 0.00 C +ATOM 119 CA GLU A 119 298.349 253.521 264.872 1.00 0.00 C +ATOM 120 CA ARG A 120 299.544 255.479 261.830 1.00 0.00 C +ATOM 121 CA SER A 121 301.060 258.701 260.475 1.00 0.00 C +TER 122 SER A 121 +END diff --git a/Plants/Q84NN0/Q84NN0.dcd b/Plants/Q84NN0/Q84NN0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..9c4a6271b30b318391eedc661507fae907d97f74 --- /dev/null +++ b/Plants/Q84NN0/Q84NN0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:02cc90501e61f1872f8c0d0c8322cdcfdd449b5fd1954140cce528b515591c2c +size 16760276 diff --git a/Plants/Q84NN0/top.pdb b/Plants/Q84NN0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..7e3aba8d577e357a53663cbfb963dde7d8668838 --- /dev/null +++ b/Plants/Q84NN0/top.pdb @@ -0,0 +1,137 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 256.465 222.099 229.953 1.00 0.00 C +ATOM 2 CA THR A 2 257.873 225.516 230.880 1.00 0.00 C +ATOM 3 CA ILE A 3 256.137 228.760 231.872 1.00 0.00 C +ATOM 4 CA GLU A 4 253.240 229.968 229.712 1.00 0.00 C +ATOM 5 CA GLU A 5 253.767 233.540 228.495 1.00 0.00 C +ATOM 6 CA ASP A 6 256.158 236.169 229.868 1.00 0.00 C +ATOM 7 CA GLU A 7 258.578 235.210 232.651 1.00 0.00 C +ATOM 8 CA GLU A 8 259.673 238.137 234.830 1.00 0.00 C +ATOM 9 CA GLU A 9 260.226 241.828 234.062 1.00 0.00 C +ATOM 10 CA ALA A 10 261.394 243.531 230.861 1.00 0.00 C +ATOM 11 CA SER A 11 258.314 244.416 228.801 1.00 0.00 C +ATOM 12 CA GLU A 12 255.186 246.508 228.203 1.00 0.00 C +ATOM 13 CA LEU A 13 254.479 249.491 230.465 1.00 0.00 C +ATOM 14 CA ALA A 14 257.117 249.318 233.210 1.00 0.00 C +ATOM 15 CA ALA A 15 258.412 247.518 236.307 1.00 0.00 C +ATOM 16 CA TYR A 16 257.197 246.532 239.782 1.00 0.00 C +ATOM 17 CA VAL A 17 255.861 243.695 241.945 1.00 0.00 C +ATOM 18 CA ARG A 18 252.840 243.733 244.266 1.00 0.00 C +ATOM 19 CA SER A 19 249.244 242.954 245.256 1.00 0.00 C +ATOM 20 CA GLY A 20 245.717 242.047 246.375 1.00 0.00 C +ATOM 21 CA GLY A 21 243.393 240.920 249.176 1.00 0.00 C +ATOM 22 CA GLY A 22 241.524 242.477 252.108 1.00 0.00 C +ATOM 23 CA GLY A 23 240.212 246.002 252.718 1.00 0.00 C +ATOM 24 CA LEU A 24 236.999 246.150 250.676 1.00 0.00 C +ATOM 25 CA GLU A 25 233.263 245.493 250.319 1.00 0.00 C +ATOM 26 CA ALA A 26 229.591 246.452 250.655 1.00 0.00 C +ATOM 27 CA ARG A 27 227.157 246.157 247.739 1.00 0.00 C +ATOM 28 CA ASP A 28 226.127 247.741 244.431 1.00 0.00 C +ATOM 29 CA ASP A 29 226.023 251.550 244.466 1.00 0.00 C +ATOM 30 CA GLU A 30 222.437 252.796 244.784 1.00 0.00 C +ATOM 31 CA THR A 31 221.096 256.361 244.685 1.00 0.00 C +ATOM 32 CA TRP A 32 217.909 257.193 246.600 1.00 0.00 C +ATOM 33 CA GLY A 33 214.739 259.145 247.413 1.00 0.00 C +ATOM 34 CA ALA A 34 215.764 262.353 249.194 1.00 0.00 C +ATOM 35 CA GLU A 35 215.996 265.654 251.082 1.00 0.00 C +ATOM 36 CA ASP A 36 217.672 267.503 253.961 1.00 0.00 C +ATOM 37 CA GLY A 37 221.012 266.164 255.213 1.00 0.00 C +ATOM 38 CA GLY A 38 224.725 266.491 254.422 1.00 0.00 C +ATOM 39 CA SER A 39 226.113 267.093 250.925 1.00 0.00 C +ATOM 40 CA HIS A 40 224.598 265.781 247.685 1.00 0.00 C +ATOM 41 CA GLY A 41 220.809 266.079 247.414 1.00 0.00 C +ATOM 42 CA GLY A 42 218.559 265.428 244.410 1.00 0.00 C +ATOM 43 CA ARG A 43 218.593 262.093 242.567 1.00 0.00 C +ATOM 44 CA ARG A 44 218.197 259.949 239.442 1.00 0.00 C +ATOM 45 CA SER A 45 220.479 257.116 238.309 1.00 0.00 C +ATOM 46 CA ARG A 46 223.680 255.382 237.186 1.00 0.00 C +ATOM 47 CA ARG A 47 227.484 255.589 237.182 1.00 0.00 C +ATOM 48 CA LEU A 48 228.895 258.136 239.640 1.00 0.00 C +ATOM 49 CA ALA A 49 232.693 257.838 239.650 1.00 0.00 C +ATOM 50 CA THR A 50 234.881 260.625 241.052 1.00 0.00 C +ATOM 51 CA THR A 51 236.516 261.342 244.418 1.00 0.00 C +ATOM 52 CA MET A 52 239.087 263.475 246.251 1.00 0.00 C +ATOM 53 CA THR A 53 240.861 265.403 243.485 1.00 0.00 C +ATOM 54 CA TRP A 54 239.861 264.880 239.846 1.00 0.00 C +ATOM 55 CA ALA A 55 242.180 264.979 236.824 1.00 0.00 C +ATOM 56 CA ALA A 56 245.713 264.002 237.865 1.00 0.00 C +ATOM 57 CA GLU A 57 248.577 261.500 238.092 1.00 0.00 C +ATOM 58 CA GLY A 58 247.566 258.387 240.040 1.00 0.00 C +ATOM 59 CA ARG A 59 247.892 254.627 239.516 1.00 0.00 C +ATOM 60 CA GLY A 60 251.259 253.100 238.593 1.00 0.00 C +ATOM 61 CA ARG A 61 250.973 250.403 235.917 1.00 0.00 C +ATOM 62 CA GLY A 62 248.355 247.638 236.044 1.00 0.00 C +ATOM 63 CA GLN A 63 246.287 245.184 233.990 1.00 0.00 C +ATOM 64 CA GLY A 64 243.875 242.815 235.747 1.00 0.00 C +ATOM 65 CA LEU A 65 243.618 241.684 239.377 1.00 0.00 C +ATOM 66 CA ARG A 66 240.550 241.219 241.588 1.00 0.00 C +ATOM 67 CA ARG A 67 239.212 239.109 244.464 1.00 0.00 C +ATOM 68 CA GLY A 68 239.236 235.326 244.012 1.00 0.00 C +ATOM 69 CA LEU A 69 241.917 232.651 243.597 1.00 0.00 C +ATOM 70 CA ARG A 70 241.525 229.172 245.100 1.00 0.00 C +ATOM 71 CA SER A 71 242.000 226.900 248.121 1.00 0.00 C +ATOM 72 CA ARG A 72 243.665 225.759 251.352 1.00 0.00 C +ATOM 73 CA PRO A 73 246.298 223.031 250.976 1.00 0.00 C +ATOM 74 CA ALA A 74 245.411 220.061 253.192 1.00 0.00 C +ATOM 75 CA THR A 75 248.324 217.883 254.327 1.00 0.00 C +ATOM 76 CA VAL A 76 250.530 216.741 257.215 1.00 0.00 C +ATOM 77 CA ARG A 77 253.163 214.629 258.982 1.00 0.00 C +ATOM 78 CA LYS A 78 254.540 212.180 261.555 1.00 0.00 C +ATOM 79 CA ALA A 79 255.682 212.041 265.188 1.00 0.00 C +ATOM 80 CA ALA A 80 255.227 214.471 268.087 1.00 0.00 C +ATOM 81 CA VAL A 81 254.747 218.122 267.109 1.00 0.00 C +ATOM 82 CA THR A 82 256.108 221.310 268.690 1.00 0.00 C +ATOM 83 CA ALA A 83 258.964 222.821 266.672 1.00 0.00 C +ATOM 84 CA ALA A 84 260.840 220.820 264.027 1.00 0.00 C +ATOM 85 CA GLY A 85 258.797 220.967 260.815 1.00 0.00 C +ATOM 86 CA ASP A 86 261.265 220.895 257.913 1.00 0.00 C +ATOM 87 CA ARG A 87 263.226 223.314 255.719 1.00 0.00 C +ATOM 88 CA ALA A 88 261.941 226.214 253.608 1.00 0.00 C +ATOM 89 CA GLU A 89 262.017 229.059 251.075 1.00 0.00 C +ATOM 90 CA GLY A 90 262.988 232.015 248.876 1.00 0.00 C +ATOM 91 CA ARG A 91 266.070 233.390 247.108 1.00 0.00 C +ATOM 92 CA GLY A 92 268.764 235.835 245.977 1.00 0.00 C +ATOM 93 CA ARG A 93 269.735 238.823 248.132 1.00 0.00 C +ATOM 94 CA GLY A 94 267.769 241.220 250.347 1.00 0.00 C +ATOM 95 CA GLN A 95 267.980 241.828 254.103 1.00 0.00 C +ATOM 96 CA ARG A 96 266.058 244.237 256.342 1.00 0.00 C +ATOM 97 CA SER A 97 263.640 247.020 257.303 1.00 0.00 C +ATOM 98 CA ARG A 98 263.455 248.695 260.721 1.00 0.00 C +ATOM 99 CA GLN A 99 265.192 252.077 260.473 1.00 0.00 C +ATOM 100 CA PRO A 100 263.169 255.183 261.353 1.00 0.00 C +ATOM 101 CA GLY A 101 259.692 254.509 259.948 1.00 0.00 C +ATOM 102 CA THR A 102 258.393 252.606 256.914 1.00 0.00 C +ATOM 103 CA ALA A 103 257.244 253.575 253.413 1.00 0.00 C +ATOM 104 CA ARG A 104 257.993 257.219 252.589 1.00 0.00 C +ATOM 105 CA GLY A 105 258.204 259.927 255.260 1.00 0.00 C +ATOM 106 CA ALA A 106 257.671 262.132 258.321 1.00 0.00 C +ATOM 107 CA ALA A 107 257.730 264.768 261.071 1.00 0.00 C +ATOM 108 CA VAL A 108 259.785 264.045 264.197 1.00 0.00 C +ATOM 109 CA GLU A 109 258.160 262.940 267.462 1.00 0.00 C +ATOM 110 CA GLY A 110 258.974 264.860 270.650 1.00 0.00 C +ATOM 111 CA GLY A 111 259.308 267.338 273.525 1.00 0.00 C +ATOM 112 CA ASP A 112 261.052 268.859 276.552 1.00 0.00 C +ATOM 113 CA GLY A 113 264.687 267.887 277.144 1.00 0.00 C +ATOM 114 CA ALA A 114 267.286 267.288 274.423 1.00 0.00 C +ATOM 115 CA GLU A 115 270.569 268.650 275.797 1.00 0.00 C +ATOM 116 CA GLY A 116 270.166 272.161 277.221 1.00 0.00 C +ATOM 117 CA GLY A 117 268.913 274.562 274.542 1.00 0.00 C +ATOM 118 CA GLY A 118 265.489 274.339 272.885 1.00 0.00 C +ATOM 119 CA ARG A 119 263.224 272.146 270.746 1.00 0.00 C +ATOM 120 CA GLY A 120 259.835 271.951 269.016 1.00 0.00 C +ATOM 121 CA ARG A 121 258.776 273.611 265.755 1.00 0.00 C +ATOM 122 CA ARG A 122 256.469 274.445 262.840 1.00 0.00 C +ATOM 123 CA ARG A 123 257.779 273.418 259.412 1.00 0.00 C +ATOM 124 CA PRO A 124 259.752 276.063 257.507 1.00 0.00 C +ATOM 125 CA SER A 125 262.686 275.248 255.218 1.00 0.00 C +ATOM 126 CA GLN A 126 266.483 275.363 254.927 1.00 0.00 C +ATOM 127 CA HIS A 127 268.472 272.642 253.150 1.00 0.00 C +ATOM 128 CA GLU A 128 271.804 271.825 251.493 1.00 0.00 C +ATOM 129 CA ARG A 129 273.798 274.474 249.617 1.00 0.00 C +ATOM 130 CA GLN A 130 275.698 277.481 250.984 1.00 0.00 C +ATOM 131 CA THR A 131 279.320 277.450 252.167 1.00 0.00 C +ATOM 132 CA ASP A 132 280.681 280.982 252.597 1.00 0.00 C +ATOM 133 CA ASP A 133 282.785 282.120 249.631 1.00 0.00 C +TER 134 ASP A 133 +END diff --git a/Plants/Q84P81/Q84P81.dcd b/Plants/Q84P81/Q84P81.dcd new file mode 100644 index 0000000000000000000000000000000000000000..95fca75ccf8ce834076325ef5ae87069183081dd --- /dev/null +++ b/Plants/Q84P81/Q84P81.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:eac58d09f7897466ce5140f7e3f5d5e0b930f2fb0ec1ebb8396ebb67d81e114e +size 5720276 diff --git a/Plants/Q84P81/top.pdb b/Plants/Q84P81/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..f7b0d6c8eaf26a4b6f4fb0d48bcf3f5fcacc66ec --- /dev/null +++ b/Plants/Q84P81/top.pdb @@ -0,0 +1,45 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA ALA A 1 248.028 280.889 254.204 1.00 0.00 C +ATOM 2 CA PRO A 2 247.636 277.103 254.035 1.00 0.00 C +ATOM 3 CA SER A 3 243.966 276.195 254.513 1.00 0.00 C +ATOM 4 CA SER A 4 240.780 277.718 253.083 1.00 0.00 C +ATOM 5 CA SER A 5 238.543 276.891 250.112 1.00 0.00 C +ATOM 6 CA SER A 6 239.927 276.268 246.618 1.00 0.00 C +ATOM 7 CA GLY A 7 242.540 278.731 245.343 1.00 0.00 C +ATOM 8 CA THR A 8 245.886 278.753 243.521 1.00 0.00 C +ATOM 9 CA THR A 9 247.277 275.226 243.151 1.00 0.00 C +ATOM 10 CA SER A 10 248.587 271.653 243.339 1.00 0.00 C +ATOM 11 CA ARG A 11 248.129 269.715 246.587 1.00 0.00 C +ATOM 12 CA PRO A 12 246.694 267.137 248.997 1.00 0.00 C +ATOM 13 CA THR A 13 249.393 264.475 249.377 1.00 0.00 C +ATOM 14 CA ALA A 14 248.795 261.603 246.946 1.00 0.00 C +ATOM 15 CA SER A 15 246.484 258.575 247.030 1.00 0.00 C +ATOM 16 CA ARG A 16 248.006 255.782 249.127 1.00 0.00 C +ATOM 17 CA THR A 17 249.692 256.610 252.441 1.00 0.00 C +ATOM 18 CA GLN A 18 251.691 253.767 254.003 1.00 0.00 C +ATOM 19 CA GLN A 19 254.157 251.315 255.559 1.00 0.00 C +ATOM 20 CA THR A 20 256.404 250.007 258.344 1.00 0.00 C +ATOM 21 CA LYS A 21 256.032 249.575 262.111 1.00 0.00 C +ATOM 22 CA GLY A 22 257.469 246.269 263.346 1.00 0.00 C +ATOM 23 CA ARG A 23 255.280 245.246 266.291 1.00 0.00 C +ATOM 24 CA LEU A 24 253.535 242.073 265.108 1.00 0.00 C +ATOM 25 CA THR A 25 255.163 239.801 262.520 1.00 0.00 C +ATOM 26 CA VAL A 26 253.700 236.317 262.032 1.00 0.00 C +ATOM 27 CA THR A 27 253.285 234.600 258.656 1.00 0.00 C +ATOM 28 CA ILE A 28 252.470 232.230 255.787 1.00 0.00 C +ATOM 29 CA SER A 29 251.672 231.485 252.136 1.00 0.00 C +ATOM 30 CA LEU A 30 250.696 230.442 248.604 1.00 0.00 C +ATOM 31 CA LYS A 31 248.598 231.585 245.637 1.00 0.00 C +ATOM 32 CA ALA A 32 248.757 232.657 241.984 1.00 0.00 C +ATOM 33 CA TYR A 33 248.591 230.674 238.735 1.00 0.00 C +ATOM 34 CA SER A 34 247.269 227.228 237.793 1.00 0.00 C +ATOM 35 CA PRO A 35 247.373 223.453 238.302 1.00 0.00 C +ATOM 36 CA GLY A 36 250.508 221.533 239.303 1.00 0.00 C +ATOM 37 CA ARG A 37 251.896 221.696 242.847 1.00 0.00 C +ATOM 38 CA THR A 38 253.692 224.514 244.678 1.00 0.00 C +ATOM 39 CA ARG A 39 256.211 227.130 243.527 1.00 0.00 C +ATOM 40 CA SER A 40 256.201 230.383 241.544 1.00 0.00 C +ATOM 41 CA GLY A 41 258.985 232.697 242.731 1.00 0.00 C +TER 42 GLY A 41 +END diff --git a/Plants/Q84Q29/Q84Q29.dcd b/Plants/Q84Q29/Q84Q29.dcd new file mode 100644 index 0000000000000000000000000000000000000000..b9ec1c56820bdda883fa92acc4a260bfc595cbec --- /dev/null +++ b/Plants/Q84Q29/Q84Q29.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:48605adeed17a13a7ebf62061fe7bfeadb9be529c7d8a3ecd3d578f90be4a3ec +size 8000276 diff --git a/Plants/Q84Q29/top.pdb b/Plants/Q84Q29/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..515ec60a3e5ec75651acbafd1f21ce14bcb7db37 --- /dev/null +++ b/Plants/Q84Q29/top.pdb @@ -0,0 +1,64 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 293.105 238.841 239.479 1.00 0.00 C +ATOM 2 CA GLN A 2 289.701 237.811 240.847 1.00 0.00 C +ATOM 3 CA GLN A 3 286.470 236.243 242.118 1.00 0.00 C +ATOM 4 CA ARG A 4 285.145 234.611 245.296 1.00 0.00 C +ATOM 5 CA ARG A 5 283.331 231.292 244.836 1.00 0.00 C +ATOM 6 CA GLY A 6 280.316 229.968 246.752 1.00 0.00 C +ATOM 7 CA LYS A 7 278.368 226.715 246.377 1.00 0.00 C +ATOM 8 CA TRP A 8 278.720 223.041 247.323 1.00 0.00 C +ATOM 9 CA ARG A 9 281.222 220.959 249.304 1.00 0.00 C +ATOM 10 CA SER A 10 279.350 217.988 250.781 1.00 0.00 C +ATOM 11 CA ALA A 11 277.615 218.376 254.150 1.00 0.00 C +ATOM 12 CA ALA A 12 274.927 220.238 256.105 1.00 0.00 C +ATOM 13 CA ALA A 13 273.427 223.577 257.162 1.00 0.00 C +ATOM 14 CA ALA A 14 271.306 226.278 258.812 1.00 0.00 C +ATOM 15 CA ALA A 15 268.256 226.631 256.556 1.00 0.00 C +ATOM 16 CA VAL A 16 265.812 229.388 257.526 1.00 0.00 C +ATOM 17 CA ALA A 17 267.202 231.076 260.646 1.00 0.00 C +ATOM 18 CA VAL A 18 264.865 233.556 262.350 1.00 0.00 C +ATOM 19 CA VAL A 19 263.873 234.449 265.919 1.00 0.00 C +ATOM 20 CA GLY A 20 264.252 238.147 266.752 1.00 0.00 C +ATOM 21 CA GLY A 21 264.557 240.037 263.458 1.00 0.00 C +ATOM 22 CA GLU A 22 263.332 243.644 263.531 1.00 0.00 C +ATOM 23 CA GLU A 23 261.119 246.723 263.165 1.00 0.00 C +ATOM 24 CA VAL A 24 257.419 246.068 262.535 1.00 0.00 C +ATOM 25 CA ALA A 25 255.869 244.598 265.691 1.00 0.00 C +ATOM 26 CA ALA A 26 254.066 241.306 265.040 1.00 0.00 C +ATOM 27 CA ASP A 27 251.497 239.967 267.515 1.00 0.00 C +ATOM 28 CA SER A 28 250.174 242.104 270.379 1.00 0.00 C +ATOM 29 CA LYS A 29 250.090 245.775 271.392 1.00 0.00 C +ATOM 30 CA GLU A 30 247.784 248.395 272.921 1.00 0.00 C +ATOM 31 CA ASP A 31 245.039 249.501 270.522 1.00 0.00 C +ATOM 32 CA ARG A 32 242.332 250.469 268.021 1.00 0.00 C +ATOM 33 CA ARG A 33 240.996 253.395 265.980 1.00 0.00 C +ATOM 34 CA GLY A 34 237.844 255.533 266.059 1.00 0.00 C +ATOM 35 CA GLU A 35 237.583 258.014 263.180 1.00 0.00 C +ATOM 36 CA LYS A 36 235.882 260.858 261.299 1.00 0.00 C +ATOM 37 CA GLU A 37 237.619 263.883 259.769 1.00 0.00 C +ATOM 38 CA ALA A 38 234.777 266.199 258.731 1.00 0.00 C +ATOM 39 CA THR A 39 233.210 267.022 255.357 1.00 0.00 C +ATOM 40 CA GLU A 40 232.505 265.650 251.873 1.00 0.00 C +ATOM 41 CA ARG A 41 231.950 265.012 248.158 1.00 0.00 C +ATOM 42 CA GLY A 42 233.141 267.546 245.574 1.00 0.00 C +ATOM 43 CA ASP A 43 234.063 266.136 242.157 1.00 0.00 C +ATOM 44 CA GLU A 44 236.077 268.182 239.653 1.00 0.00 C +ATOM 45 CA LEU A 45 238.733 270.116 237.723 1.00 0.00 C +ATOM 46 CA GLU A 46 239.682 270.329 234.039 1.00 0.00 C +ATOM 47 CA GLY A 47 238.035 272.011 231.044 1.00 0.00 C +ATOM 48 CA ARG A 48 235.632 271.684 228.106 1.00 0.00 C +ATOM 49 CA SER A 49 232.033 271.996 226.893 1.00 0.00 C +ATOM 50 CA ASP A 50 228.573 272.066 228.487 1.00 0.00 C +ATOM 51 CA ARG A 51 226.989 270.804 231.714 1.00 0.00 C +ATOM 52 CA GLY A 52 224.014 270.889 234.091 1.00 0.00 C +ATOM 53 CA GLY A 53 220.926 273.100 234.399 1.00 0.00 C +ATOM 54 CA VAL A 54 217.281 272.371 235.233 1.00 0.00 C +ATOM 55 CA VAL A 55 215.400 273.062 231.992 1.00 0.00 C +ATOM 56 CA GLY A 56 213.555 272.848 228.665 1.00 0.00 C +ATOM 57 CA LEU A 57 215.174 270.271 226.373 1.00 0.00 C +ATOM 58 CA THR A 58 217.337 267.458 227.760 1.00 0.00 C +ATOM 59 CA GLY A 59 218.981 264.335 226.325 1.00 0.00 C +ATOM 60 CA GLY A 60 221.467 261.456 226.105 1.00 0.00 C +TER 61 GLY A 60 +END diff --git a/Plants/Q84QQ0/Q84QQ0.dcd b/Plants/Q84QQ0/Q84QQ0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..2adc8f6cad40a5e1db0b64b8cfab07ee4df5e808 --- /dev/null +++ b/Plants/Q84QQ0/Q84QQ0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:dbf2bb9502ce8ba8a0dc717af8d60766c3731fa28b9464fd08299c5d46d37d1e +size 17240276 diff --git a/Plants/Q84QQ0/top.pdb b/Plants/Q84QQ0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..400f4b88a3053aefa1e165bbc7e9861f4088298f --- /dev/null +++ b/Plants/Q84QQ0/top.pdb @@ -0,0 +1,141 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 256.755 265.872 229.787 1.00 0.00 C +ATOM 2 CA PRO A 2 254.206 268.057 231.588 1.00 0.00 C +ATOM 3 CA PRO A 3 252.193 271.102 232.679 1.00 0.00 C +ATOM 4 CA TRP A 4 249.319 272.886 234.432 1.00 0.00 C +ATOM 5 CA ALA A 5 245.914 271.875 235.811 1.00 0.00 C +ATOM 6 CA PRO A 6 242.640 269.965 235.424 1.00 0.00 C +ATOM 7 CA GLN A 7 241.384 270.506 231.868 1.00 0.00 C +ATOM 8 CA PRO A 8 238.980 268.153 230.079 1.00 0.00 C +ATOM 9 CA PRO A 9 239.867 265.884 227.150 1.00 0.00 C +ATOM 10 CA PRO A 10 242.726 263.571 228.146 1.00 0.00 C +ATOM 11 CA LEU A 11 242.653 260.159 229.841 1.00 0.00 C +ATOM 12 CA PRO A 12 240.955 256.840 230.628 1.00 0.00 C +ATOM 13 CA VAL A 13 241.598 253.101 230.977 1.00 0.00 C +ATOM 14 CA VAL A 14 241.982 250.093 233.283 1.00 0.00 C +ATOM 15 CA GLY A 15 240.485 246.631 232.742 1.00 0.00 C +ATOM 16 CA GLU A 16 239.303 243.856 235.070 1.00 0.00 C +ATOM 17 CA PRO A 17 241.182 240.844 236.451 1.00 0.00 C +ATOM 18 CA PRO A 18 242.504 237.561 235.038 1.00 0.00 C +ATOM 19 CA SER A 19 244.665 235.185 232.989 1.00 0.00 C +ATOM 20 CA PRO A 20 242.745 232.998 230.530 1.00 0.00 C +ATOM 21 CA LEU A 21 245.074 230.435 228.943 1.00 0.00 C +ATOM 22 CA THR A 22 244.796 226.755 227.996 1.00 0.00 C +ATOM 23 CA GLY A 23 247.993 225.336 226.484 1.00 0.00 C +ATOM 24 CA GLY A 24 250.216 222.434 225.410 1.00 0.00 C +ATOM 25 CA GLY A 25 251.620 219.769 223.077 1.00 0.00 C +ATOM 26 CA ARG A 26 250.700 216.386 221.585 1.00 0.00 C +ATOM 27 CA HIS A 27 249.838 213.771 218.952 1.00 0.00 C +ATOM 28 CA ARG A 28 252.809 212.712 216.814 1.00 0.00 C +ATOM 29 CA HIS A 29 255.994 211.827 214.920 1.00 0.00 C +ATOM 30 CA CYS A 30 259.299 213.397 215.983 1.00 0.00 C +ATOM 31 CA SER A 31 259.989 217.114 215.513 1.00 0.00 C +ATOM 32 CA GLY A 32 259.494 220.892 215.572 1.00 0.00 C +ATOM 33 CA GLY A 33 256.592 223.325 215.986 1.00 0.00 C +ATOM 34 CA GLY A 34 252.992 224.354 216.693 1.00 0.00 C +ATOM 35 CA GLY A 35 250.965 226.432 214.225 1.00 0.00 C +ATOM 36 CA GLY A 36 248.579 229.401 214.296 1.00 0.00 C +ATOM 37 CA ALA A 37 245.143 229.322 212.652 1.00 0.00 C +ATOM 38 CA PRO A 38 243.828 225.758 212.363 1.00 0.00 C +ATOM 39 CA PRO A 39 241.417 224.799 215.153 1.00 0.00 C +ATOM 40 CA PRO A 40 238.444 223.372 217.060 1.00 0.00 C +ATOM 41 CA HIS A 41 236.275 220.966 219.065 1.00 0.00 C +ATOM 42 CA LEU A 42 233.740 220.184 221.800 1.00 0.00 C +ATOM 43 CA GLY A 43 230.102 220.598 222.855 1.00 0.00 C +ATOM 44 CA LEU A 44 229.915 219.585 226.523 1.00 0.00 C +ATOM 45 CA GLY A 45 227.641 219.137 229.547 1.00 0.00 C +ATOM 46 CA GLY A 46 225.103 218.943 232.382 1.00 0.00 C +ATOM 47 CA GLY A 47 224.522 221.015 235.525 1.00 0.00 C +ATOM 48 CA ARG A 48 222.723 223.478 237.810 1.00 0.00 C +ATOM 49 CA CYS A 49 219.343 223.491 239.568 1.00 0.00 C +ATOM 50 CA PRO A 50 217.482 220.366 240.702 1.00 0.00 C +ATOM 51 CA ARG A 51 220.224 218.016 241.918 1.00 0.00 C +ATOM 52 CA CYS A 52 222.923 219.970 243.765 1.00 0.00 C +ATOM 53 CA ARG A 53 224.179 223.412 244.809 1.00 0.00 C +ATOM 54 CA SER A 54 227.594 224.589 243.596 1.00 0.00 C +ATOM 55 CA GLY A 55 231.104 226.030 243.256 1.00 0.00 C +ATOM 56 CA GLY A 56 234.462 227.430 244.386 1.00 0.00 C +ATOM 57 CA GLY A 57 237.372 229.879 244.164 1.00 0.00 C +ATOM 58 CA ARG A 58 238.359 233.302 245.515 1.00 0.00 C +ATOM 59 CA ARG A 59 240.413 235.853 247.462 1.00 0.00 C +ATOM 60 CA CYS A 60 241.097 238.628 249.982 1.00 0.00 C +ATOM 61 CA ARG A 61 238.812 240.830 252.090 1.00 0.00 C +ATOM 62 CA ARG A 62 235.030 241.291 252.063 1.00 0.00 C +ATOM 63 CA LEU A 63 233.397 242.503 248.841 1.00 0.00 C +ATOM 64 CA GLY A 64 235.514 244.816 246.678 1.00 0.00 C +ATOM 65 CA SER A 65 237.441 247.078 249.063 1.00 0.00 C +ATOM 66 CA GLY A 66 239.733 249.376 247.068 1.00 0.00 C +ATOM 67 CA GLY A 67 241.697 248.302 243.985 1.00 0.00 C +ATOM 68 CA GLU A 68 244.385 250.974 243.596 1.00 0.00 C +ATOM 69 CA ALA A 69 247.556 250.223 245.569 1.00 0.00 C +ATOM 70 CA ALA A 70 250.504 248.963 247.627 1.00 0.00 C +ATOM 71 CA SER A 71 252.389 246.032 249.168 1.00 0.00 C +ATOM 72 CA PRO A 72 251.408 245.561 252.819 1.00 0.00 C +ATOM 73 CA PRO A 73 249.889 242.071 252.980 1.00 0.00 C +ATOM 74 CA GLN A 74 250.185 239.007 255.226 1.00 0.00 C +ATOM 75 CA SER A 75 250.141 238.556 259.009 1.00 0.00 C +ATOM 76 CA LEU A 76 251.638 239.148 262.462 1.00 0.00 C +ATOM 77 CA GLY A 77 251.470 241.131 265.711 1.00 0.00 C +ATOM 78 CA GLU A 78 253.468 241.027 268.953 1.00 0.00 C +ATOM 79 CA ARG A 79 251.276 240.923 272.068 1.00 0.00 C +ATOM 80 CA GLY A 80 250.144 244.273 273.487 1.00 0.00 C +ATOM 81 CA ALA A 81 246.496 244.831 274.434 1.00 0.00 C +ATOM 82 CA ALA A 82 243.264 245.780 276.215 1.00 0.00 C +ATOM 83 CA ALA A 83 240.476 248.292 276.871 1.00 0.00 C +ATOM 84 CA ALA A 84 240.261 250.490 273.766 1.00 0.00 C +ATOM 85 CA ALA A 85 243.321 252.293 272.387 1.00 0.00 C +ATOM 86 CA ALA A 86 244.104 253.501 268.859 1.00 0.00 C +ATOM 87 CA LEU A 87 244.493 257.151 267.837 1.00 0.00 C +ATOM 88 CA SER A 88 247.202 259.493 266.536 1.00 0.00 C +ATOM 89 CA ARG A 89 250.055 261.060 264.557 1.00 0.00 C +ATOM 90 CA GLU A 90 253.591 262.327 263.919 1.00 0.00 C +ATOM 91 CA HIS A 91 256.267 259.708 263.215 1.00 0.00 C +ATOM 92 CA GLN A 92 258.765 258.683 260.527 1.00 0.00 C +ATOM 93 CA GLY A 93 261.279 257.296 258.023 1.00 0.00 C +ATOM 94 CA ARG A 94 259.973 253.932 256.802 1.00 0.00 C +ATOM 95 CA GLY A 95 256.635 252.098 256.900 1.00 0.00 C +ATOM 96 CA GLY A 96 254.371 251.646 259.931 1.00 0.00 C +ATOM 97 CA GLU A 97 251.553 254.206 259.776 1.00 0.00 C +ATOM 98 CA GLY A 98 248.724 256.031 257.992 1.00 0.00 C +ATOM 99 CA GLY A 99 246.008 258.587 257.216 1.00 0.00 C +ATOM 100 CA GLU A 100 247.373 261.913 258.477 1.00 0.00 C +ATOM 101 CA ALA A 101 248.705 265.417 257.796 1.00 0.00 C +ATOM 102 CA ARG A 102 249.015 268.987 259.090 1.00 0.00 C +ATOM 103 CA GLU A 103 248.233 270.536 262.482 1.00 0.00 C +ATOM 104 CA GLY A 104 248.713 269.314 266.059 1.00 0.00 C +ATOM 105 CA ARG A 105 249.108 272.323 268.362 1.00 0.00 C +ATOM 106 CA GLU A 106 252.234 274.258 269.364 1.00 0.00 C +ATOM 107 CA GLY A 107 252.773 277.682 270.947 1.00 0.00 C +ATOM 108 CA ASN A 108 254.969 280.069 268.949 1.00 0.00 C +ATOM 109 CA GLY A 109 255.032 283.658 270.226 1.00 0.00 C +ATOM 110 CA LEU A 110 257.383 285.663 267.996 1.00 0.00 C +ATOM 111 CA GLY A 111 259.634 283.173 266.193 1.00 0.00 C +ATOM 112 CA ASP A 112 259.777 279.607 264.858 1.00 0.00 C +ATOM 113 CA ARG A 113 262.832 277.594 263.797 1.00 0.00 C +ATOM 114 CA THR A 114 265.776 275.299 263.033 1.00 0.00 C +ATOM 115 CA ALA A 115 266.659 272.472 265.430 1.00 0.00 C +ATOM 116 CA ALA A 116 267.844 270.816 268.650 1.00 0.00 C +ATOM 117 CA VAL A 117 268.243 270.184 272.386 1.00 0.00 C +ATOM 118 CA ASN A 118 270.820 270.278 275.190 1.00 0.00 C +ATOM 119 CA ARG A 119 269.973 271.442 278.718 1.00 0.00 C +ATOM 120 CA ALA A 120 267.784 271.638 281.830 1.00 0.00 C +ATOM 121 CA GLU A 121 266.284 271.489 285.329 1.00 0.00 C +ATOM 122 CA MET A 122 269.099 270.754 287.790 1.00 0.00 C +ATOM 123 CA GLY A 123 272.427 272.420 286.976 1.00 0.00 C +ATOM 124 CA PRO A 124 275.432 272.318 284.636 1.00 0.00 C +ATOM 125 CA ARG A 125 276.843 273.015 281.166 1.00 0.00 C +ATOM 126 CA GLY A 126 279.200 274.177 278.407 1.00 0.00 C +ATOM 127 CA ILE A 127 280.797 271.803 275.891 1.00 0.00 C +ATOM 128 CA GLU A 128 283.445 273.186 273.527 1.00 0.00 C +ATOM 129 CA SER A 129 281.799 275.031 270.628 1.00 0.00 C +ATOM 130 CA GLU A 130 280.600 278.606 270.083 1.00 0.00 C +ATOM 131 CA ALA A 131 279.182 281.387 272.267 1.00 0.00 C +ATOM 132 CA THR A 132 278.810 280.932 276.032 1.00 0.00 C +ATOM 133 CA PHE A 133 279.198 283.353 278.948 1.00 0.00 C +ATOM 134 CA PRO A 134 275.944 284.321 280.677 1.00 0.00 C +ATOM 135 CA ALA A 135 272.154 284.592 280.395 1.00 0.00 C +ATOM 136 CA GLN A 136 269.920 283.436 277.533 1.00 0.00 C +ATOM 137 CA ALA A 137 270.657 279.764 276.832 1.00 0.00 C +TER 138 ALA A 137 +END diff --git a/Plants/Q84RM3/Q84RM3.dcd b/Plants/Q84RM3/Q84RM3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..a750d9173a5ded6e23317cabc85c307740b827c8 --- /dev/null +++ b/Plants/Q84RM3/Q84RM3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:d6c977abdaba59ce4feb1cc9aca48939328a282605e3e26192afc2b34b711881 +size 16760276 diff --git a/Plants/Q84RM3/top.pdb b/Plants/Q84RM3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..28d709abec090dfa191bb05d540078f4f25a1a48 --- /dev/null +++ b/Plants/Q84RM3/top.pdb @@ -0,0 +1,137 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 216.827 266.009 213.446 1.00 0.00 C +ATOM 2 CA GLU A 2 220.236 264.849 212.202 1.00 0.00 C +ATOM 3 CA PRO A 3 222.614 265.419 215.124 1.00 0.00 C +ATOM 4 CA TYR A 4 226.145 266.407 216.161 1.00 0.00 C +ATOM 5 CA GLY A 5 227.264 267.939 219.466 1.00 0.00 C +ATOM 6 CA ASN A 6 228.894 267.160 222.820 1.00 0.00 C +ATOM 7 CA HIS A 7 230.599 270.292 224.164 1.00 0.00 C +ATOM 8 CA GLN A 8 230.387 273.713 225.826 1.00 0.00 C +ATOM 9 CA ILE A 9 228.861 275.426 228.868 1.00 0.00 C +ATOM 10 CA GLY A 10 228.396 279.007 230.083 1.00 0.00 C +ATOM 11 CA ASP A 11 230.255 281.514 227.898 1.00 0.00 C +ATOM 12 CA GLN A 12 233.969 281.151 228.668 1.00 0.00 C +ATOM 13 CA LEU A 13 237.749 281.132 229.140 1.00 0.00 C +ATOM 14 CA ARG A 14 240.554 280.489 226.643 1.00 0.00 C +ATOM 15 CA LYS A 15 242.872 277.935 225.024 1.00 0.00 C +ATOM 16 CA THR A 16 241.660 274.400 225.767 1.00 0.00 C +ATOM 17 CA ASP A 17 239.458 271.360 225.116 1.00 0.00 C +ATOM 18 CA GLU A 18 240.036 267.624 224.640 1.00 0.00 C +ATOM 19 CA TYR A 19 238.468 264.376 225.868 1.00 0.00 C +ATOM 20 CA GLY A 20 239.659 261.324 227.812 1.00 0.00 C +ATOM 21 CA ASN A 21 242.310 261.081 230.537 1.00 0.00 C +ATOM 22 CA PRO A 22 242.905 259.579 233.988 1.00 0.00 C +ATOM 23 CA VAL A 23 244.945 259.978 237.181 1.00 0.00 C +ATOM 24 CA HIS A 24 244.251 256.945 239.380 1.00 0.00 C +ATOM 25 CA HIS A 25 245.927 254.149 241.353 1.00 0.00 C +ATOM 26 CA THR A 26 249.697 254.448 241.814 1.00 0.00 C +ATOM 27 CA PRO A 27 251.512 251.681 243.701 1.00 0.00 C +ATOM 28 CA GLY A 28 253.225 248.279 243.599 1.00 0.00 C +ATOM 29 CA GLY A 29 255.898 245.578 243.327 1.00 0.00 C +ATOM 30 CA GLU A 30 255.137 243.210 240.441 1.00 0.00 C +ATOM 31 CA TYR A 31 255.905 239.489 240.727 1.00 0.00 C +ATOM 32 CA GLY A 32 255.148 236.138 242.375 1.00 0.00 C +ATOM 33 CA GLY A 33 252.186 234.386 244.010 1.00 0.00 C +ATOM 34 CA PRO A 34 249.879 235.797 246.694 1.00 0.00 C +ATOM 35 CA HIS A 35 246.326 236.644 247.779 1.00 0.00 C +ATOM 36 CA VAL A 36 242.889 237.050 246.188 1.00 0.00 C +ATOM 37 CA GLY A 37 241.382 238.937 243.240 1.00 0.00 C +ATOM 38 CA ALA A 38 240.803 242.702 243.309 1.00 0.00 C +ATOM 39 CA GLU A 39 243.038 245.138 241.415 1.00 0.00 C +ATOM 40 CA HIS A 40 242.408 248.851 240.842 1.00 0.00 C +ATOM 41 CA HIS A 41 241.194 251.637 238.545 1.00 0.00 C +ATOM 42 CA HIS A 42 239.713 251.679 235.034 1.00 0.00 C +ATOM 43 CA GLY A 43 242.103 252.276 232.128 1.00 0.00 C +ATOM 44 CA ALA A 44 245.529 250.696 231.593 1.00 0.00 C +ATOM 45 CA PRO A 45 247.594 247.505 231.335 1.00 0.00 C +ATOM 46 CA ILE A 46 251.321 248.137 231.813 1.00 0.00 C +ATOM 47 CA SER A 47 254.615 246.568 230.717 1.00 0.00 C +ATOM 48 CA ILE A 48 255.531 242.880 230.996 1.00 0.00 C +ATOM 49 CA PRO A 49 259.171 241.842 231.433 1.00 0.00 C +ATOM 50 CA PRO A 50 260.665 243.456 234.544 1.00 0.00 C +ATOM 51 CA THR A 51 262.435 245.927 236.841 1.00 0.00 C +ATOM 52 CA THR A 52 265.091 245.756 239.568 1.00 0.00 C +ATOM 53 CA ASP A 53 268.660 245.084 240.720 1.00 0.00 C +ATOM 54 CA VAL A 54 272.148 243.913 241.711 1.00 0.00 C +ATOM 55 CA PRO A 55 275.171 241.920 240.525 1.00 0.00 C +ATOM 56 CA HIS A 56 277.646 241.651 243.409 1.00 0.00 C +ATOM 57 CA HIS A 57 277.788 242.723 247.063 1.00 0.00 C +ATOM 58 CA ARG A 58 274.723 241.866 249.157 1.00 0.00 C +ATOM 59 CA ARG A 59 273.221 238.498 248.200 1.00 0.00 C +ATOM 60 CA SER A 60 273.587 236.613 244.909 1.00 0.00 C +ATOM 61 CA GLY A 61 271.646 236.736 241.633 1.00 0.00 C +ATOM 62 CA SER A 62 268.764 238.945 240.479 1.00 0.00 C +ATOM 63 CA SER A 63 265.006 238.315 240.445 1.00 0.00 C +ATOM 64 CA SER A 64 261.784 238.755 242.429 1.00 0.00 C +ATOM 65 CA SER A 65 260.908 242.197 243.808 1.00 0.00 C +ATOM 66 CA SER A 66 261.230 243.267 247.451 1.00 0.00 C +ATOM 67 CA SER A 67 257.719 243.540 248.905 1.00 0.00 C +ATOM 68 CA SER A 68 256.550 240.975 251.468 1.00 0.00 C +ATOM 69 CA GLU A 69 253.286 240.771 253.424 1.00 0.00 C +ATOM 70 CA ASP A 70 250.371 241.691 255.698 1.00 0.00 C +ATOM 71 CA ASP A 71 246.912 243.270 255.943 1.00 0.00 C +ATOM 72 CA GLY A 72 243.913 244.544 257.917 1.00 0.00 C +ATOM 73 CA GLN A 73 240.493 244.202 256.273 1.00 0.00 C +ATOM 74 CA GLY A 74 236.858 244.659 255.228 1.00 0.00 C +ATOM 75 CA GLY A 75 236.258 247.653 252.949 1.00 0.00 C +ATOM 76 CA ARG A 76 238.897 250.393 252.749 1.00 0.00 C +ATOM 77 CA ARG A 77 241.843 252.403 251.408 1.00 0.00 C +ATOM 78 CA LYS A 78 241.977 256.023 252.591 1.00 0.00 C +ATOM 79 CA LYS A 79 239.651 258.966 251.926 1.00 0.00 C +ATOM 80 CA GLY A 80 239.776 262.410 250.301 1.00 0.00 C +ATOM 81 CA ILE A 81 240.250 262.529 246.522 1.00 0.00 C +ATOM 82 CA LYS A 82 241.153 264.566 243.432 1.00 0.00 C +ATOM 83 CA ASP A 83 243.878 266.184 241.316 1.00 0.00 C +ATOM 84 CA LYS A 84 246.133 268.533 239.338 1.00 0.00 C +ATOM 85 CA VAL A 85 249.811 268.176 240.263 1.00 0.00 C +ATOM 86 CA LYS A 86 253.116 266.321 240.655 1.00 0.00 C +ATOM 87 CA GLU A 87 256.097 268.012 242.319 1.00 0.00 C +ATOM 88 CA LYS A 88 257.222 266.348 245.557 1.00 0.00 C +ATOM 89 CA LEU A 89 258.421 266.548 249.168 1.00 0.00 C +ATOM 90 CA PRO A 90 259.848 264.001 251.615 1.00 0.00 C +ATOM 91 CA GLY A 91 259.317 264.092 255.387 1.00 0.00 C +ATOM 92 CA GLY A 92 261.668 261.548 256.974 1.00 0.00 C +ATOM 93 CA HIS A 93 264.568 260.538 259.229 1.00 0.00 C +ATOM 94 CA LYS A 94 264.837 259.941 262.982 1.00 0.00 C +ATOM 95 CA ASP A 95 262.689 256.931 263.900 1.00 0.00 C +ATOM 96 CA ASN A 96 263.140 254.229 261.251 1.00 0.00 C +ATOM 97 CA GLN A 97 261.870 252.576 258.063 1.00 0.00 C +ATOM 98 CA PRO A 98 260.205 249.149 258.108 1.00 0.00 C +ATOM 99 CA HIS A 99 261.939 246.344 260.017 1.00 0.00 C +ATOM 100 CA HIS A 100 262.311 242.557 260.200 1.00 0.00 C +ATOM 101 CA GLU A 101 260.460 239.908 262.218 1.00 0.00 C +ATOM 102 CA ALA A 102 258.439 239.721 265.442 1.00 0.00 C +ATOM 103 CA GLY A 103 260.667 240.590 268.408 1.00 0.00 C +ATOM 104 CA TYR A 104 259.421 240.351 272.001 1.00 0.00 C +ATOM 105 CA GLY A 105 256.658 242.045 274.003 1.00 0.00 C +ATOM 106 CA GLY A 106 253.719 244.275 274.957 1.00 0.00 C +ATOM 107 CA GLY A 107 253.347 247.927 275.975 1.00 0.00 C +ATOM 108 CA TYR A 108 254.654 250.905 273.991 1.00 0.00 C +ATOM 109 CA GLY A 109 253.295 250.583 270.446 1.00 0.00 C +ATOM 110 CA ALA A 110 255.223 249.698 267.281 1.00 0.00 C +ATOM 111 CA GLN A 111 252.852 248.755 264.452 1.00 0.00 C +ATOM 112 CA PRO A 112 251.112 245.444 265.178 1.00 0.00 C +ATOM 113 CA GLU A 113 250.114 243.469 262.077 1.00 0.00 C +ATOM 114 CA PRO A 114 248.462 240.038 262.203 1.00 0.00 C +ATOM 115 CA GLU A 115 244.844 239.544 263.290 1.00 0.00 C +ATOM 116 CA LYS A 116 243.261 240.688 266.561 1.00 0.00 C +ATOM 117 CA LYS A 117 240.294 238.887 268.133 1.00 0.00 C +ATOM 118 CA GLY A 118 238.494 237.029 270.931 1.00 0.00 C +ATOM 119 CA MET A 119 237.700 234.805 273.920 1.00 0.00 C +ATOM 120 CA MET A 120 239.458 233.845 277.162 1.00 0.00 C +ATOM 121 CA ASP A 121 242.427 236.006 278.177 1.00 0.00 C +ATOM 122 CA LYS A 122 244.828 235.080 280.986 1.00 0.00 C +ATOM 123 CA ILE A 123 247.256 236.480 283.567 1.00 0.00 C +ATOM 124 CA LYS A 124 249.904 237.866 285.931 1.00 0.00 C +ATOM 125 CA GLU A 125 250.914 236.008 289.100 1.00 0.00 C +ATOM 126 CA LYS A 126 252.812 235.941 292.403 1.00 0.00 C +ATOM 127 CA LEU A 127 256.582 236.004 292.947 1.00 0.00 C +ATOM 128 CA PRO A 128 258.390 233.343 290.905 1.00 0.00 C +ATOM 129 CA GLY A 129 256.532 230.037 291.272 1.00 0.00 C +ATOM 130 CA GLY A 130 254.633 229.497 294.531 1.00 0.00 C +ATOM 131 CA HIS A 131 253.108 226.076 295.231 1.00 0.00 C +ATOM 132 CA ARG A 132 253.900 222.458 296.124 1.00 0.00 C +ATOM 133 CA ASN A 133 255.346 219.645 293.999 1.00 0.00 C +TER 134 ASN A 133 +END diff --git a/Plants/Q84RW5/Q84RW5.dcd b/Plants/Q84RW5/Q84RW5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..d32dcb2e4edb911d9ff0b7a087d7ef231e2c025b --- /dev/null +++ b/Plants/Q84RW5/Q84RW5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:9bfeafddd0ab8ac8fcbde9626955f0bd68c7bde91a478c3a8bb7cd438807060c +size 24200276 diff --git a/Plants/Q84RW5/top.pdb b/Plants/Q84RW5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..805d4cdc0af369cb63469238c083e52864f51c4d --- /dev/null +++ b/Plants/Q84RW5/top.pdb @@ -0,0 +1,199 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 312.237 278.128 176.165 1.00 0.00 C +ATOM 2 CA VAL A 2 310.543 275.163 177.856 1.00 0.00 C +ATOM 3 CA GLU A 3 312.874 272.189 177.368 1.00 0.00 C +ATOM 4 CA LEU A 4 314.266 269.474 179.651 1.00 0.00 C +ATOM 5 CA LYS A 5 314.424 266.561 182.101 1.00 0.00 C +ATOM 6 CA LYS A 6 316.800 263.628 182.618 1.00 0.00 C +ATOM 7 CA LYS A 7 319.623 262.295 184.802 1.00 0.00 C +ATOM 8 CA LYS A 8 322.032 259.451 185.593 1.00 0.00 C +ATOM 9 CA LYS A 9 325.429 260.891 186.543 1.00 0.00 C +ATOM 10 CA LYS A 10 328.846 261.347 188.164 1.00 0.00 C +ATOM 11 CA LYS A 11 332.469 261.969 189.169 1.00 0.00 C +ATOM 12 CA LYS A 12 334.742 258.919 188.959 1.00 0.00 C +ATOM 13 CA LYS A 13 338.178 257.382 189.549 1.00 0.00 C +ATOM 14 CA LYS A 14 338.834 257.848 193.273 1.00 0.00 C +ATOM 15 CA LYS A 15 338.450 254.443 194.939 1.00 0.00 C +ATOM 16 CA LYS A 16 338.621 251.740 197.619 1.00 0.00 C +ATOM 17 CA LYS A 17 340.285 249.093 199.796 1.00 0.00 C +ATOM 18 CA LYS A 18 340.843 250.079 203.434 1.00 0.00 C +ATOM 19 CA LYS A 19 338.909 250.927 206.605 1.00 0.00 C +ATOM 20 CA LYS A 20 337.958 249.369 209.949 1.00 0.00 C +ATOM 21 CA LYS A 21 334.413 249.972 211.209 1.00 0.00 C +ATOM 22 CA LYS A 22 332.167 251.423 208.495 1.00 0.00 C +ATOM 23 CA LEU A 23 329.405 253.838 207.469 1.00 0.00 C +ATOM 24 CA LEU A 24 326.045 255.620 207.711 1.00 0.00 C +ATOM 25 CA ARG A 25 324.278 258.110 205.433 1.00 0.00 C +ATOM 26 CA ARG A 26 326.196 260.968 203.800 1.00 0.00 C +ATOM 27 CA GLN A 27 326.932 262.494 200.387 1.00 0.00 C +ATOM 28 CA VAL A 28 330.251 261.126 199.110 1.00 0.00 C +ATOM 29 CA LEU A 29 332.483 258.603 200.891 1.00 0.00 C +ATOM 30 CA GLU A 30 330.957 255.117 200.719 1.00 0.00 C +ATOM 31 CA VAL A 31 327.950 252.824 201.190 1.00 0.00 C +ATOM 32 CA SER A 32 326.350 249.675 202.618 1.00 0.00 C +ATOM 33 CA MET A 33 325.035 246.723 204.636 1.00 0.00 C +ATOM 34 CA ILE A 34 324.021 245.709 208.166 1.00 0.00 C +ATOM 35 CA GLU A 35 321.903 242.710 209.183 1.00 0.00 C +ATOM 36 CA GLU A 36 321.839 238.913 208.875 1.00 0.00 C +ATOM 37 CA LYS A 37 319.049 238.183 206.386 1.00 0.00 C +ATOM 38 CA ARG A 38 315.330 238.851 205.894 1.00 0.00 C +ATOM 39 CA LYS A 39 313.105 241.933 205.628 1.00 0.00 C +ATOM 40 CA ASP A 40 311.240 242.994 202.479 1.00 0.00 C +ATOM 41 CA ARG A 41 311.180 246.700 201.599 1.00 0.00 C +ATOM 42 CA GLU A 42 310.965 249.124 204.530 1.00 0.00 C +ATOM 43 CA ILE A 43 308.318 249.417 207.255 1.00 0.00 C +ATOM 44 CA ASP A 44 305.716 246.934 208.512 1.00 0.00 C +ATOM 45 CA GLU A 45 302.672 246.512 210.764 1.00 0.00 C +ATOM 46 CA TRP A 46 303.183 243.186 212.550 1.00 0.00 C +ATOM 47 CA ARG A 47 301.815 240.264 210.523 1.00 0.00 C +ATOM 48 CA ARG A 48 298.986 239.671 208.040 1.00 0.00 C +ATOM 49 CA ARG A 49 297.988 236.411 206.339 1.00 0.00 C +ATOM 50 CA ASP A 50 295.948 233.221 205.921 1.00 0.00 C +ATOM 51 CA GLU A 51 295.930 229.435 206.347 1.00 0.00 C +ATOM 52 CA SER A 52 292.715 227.918 207.716 1.00 0.00 C +ATOM 53 CA SER A 53 289.599 228.384 205.574 1.00 0.00 C +ATOM 54 CA SER A 54 287.027 231.167 205.967 1.00 0.00 C +ATOM 55 CA ASN A 55 284.033 233.319 205.006 1.00 0.00 C +ATOM 56 CA VAL A 56 281.194 235.762 204.309 1.00 0.00 C +ATOM 57 CA ASP A 57 278.615 238.566 204.223 1.00 0.00 C +ATOM 58 CA GLY A 58 275.062 237.236 204.575 1.00 0.00 C +ATOM 59 CA GLY A 59 272.261 234.975 205.824 1.00 0.00 C +ATOM 60 CA GLY A 60 271.141 236.565 209.100 1.00 0.00 C +ATOM 61 CA THR A 61 268.178 238.320 210.731 1.00 0.00 C +ATOM 62 CA ARG A 62 265.122 236.057 210.966 1.00 0.00 C +ATOM 63 CA ALA A 63 263.504 233.885 213.645 1.00 0.00 C +ATOM 64 CA THR A 64 262.460 231.035 215.949 1.00 0.00 C +ATOM 65 CA ALA A 65 263.622 229.651 219.303 1.00 0.00 C +ATOM 66 CA THR A 66 266.411 229.980 221.878 1.00 0.00 C +ATOM 67 CA ALA A 67 266.928 231.870 225.145 1.00 0.00 C +ATOM 68 CA ALA A 68 268.908 234.355 227.248 1.00 0.00 C +ATOM 69 CA ALA A 69 270.667 236.171 230.099 1.00 0.00 C +ATOM 70 CA GLY A 70 272.657 235.419 233.259 1.00 0.00 C +ATOM 71 CA ALA A 71 272.279 236.927 236.738 1.00 0.00 C +ATOM 72 CA ARG A 72 271.604 237.255 240.473 1.00 0.00 C +ATOM 73 CA ALA A 73 273.411 240.438 241.532 1.00 0.00 C +ATOM 74 CA MET A 74 276.598 239.450 243.370 1.00 0.00 C +ATOM 75 CA THR A 75 279.692 237.522 244.477 1.00 0.00 C +ATOM 76 CA GLU A 76 282.059 239.832 246.369 1.00 0.00 C +ATOM 77 CA VAL A 77 284.605 240.468 249.131 1.00 0.00 C +ATOM 78 CA ASP A 78 284.053 240.080 252.881 1.00 0.00 C +ATOM 79 CA ALA A 79 281.721 242.027 255.180 1.00 0.00 C +ATOM 80 CA SER A 80 278.549 244.136 255.116 1.00 0.00 C +ATOM 81 CA ASP A 81 277.914 246.605 252.285 1.00 0.00 C +ATOM 82 CA GLY A 82 276.042 249.922 252.376 1.00 0.00 C +ATOM 83 CA ASP A 83 273.195 251.615 254.259 1.00 0.00 C +ATOM 84 CA GLY A 84 272.693 255.035 252.655 1.00 0.00 C +ATOM 85 CA ALA A 85 271.522 256.379 249.288 1.00 0.00 C +ATOM 86 CA THR A 86 272.439 257.457 245.751 1.00 0.00 C +ATOM 87 CA ALA A 87 270.646 258.072 242.446 1.00 0.00 C +ATOM 88 CA VAL A 88 269.616 256.447 239.157 1.00 0.00 C +ATOM 89 CA ALA A 89 266.476 258.178 237.867 1.00 0.00 C +ATOM 90 CA GLY A 90 263.904 260.927 237.282 1.00 0.00 C +ATOM 91 CA VAL A 91 260.101 261.136 237.187 1.00 0.00 C +ATOM 92 CA ASP A 92 256.745 260.437 238.850 1.00 0.00 C +ATOM 93 CA ASN A 93 255.182 257.126 239.905 1.00 0.00 C +ATOM 94 CA GLY A 94 255.070 256.348 243.633 1.00 0.00 C +ATOM 95 CA HIS A 95 256.789 253.123 244.710 1.00 0.00 C +ATOM 96 CA SER A 96 259.069 250.106 244.246 1.00 0.00 C +ATOM 97 CA CYS A 97 259.994 246.435 244.674 1.00 0.00 C +ATOM 98 CA GLY A 98 258.031 243.814 246.622 1.00 0.00 C +ATOM 99 CA GLY A 99 254.568 242.251 246.341 1.00 0.00 C +ATOM 100 CA CYS A 100 251.862 241.016 243.961 1.00 0.00 C +ATOM 101 CA ARG A 101 248.854 243.191 243.102 1.00 0.00 C +ATOM 102 CA ARG A 102 245.344 243.869 241.783 1.00 0.00 C +ATOM 103 CA ARG A 103 241.715 243.071 242.625 1.00 0.00 C +ATOM 104 CA ASP A 104 239.617 244.819 245.282 1.00 0.00 C +ATOM 105 CA GLY A 105 240.106 243.552 248.842 1.00 0.00 C +ATOM 106 CA CYS A 106 239.658 239.778 249.117 1.00 0.00 C +ATOM 107 CA GLY A 107 236.676 237.477 249.685 1.00 0.00 C +ATOM 108 CA ARG A 108 233.738 236.945 247.318 1.00 0.00 C +ATOM 109 CA GLY A 109 232.991 233.212 247.451 1.00 0.00 C +ATOM 110 CA GLY A 110 234.456 231.663 250.608 1.00 0.00 C +ATOM 111 CA ARG A 111 232.003 232.590 253.373 1.00 0.00 C +ATOM 112 CA GLU A 112 228.967 230.327 253.794 1.00 0.00 C +ATOM 113 CA PRO A 113 225.692 231.606 255.262 1.00 0.00 C +ATOM 114 CA ARG A 114 226.417 234.982 256.874 1.00 0.00 C +ATOM 115 CA PRO A 115 228.461 234.549 260.060 1.00 0.00 C +ATOM 116 CA ARG A 116 231.860 235.118 261.684 1.00 0.00 C +ATOM 117 CA MET A 117 234.425 232.939 259.901 1.00 0.00 C +ATOM 118 CA GLN A 118 236.812 231.117 262.246 1.00 0.00 C +ATOM 119 CA ALA A 119 235.136 229.914 265.449 1.00 0.00 C +ATOM 120 CA MET A 120 232.043 228.528 267.189 1.00 0.00 C +ATOM 121 CA ALA A 121 230.134 225.550 265.773 1.00 0.00 C +ATOM 122 CA THR A 122 226.528 224.855 264.759 1.00 0.00 C +ATOM 123 CA GLY A 123 223.956 227.238 266.250 1.00 0.00 C +ATOM 124 CA MET A 124 223.957 230.973 267.001 1.00 0.00 C +ATOM 125 CA ALA A 125 222.102 233.795 268.765 1.00 0.00 C +ATOM 126 CA GLY A 126 220.126 236.002 266.370 1.00 0.00 C +ATOM 127 CA VAL A 127 217.441 235.241 263.776 1.00 0.00 C +ATOM 128 CA ASP A 128 214.503 236.771 261.893 1.00 0.00 C +ATOM 129 CA GLU A 129 211.526 235.037 260.267 1.00 0.00 C +ATOM 130 CA SER A 130 210.328 232.121 262.408 1.00 0.00 C +ATOM 131 CA HIS A 131 208.422 233.289 265.493 1.00 0.00 C +ATOM 132 CA ASN A 132 205.378 233.744 267.740 1.00 0.00 C +ATOM 133 CA CYS A 133 204.573 230.361 269.298 1.00 0.00 C +ATOM 134 CA ALA A 134 202.546 230.388 272.523 1.00 0.00 C +ATOM 135 CA ASP A 135 200.166 231.040 275.426 1.00 0.00 C +ATOM 136 CA VAL A 136 196.562 230.942 274.193 1.00 0.00 C +ATOM 137 CA GLY A 137 193.171 232.256 273.059 1.00 0.00 C +ATOM 138 CA GLY A 138 192.609 235.712 274.560 1.00 0.00 C +ATOM 139 CA ASP A 139 191.505 238.156 271.854 1.00 0.00 C +ATOM 140 CA ASP A 140 190.697 241.618 270.483 1.00 0.00 C +ATOM 141 CA GLY A 141 189.181 244.585 268.635 1.00 0.00 C +ATOM 142 CA CYS A 142 190.278 246.796 265.732 1.00 0.00 C +ATOM 143 CA ASP A 143 189.317 250.183 264.278 1.00 0.00 C +ATOM 144 CA CYS A 144 188.533 252.766 266.967 1.00 0.00 C +ATOM 145 CA GLY A 145 189.489 252.530 270.648 1.00 0.00 C +ATOM 146 CA GLY A 146 189.318 255.509 273.017 1.00 0.00 C +ATOM 147 CA ARG A 147 192.701 255.638 274.766 1.00 0.00 C +ATOM 148 CA GLU A 148 192.192 256.024 278.522 1.00 0.00 C +ATOM 149 CA PRO A 149 193.954 254.564 281.568 1.00 0.00 C +ATOM 150 CA ARG A 150 196.961 256.717 282.482 1.00 0.00 C +ATOM 151 CA LEU A 151 196.617 260.125 284.151 1.00 0.00 C +ATOM 152 CA ARG A 152 196.450 263.894 283.622 1.00 0.00 C +ATOM 153 CA MET A 153 195.639 266.490 280.954 1.00 0.00 C +ATOM 154 CA GLN A 154 193.894 269.812 280.292 1.00 0.00 C +ATOM 155 CA ALA A 155 195.036 272.822 278.255 1.00 0.00 C +ATOM 156 CA THR A 156 194.668 275.899 280.473 1.00 0.00 C +ATOM 157 CA ALA A 157 193.272 277.439 283.666 1.00 0.00 C +ATOM 158 CA ARG A 158 189.878 275.885 284.430 1.00 0.00 C +ATOM 159 CA ARG A 159 186.292 275.356 285.603 1.00 0.00 C +ATOM 160 CA ARG A 160 184.124 277.242 288.104 1.00 0.00 C +ATOM 161 CA GLY A 161 185.503 280.347 289.829 1.00 0.00 C +ATOM 162 CA PRO A 162 185.825 280.872 293.589 1.00 0.00 C +ATOM 163 CA GLN A 163 182.702 280.711 295.766 1.00 0.00 C +ATOM 164 CA GLY A 164 180.224 279.042 298.130 1.00 0.00 C +ATOM 165 CA ASP A 165 180.776 280.129 301.739 1.00 0.00 C +ATOM 166 CA GLU A 166 182.308 281.357 305.004 1.00 0.00 C +ATOM 167 CA GLY A 167 181.866 281.436 308.788 1.00 0.00 C +ATOM 168 CA ASP A 168 179.987 278.679 310.627 1.00 0.00 C +ATOM 169 CA GLY A 169 179.766 276.769 313.917 1.00 0.00 C +ATOM 170 CA GLY A 170 178.329 276.571 317.440 1.00 0.00 C +ATOM 171 CA ARG A 171 181.288 275.798 319.712 1.00 0.00 C +ATOM 172 CA ARG A 172 184.769 277.104 320.548 1.00 0.00 C +ATOM 173 CA GLN A 173 187.595 274.596 321.034 1.00 0.00 C +ATOM 174 CA PRO A 174 188.344 273.942 324.712 1.00 0.00 C +ATOM 175 CA GLN A 175 185.547 273.678 327.285 1.00 0.00 C +ATOM 176 CA GLY A 176 181.871 274.366 326.556 1.00 0.00 C +ATOM 177 CA ASP A 177 178.764 272.688 327.986 1.00 0.00 C +ATOM 178 CA GLU A 178 179.396 269.552 330.056 1.00 0.00 C +ATOM 179 CA ASP A 179 181.951 267.201 328.487 1.00 0.00 C +ATOM 180 CA ASP A 180 181.609 266.135 324.846 1.00 0.00 C +ATOM 181 CA ASP A 181 180.210 266.307 321.306 1.00 0.00 C +ATOM 182 CA ALA A 182 178.766 264.372 318.359 1.00 0.00 C +ATOM 183 CA THR A 183 176.687 261.684 316.638 1.00 0.00 C +ATOM 184 CA MET A 184 176.309 257.892 316.659 1.00 0.00 C +ATOM 185 CA PRO A 185 177.196 255.713 319.656 1.00 0.00 C +ATOM 186 CA VAL A 186 174.776 255.234 322.558 1.00 0.00 C +ATOM 187 CA GLU A 187 175.104 251.721 323.996 1.00 0.00 C +ATOM 188 CA PRO A 188 174.873 251.173 327.759 1.00 0.00 C +ATOM 189 CA ASP A 189 178.286 251.615 329.394 1.00 0.00 C +ATOM 190 CA GLU A 190 180.731 250.871 332.220 1.00 0.00 C +ATOM 191 CA GLY A 191 183.908 252.959 331.973 1.00 0.00 C +ATOM 192 CA SER A 192 185.892 255.800 333.557 1.00 0.00 C +ATOM 193 CA TRP A 193 189.630 255.203 333.131 1.00 0.00 C +ATOM 194 CA SER A 194 191.553 253.912 330.105 1.00 0.00 C +ATOM 195 CA THR A 195 194.117 251.195 330.852 1.00 0.00 C +TER 196 THR A 195 +END diff --git a/Plants/Q84SN7/Q84SN7.dcd b/Plants/Q84SN7/Q84SN7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..8f6ba61231c15f25950bd2ec5f377036beaecb86 --- /dev/null +++ b/Plants/Q84SN7/Q84SN7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:815c650dcec8f8d49c877e657402d2520d8bde14f55ec6db23690f180a662b8d +size 8360276 diff --git a/Plants/Q84SN7/top.pdb b/Plants/Q84SN7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a82600d09261e103a45be0ad3ed3c11d7006725d --- /dev/null +++ b/Plants/Q84SN7/top.pdb @@ -0,0 +1,67 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 250.011 278.129 208.118 1.00 0.00 C +ATOM 2 CA SER A 2 249.511 274.540 206.941 1.00 0.00 C +ATOM 3 CA THR A 3 251.628 271.841 208.599 1.00 0.00 C +ATOM 4 CA ALA A 4 254.267 269.629 210.230 1.00 0.00 C +ATOM 5 CA GLY A 5 255.413 266.725 208.046 1.00 0.00 C +ATOM 6 CA GLY A 6 257.476 264.225 210.049 1.00 0.00 C +ATOM 7 CA GLY A 7 257.725 261.263 212.433 1.00 0.00 C +ATOM 8 CA TYR A 8 260.169 259.353 214.645 1.00 0.00 C +ATOM 9 CA LYS A 9 258.338 256.761 216.753 1.00 0.00 C +ATOM 10 CA GLU A 10 260.664 253.748 216.921 1.00 0.00 C +ATOM 11 CA ALA A 11 259.301 251.044 219.233 1.00 0.00 C +ATOM 12 CA LYS A 12 258.486 247.489 218.129 1.00 0.00 C +ATOM 13 CA GLN A 13 257.668 243.769 218.178 1.00 0.00 C +ATOM 14 CA GLU A 14 257.475 240.522 216.194 1.00 0.00 C +ATOM 15 CA GLN A 15 257.974 237.199 214.397 1.00 0.00 C +ATOM 16 CA GLN A 16 261.114 235.311 215.440 1.00 0.00 C +ATOM 17 CA ASP A 17 262.381 234.333 218.898 1.00 0.00 C +ATOM 18 CA GLU A 18 260.895 236.880 221.310 1.00 0.00 C +ATOM 19 CA GLY A 19 257.712 238.812 222.116 1.00 0.00 C +ATOM 20 CA ILE A 20 256.532 239.113 225.726 1.00 0.00 C +ATOM 21 CA ARG A 21 256.512 242.512 227.448 1.00 0.00 C +ATOM 22 CA ARG A 22 254.499 242.259 230.672 1.00 0.00 C +ATOM 23 CA GLU A 23 254.925 239.634 233.401 1.00 0.00 C +ATOM 24 CA LEU A 24 253.134 237.639 236.108 1.00 0.00 C +ATOM 25 CA SER A 25 254.018 237.621 239.814 1.00 0.00 C +ATOM 26 CA VAL A 26 254.785 238.789 243.359 1.00 0.00 C +ATOM 27 CA ALA A 27 253.279 241.631 245.401 1.00 0.00 C +ATOM 28 CA VAL A 28 255.214 243.567 248.051 1.00 0.00 C +ATOM 29 CA ALA A 29 255.157 247.377 248.067 1.00 0.00 C +ATOM 30 CA THR A 30 253.299 250.174 249.867 1.00 0.00 C +ATOM 31 CA GLU A 31 249.703 249.980 248.623 1.00 0.00 C +ATOM 32 CA VAL A 32 246.766 248.855 250.773 1.00 0.00 C +ATOM 33 CA SER A 33 245.185 245.817 252.441 1.00 0.00 C +ATOM 34 CA ARG A 34 242.400 244.770 254.822 1.00 0.00 C +ATOM 35 CA ASN A 35 241.073 243.172 258.016 1.00 0.00 C +ATOM 36 CA GLY A 36 242.421 239.610 258.116 1.00 0.00 C +ATOM 37 CA CYS A 37 241.718 238.171 261.573 1.00 0.00 C +ATOM 38 CA GLY A 38 239.620 235.365 263.070 1.00 0.00 C +ATOM 39 CA ASP A 39 236.146 235.186 264.625 1.00 0.00 C +ATOM 40 CA ASN A 40 233.471 235.696 267.290 1.00 0.00 C +ATOM 41 CA ALA A 41 232.639 239.143 268.685 1.00 0.00 C +ATOM 42 CA CYS A 42 230.755 240.455 271.725 1.00 0.00 C +ATOM 43 CA SER A 43 228.847 243.752 271.621 1.00 0.00 C +ATOM 44 CA ASN A 44 230.080 246.693 269.536 1.00 0.00 C +ATOM 45 CA PHE A 45 231.909 249.519 271.320 1.00 0.00 C +ATOM 46 CA GLY A 46 235.660 250.051 270.911 1.00 0.00 C +ATOM 47 CA TRP A 47 239.411 249.617 270.403 1.00 0.00 C +ATOM 48 CA ARG A 48 241.648 249.252 273.465 1.00 0.00 C +ATOM 49 CA ARG A 49 243.570 251.920 275.391 1.00 0.00 C +ATOM 50 CA GLY A 50 246.428 254.153 276.558 1.00 0.00 C +ATOM 51 CA GLY A 51 249.745 254.371 278.419 1.00 0.00 C +ATOM 52 CA GLU A 52 253.188 255.919 278.934 1.00 0.00 C +ATOM 53 CA GLU A 53 255.719 256.886 281.613 1.00 0.00 C +ATOM 54 CA PRO A 54 255.733 257.318 285.398 1.00 0.00 C +ATOM 55 CA ALA A 55 257.350 258.670 288.572 1.00 0.00 C +ATOM 56 CA TRP A 56 259.393 261.031 290.757 1.00 0.00 C +ATOM 57 CA PRO A 57 258.500 264.318 292.463 1.00 0.00 C +ATOM 58 CA ALA A 58 255.092 265.926 291.905 1.00 0.00 C +ATOM 59 CA ALA A 59 251.913 264.347 290.520 1.00 0.00 C +ATOM 60 CA ALA A 60 250.902 260.865 289.349 1.00 0.00 C +ATOM 61 CA ALA A 61 247.532 259.961 290.880 1.00 0.00 C +ATOM 62 CA GLU A 62 244.150 259.141 292.431 1.00 0.00 C +ATOM 63 CA CYS A 63 241.769 258.183 295.247 1.00 0.00 C +TER 64 CYS A 63 +END diff --git a/Plants/Q84ST6/Q84ST6.dcd b/Plants/Q84ST6/Q84ST6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..a9a95c411c4b02bc38c52a6de14ee788c893e30f --- /dev/null +++ b/Plants/Q84ST6/Q84ST6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:8df227748620b14e28a2c4d22006a767535dba6d0c4f22fd9e112e91f495dd5d +size 6800276 diff --git a/Plants/Q84ST6/top.pdb b/Plants/Q84ST6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..bc46538d22dd40589ab47f594b7bfd451f630492 --- /dev/null +++ b/Plants/Q84ST6/top.pdb @@ -0,0 +1,54 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 237.936 234.531 224.012 1.00 0.00 C +ATOM 2 CA ALA A 2 237.970 230.828 223.115 1.00 0.00 C +ATOM 3 CA SER A 3 238.080 227.306 221.667 1.00 0.00 C +ATOM 4 CA ARG A 4 239.815 224.102 222.781 1.00 0.00 C +ATOM 5 CA ALA A 5 238.770 220.441 222.633 1.00 0.00 C +ATOM 6 CA ILE A 6 241.538 218.241 224.053 1.00 0.00 C +ATOM 7 CA VAL A 7 243.868 219.091 226.945 1.00 0.00 C +ATOM 8 CA THR A 8 244.444 222.515 228.513 1.00 0.00 C +ATOM 9 CA VAL A 9 242.760 225.908 228.926 1.00 0.00 C +ATOM 10 CA GLY A 10 243.080 227.940 232.133 1.00 0.00 C +ATOM 11 CA PHE A 11 246.409 229.351 233.333 1.00 0.00 C +ATOM 12 CA THR A 12 250.021 230.510 232.978 1.00 0.00 C +ATOM 13 CA SER A 13 252.380 231.292 230.091 1.00 0.00 C +ATOM 14 CA PRO A 14 255.601 233.321 229.924 1.00 0.00 C +ATOM 15 CA ARG A 15 256.472 236.682 231.492 1.00 0.00 C +ATOM 16 CA ALA A 16 253.924 239.125 232.925 1.00 0.00 C +ATOM 17 CA THR A 17 250.996 239.335 235.355 1.00 0.00 C +ATOM 18 CA PRO A 18 250.262 243.045 235.814 1.00 0.00 C +ATOM 19 CA SER A 19 248.363 245.555 233.666 1.00 0.00 C +ATOM 20 CA ALA A 20 245.291 246.899 235.475 1.00 0.00 C +ATOM 21 CA SER A 21 243.180 246.541 238.627 1.00 0.00 C +ATOM 22 CA PRO A 22 240.302 244.954 240.554 1.00 0.00 C +ATOM 23 CA SER A 23 239.968 244.224 244.278 1.00 0.00 C +ATOM 24 CA PRO A 24 241.849 245.338 247.398 1.00 0.00 C +ATOM 25 CA PHE A 25 242.684 246.073 251.042 1.00 0.00 C +ATOM 26 CA SER A 26 243.016 249.663 252.274 1.00 0.00 C +ATOM 27 CA ALA A 27 245.817 251.126 250.146 1.00 0.00 C +ATOM 28 CA ALA A 28 249.422 252.324 249.850 1.00 0.00 C +ATOM 29 CA GLY A 29 252.828 253.910 249.223 1.00 0.00 C +ATOM 30 CA THR A 30 255.390 253.720 252.036 1.00 0.00 C +ATOM 31 CA PRO A 31 258.917 255.112 251.657 1.00 0.00 C +ATOM 32 CA PHE A 32 259.471 258.738 252.686 1.00 0.00 C +ATOM 33 CA ALA A 33 260.819 261.771 254.556 1.00 0.00 C +ATOM 34 CA PRO A 34 261.437 262.127 258.299 1.00 0.00 C +ATOM 35 CA HIS A 35 261.181 260.573 261.768 1.00 0.00 C +ATOM 36 CA ALA A 36 260.314 259.187 265.210 1.00 0.00 C +ATOM 37 CA GLU A 37 258.023 261.203 267.491 1.00 0.00 C +ATOM 38 CA ASN A 38 256.245 264.171 269.086 1.00 0.00 C +ATOM 39 CA SER A 39 257.400 267.586 270.319 1.00 0.00 C +ATOM 40 CA SER A 40 260.205 269.144 272.375 1.00 0.00 C +ATOM 41 CA GLU A 41 260.918 271.625 275.177 1.00 0.00 C +ATOM 42 CA LEU A 42 258.183 273.683 276.851 1.00 0.00 C +ATOM 43 CA CYS A 43 257.186 277.338 277.257 1.00 0.00 C +ATOM 44 CA LEU A 44 254.613 280.060 277.953 1.00 0.00 C +ATOM 45 CA SER A 45 254.926 280.857 281.666 1.00 0.00 C +ATOM 46 CA PRO A 46 252.301 280.523 284.408 1.00 0.00 C +ATOM 47 CA PHE A 47 250.764 279.023 287.555 1.00 0.00 C +ATOM 48 CA LYS A 48 247.803 276.632 287.733 1.00 0.00 C +ATOM 49 CA SER A 49 248.462 273.876 285.187 1.00 0.00 C +ATOM 50 CA GLN A 50 248.396 272.881 281.509 1.00 0.00 C +TER 51 GLN A 50 +END diff --git a/Plants/Q84SW4/Q84SW4.dcd b/Plants/Q84SW4/Q84SW4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..7d36e1863ff07601925315c7a1927db55c112d93 --- /dev/null +++ b/Plants/Q84SW4/Q84SW4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:9f238ba6a43a49ffe5f8bafcf7223d112147c6e7a704d00ce8cec2ccbbd90ae6 +size 5600276 diff --git a/Plants/Q84SW4/top.pdb b/Plants/Q84SW4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..f067d92c4ab6b5a8c8fdcaa583a8ea9a072b38d6 --- /dev/null +++ b/Plants/Q84SW4/top.pdb @@ -0,0 +1,44 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 242.321 238.312 220.004 1.00 0.00 C +ATOM 2 CA SER A 2 241.855 235.912 222.926 1.00 0.00 C +ATOM 3 CA THR A 3 239.022 233.456 222.247 1.00 0.00 C +ATOM 4 CA ARG A 4 237.143 232.762 225.487 1.00 0.00 C +ATOM 5 CA ARG A 5 237.585 235.569 228.025 1.00 0.00 C +ATOM 6 CA CYS A 6 239.082 237.566 230.903 1.00 0.00 C +ATOM 7 CA ARG A 7 241.666 240.362 230.742 1.00 0.00 C +ATOM 8 CA PRO A 8 240.687 242.547 227.778 1.00 0.00 C +ATOM 9 CA PRO A 9 239.858 245.457 225.463 1.00 0.00 C +ATOM 10 CA HIS A 10 238.770 248.812 226.902 1.00 0.00 C +ATOM 11 CA ALA A 11 240.019 250.179 230.232 1.00 0.00 C +ATOM 12 CA GLU A 12 241.721 251.726 233.269 1.00 0.00 C +ATOM 13 CA GLY A 13 241.250 253.493 236.611 1.00 0.00 C +ATOM 14 CA GLU A 14 240.416 255.905 239.440 1.00 0.00 C +ATOM 15 CA ALA A 15 238.359 254.754 242.433 1.00 0.00 C +ATOM 16 CA GLU A 16 238.627 257.053 245.459 1.00 0.00 C +ATOM 17 CA ASP A 17 241.848 258.148 247.175 1.00 0.00 C +ATOM 18 CA GLU A 18 245.605 257.754 246.683 1.00 0.00 C +ATOM 19 CA GLU A 19 248.703 258.614 248.728 1.00 0.00 C +ATOM 20 CA ARG A 20 251.591 260.002 250.789 1.00 0.00 C +ATOM 21 CA HIS A 21 252.876 259.170 254.278 1.00 0.00 C +ATOM 22 CA GLY A 22 253.335 255.620 255.584 1.00 0.00 C +ATOM 23 CA HIS A 23 256.840 254.335 254.822 1.00 0.00 C +ATOM 24 CA VAL A 24 257.436 253.762 251.102 1.00 0.00 C +ATOM 25 CA ASP A 25 260.528 255.765 250.134 1.00 0.00 C +ATOM 26 CA PRO A 26 264.060 255.479 251.534 1.00 0.00 C +ATOM 27 CA LEU A 27 265.752 255.878 254.924 1.00 0.00 C +ATOM 28 CA LEU A 28 264.914 254.127 258.202 1.00 0.00 C +ATOM 29 CA CYS A 29 264.471 251.235 260.642 1.00 0.00 C +ATOM 30 CA THR A 30 263.639 251.988 264.284 1.00 0.00 C +ATOM 31 CA LEU A 31 264.309 250.459 267.708 1.00 0.00 C +ATOM 32 CA THR A 32 261.334 250.437 270.088 1.00 0.00 C +ATOM 33 CA THR A 33 257.990 251.813 268.887 1.00 0.00 C +ATOM 34 CA ARG A 34 254.761 251.700 270.907 1.00 0.00 C +ATOM 35 CA ARG A 35 252.928 250.345 273.959 1.00 0.00 C +ATOM 36 CA PRO A 36 251.250 249.459 277.263 1.00 0.00 C +ATOM 37 CA GLU A 37 253.682 250.506 280.002 1.00 0.00 C +ATOM 38 CA ARG A 38 254.620 248.897 283.326 1.00 0.00 C +ATOM 39 CA GLY A 39 258.168 249.848 284.336 1.00 0.00 C +ATOM 40 CA GLY A 40 260.982 250.794 286.724 1.00 0.00 C +TER 41 GLY A 40 +END diff --git a/Plants/Q84SW5/Q84SW5.dcd b/Plants/Q84SW5/Q84SW5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..51b82188cab99c3ba0d3c2e6d455479284317927 --- /dev/null +++ b/Plants/Q84SW5/Q84SW5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:82d618150649b7fa4fa0dd80bf5b13878a2ae6f0c10aaa95554abe48270443f6 +size 16280276 diff --git a/Plants/Q84SW5/top.pdb b/Plants/Q84SW5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..1fbf6d187618ae3bed864dd3e5236e9a4b6c962e --- /dev/null +++ b/Plants/Q84SW5/top.pdb @@ -0,0 +1,133 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 251.341 228.823 193.030 1.00 0.00 C +ATOM 2 CA PRO A 2 253.903 230.357 195.396 1.00 0.00 C +ATOM 3 CA GLY A 3 256.904 230.271 197.742 1.00 0.00 C +ATOM 4 CA ARG A 4 258.568 232.120 200.628 1.00 0.00 C +ATOM 5 CA PRO A 5 261.934 230.736 201.755 1.00 0.00 C +ATOM 6 CA ASN A 6 262.965 228.167 204.373 1.00 0.00 C +ATOM 7 CA VAL A 7 263.234 226.944 207.971 1.00 0.00 C +ATOM 8 CA PRO A 8 265.765 228.524 210.340 1.00 0.00 C +ATOM 9 CA VAL A 9 267.735 230.991 212.473 1.00 0.00 C +ATOM 10 CA GLU A 10 271.424 230.666 211.576 1.00 0.00 C +ATOM 11 CA GLY A 11 275.065 229.677 212.104 1.00 0.00 C +ATOM 12 CA PRO A 12 278.082 227.382 212.488 1.00 0.00 C +ATOM 13 CA ARG A 13 278.329 225.505 215.794 1.00 0.00 C +ATOM 14 CA HIS A 14 279.430 226.902 219.164 1.00 0.00 C +ATOM 15 CA GLY A 15 280.611 228.746 222.282 1.00 0.00 C +ATOM 16 CA PRO A 16 280.419 232.517 222.789 1.00 0.00 C +ATOM 17 CA VAL A 17 278.347 233.907 219.909 1.00 0.00 C +ATOM 18 CA ASN A 18 276.156 237.022 220.026 1.00 0.00 C +ATOM 19 CA ALA A 19 274.673 239.804 222.165 1.00 0.00 C +ATOM 20 CA GLY A 20 271.717 238.944 224.409 1.00 0.00 C +ATOM 21 CA GLN A 21 267.934 239.046 224.850 1.00 0.00 C +ATOM 22 CA SER A 22 265.494 237.577 227.381 1.00 0.00 C +ATOM 23 CA SER A 23 262.624 236.079 229.389 1.00 0.00 C +ATOM 24 CA SER A 24 259.947 233.778 230.824 1.00 0.00 C +ATOM 25 CA ALA A 25 256.487 233.410 232.376 1.00 0.00 C +ATOM 26 CA ASP A 26 256.668 231.926 235.880 1.00 0.00 C +ATOM 27 CA HIS A 27 258.513 228.653 236.514 1.00 0.00 C +ATOM 28 CA ASP A 28 262.217 227.792 236.743 1.00 0.00 C +ATOM 29 CA ALA A 29 264.077 227.730 233.419 1.00 0.00 C +ATOM 30 CA ARG A 30 262.068 227.664 230.182 1.00 0.00 C +ATOM 31 CA VAL A 31 258.423 226.767 229.534 1.00 0.00 C +ATOM 32 CA GLY A 32 257.164 223.194 229.126 1.00 0.00 C +ATOM 33 CA ARG A 33 258.392 222.050 225.706 1.00 0.00 C +ATOM 34 CA SER A 34 256.379 223.690 222.918 1.00 0.00 C +ATOM 35 CA LEU A 35 252.914 222.195 222.395 1.00 0.00 C +ATOM 36 CA PRO A 36 250.324 224.981 222.172 1.00 0.00 C +ATOM 37 CA ALA A 37 248.005 228.000 222.019 1.00 0.00 C +ATOM 38 CA VAL A 38 248.359 231.188 219.963 1.00 0.00 C +ATOM 39 CA SER A 39 245.658 233.794 220.618 1.00 0.00 C +ATOM 40 CA CYS A 40 246.277 236.943 218.563 1.00 0.00 C +ATOM 41 CA ALA A 41 248.722 235.921 215.826 1.00 0.00 C +ATOM 42 CA GLY A 42 251.312 234.573 213.379 1.00 0.00 C +ATOM 43 CA ARG A 43 252.582 232.512 210.437 1.00 0.00 C +ATOM 44 CA GLY A 44 253.608 235.017 207.756 1.00 0.00 C +ATOM 45 CA GLY A 45 256.951 236.377 208.978 1.00 0.00 C +ATOM 46 CA GLY A 46 257.573 240.075 208.307 1.00 0.00 C +ATOM 47 CA ARG A 47 257.010 242.193 211.424 1.00 0.00 C +ATOM 48 CA CYS A 48 259.669 243.749 213.666 1.00 0.00 C +ATOM 49 CA PHE A 49 260.378 246.195 216.500 1.00 0.00 C +ATOM 50 CA ARG A 50 262.287 247.245 219.625 1.00 0.00 C +ATOM 51 CA PRO A 51 265.782 248.682 220.113 1.00 0.00 C +ATOM 52 CA GLY A 52 267.937 250.709 222.513 1.00 0.00 C +ATOM 53 CA GLY A 53 268.852 253.877 220.605 1.00 0.00 C +ATOM 54 CA ALA A 54 270.891 256.580 222.354 1.00 0.00 C +ATOM 55 CA ARG A 55 269.866 257.096 225.987 1.00 0.00 C +ATOM 56 CA GLN A 56 268.902 260.750 226.469 1.00 0.00 C +ATOM 57 CA LYS A 57 265.311 261.779 227.218 1.00 0.00 C +ATOM 58 CA ARG A 58 262.842 260.506 224.610 1.00 0.00 C +ATOM 59 CA ARG A 59 259.612 258.664 223.781 1.00 0.00 C +ATOM 60 CA THR A 60 256.295 257.747 225.417 1.00 0.00 C +ATOM 61 CA ARG A 61 252.873 257.759 227.092 1.00 0.00 C +ATOM 62 CA VAL A 62 251.291 254.935 229.101 1.00 0.00 C +ATOM 63 CA GLU A 63 251.780 255.585 232.823 1.00 0.00 C +ATOM 64 CA GLY A 64 250.817 257.941 235.658 1.00 0.00 C +ATOM 65 CA SER A 65 251.391 261.655 236.280 1.00 0.00 C +ATOM 66 CA PRO A 66 248.692 264.325 236.605 1.00 0.00 C +ATOM 67 CA ALA A 67 249.912 267.625 238.068 1.00 0.00 C +ATOM 68 CA ARG A 68 249.449 271.238 236.952 1.00 0.00 C +ATOM 69 CA CYS A 69 247.907 274.527 238.102 1.00 0.00 C +ATOM 70 CA ALA A 70 244.242 274.317 239.122 1.00 0.00 C +ATOM 71 CA ARG A 71 241.003 273.970 237.146 1.00 0.00 C +ATOM 72 CA ARG A 72 237.314 274.777 237.649 1.00 0.00 C +ATOM 73 CA LYS A 73 235.036 271.788 237.026 1.00 0.00 C +ATOM 74 CA GLU A 74 232.594 271.859 239.949 1.00 0.00 C +ATOM 75 CA LEU A 75 232.042 271.718 243.716 1.00 0.00 C +ATOM 76 CA ALA A 76 232.995 269.395 246.581 1.00 0.00 C +ATOM 77 CA ILE A 77 230.868 266.234 246.526 1.00 0.00 C +ATOM 78 CA SER A 78 233.023 263.439 247.962 1.00 0.00 C +ATOM 79 CA GLY A 79 233.414 263.694 251.743 1.00 0.00 C +ATOM 80 CA ALA A 80 233.612 267.012 253.606 1.00 0.00 C +ATOM 81 CA ARG A 81 232.866 266.240 257.262 1.00 0.00 C +ATOM 82 CA VAL A 82 232.600 263.679 260.070 1.00 0.00 C +ATOM 83 CA GLY A 83 235.907 263.155 261.888 1.00 0.00 C +ATOM 84 CA SER A 84 237.168 264.748 265.111 1.00 0.00 C +ATOM 85 CA GLY A 85 239.056 264.837 268.420 1.00 0.00 C +ATOM 86 CA ARG A 86 240.646 264.735 271.881 1.00 0.00 C +ATOM 87 CA GLY A 87 240.736 261.189 273.272 1.00 0.00 C +ATOM 88 CA PRO A 88 238.952 257.833 273.003 1.00 0.00 C +ATOM 89 CA VAL A 89 235.298 256.811 272.660 1.00 0.00 C +ATOM 90 CA ALA A 90 232.463 254.986 274.434 1.00 0.00 C +ATOM 91 CA ARG A 91 229.838 253.892 271.898 1.00 0.00 C +ATOM 92 CA SER A 92 228.516 250.326 271.672 1.00 0.00 C +ATOM 93 CA LEU A 93 230.723 248.341 274.060 1.00 0.00 C +ATOM 94 CA GLY A 94 231.450 246.461 277.294 1.00 0.00 C +ATOM 95 CA ALA A 95 233.073 249.028 279.594 1.00 0.00 C +ATOM 96 CA ARG A 96 234.820 249.152 282.977 1.00 0.00 C +ATOM 97 CA ARG A 97 238.254 250.484 283.951 1.00 0.00 C +ATOM 98 CA PRO A 98 237.504 253.687 285.874 1.00 0.00 C +ATOM 99 CA ARG A 99 237.852 256.524 288.393 1.00 0.00 C +ATOM 100 CA ARG A 100 238.109 255.816 292.128 1.00 0.00 C +ATOM 101 CA ALA A 101 240.466 256.646 295.004 1.00 0.00 C +ATOM 102 CA ARG A 102 244.108 256.533 296.117 1.00 0.00 C +ATOM 103 CA GLY A 103 246.120 257.506 299.202 1.00 0.00 C +ATOM 104 CA GLU A 104 249.842 258.213 298.798 1.00 0.00 C +ATOM 105 CA GLU A 105 252.466 260.812 297.862 1.00 0.00 C +ATOM 106 CA LEU A 106 253.059 264.456 298.802 1.00 0.00 C +ATOM 107 CA ALA A 107 251.144 267.454 300.166 1.00 0.00 C +ATOM 108 CA GLY A 108 252.373 269.406 303.199 1.00 0.00 C +ATOM 109 CA LEU A 109 251.486 270.850 306.611 1.00 0.00 C +ATOM 110 CA ASP A 110 250.879 270.637 310.367 1.00 0.00 C +ATOM 111 CA ALA A 111 252.847 268.515 312.844 1.00 0.00 C +ATOM 112 CA SER A 112 254.255 264.975 312.899 1.00 0.00 C +ATOM 113 CA ARG A 113 252.851 261.767 314.401 1.00 0.00 C +ATOM 114 CA SER A 114 251.823 259.688 311.378 1.00 0.00 C +ATOM 115 CA ARG A 115 249.500 257.008 309.986 1.00 0.00 C +ATOM 116 CA ALA A 116 246.711 258.648 307.974 1.00 0.00 C +ATOM 117 CA ARG A 117 245.107 262.011 308.775 1.00 0.00 C +ATOM 118 CA GLU A 118 241.530 262.955 307.867 1.00 0.00 C +ATOM 119 CA GLY A 119 237.751 262.471 307.823 1.00 0.00 C +ATOM 120 CA SER A 120 235.330 261.677 310.656 1.00 0.00 C +ATOM 121 CA PRO A 121 232.072 260.348 309.195 1.00 0.00 C +ATOM 122 CA ALA A 122 229.798 258.614 306.678 1.00 0.00 C +ATOM 123 CA GLY A 123 228.041 261.344 304.685 1.00 0.00 C +ATOM 124 CA ARG A 124 224.278 261.728 304.224 1.00 0.00 C +ATOM 125 CA THR A 125 220.500 261.394 303.867 1.00 0.00 C +ATOM 126 CA ARG A 126 217.194 261.340 301.974 1.00 0.00 C +ATOM 127 CA GLU A 127 216.566 261.485 298.219 1.00 0.00 C +ATOM 128 CA GLU A 128 215.983 264.402 295.838 1.00 0.00 C +ATOM 129 CA GLY A 129 218.934 266.693 295.090 1.00 0.00 C +TER 130 GLY A 129 +END diff --git a/Plants/Q84T26/Q84T26.dcd b/Plants/Q84T26/Q84T26.dcd new file mode 100644 index 0000000000000000000000000000000000000000..cce74cb7e649623b9aa78729e3e643394ee3fc74 --- /dev/null +++ b/Plants/Q84T26/Q84T26.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:eddb8337dd5d55f723e23a0f9febc8f78c5267d6b2c4ec137c0326f518a32e20 +size 19520276 diff --git a/Plants/Q84T26/top.pdb b/Plants/Q84T26/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..1ae870bbbaa295f1a011677105b4eb931056b59c --- /dev/null +++ b/Plants/Q84T26/top.pdb @@ -0,0 +1,160 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 294.845 269.753 256.683 1.00 0.00 C +ATOM 2 CA ALA A 2 298.019 267.699 257.154 1.00 0.00 C +ATOM 3 CA ALA A 3 300.124 265.518 254.846 1.00 0.00 C +ATOM 4 CA ALA A 4 298.478 262.679 252.909 1.00 0.00 C +ATOM 5 CA GLY A 5 297.976 259.418 254.814 1.00 0.00 C +ATOM 6 CA ARG A 6 297.287 258.342 258.403 1.00 0.00 C +ATOM 7 CA ALA A 7 294.952 256.055 260.363 1.00 0.00 C +ATOM 8 CA ARG A 8 292.649 257.151 263.193 1.00 0.00 C +ATOM 9 CA ARG A 9 289.172 256.308 264.502 1.00 0.00 C +ATOM 10 CA ARG A 10 286.129 258.589 264.275 1.00 0.00 C +ATOM 11 CA PRO A 11 285.671 260.814 267.334 1.00 0.00 C +ATOM 12 CA ARG A 12 288.136 263.688 267.758 1.00 0.00 C +ATOM 13 CA ARG A 13 291.636 265.084 267.194 1.00 0.00 C +ATOM 14 CA HIS A 14 294.575 267.195 266.000 1.00 0.00 C +ATOM 15 CA SER A 15 295.328 270.602 264.470 1.00 0.00 C +ATOM 16 CA ARG A 16 294.628 274.342 264.660 1.00 0.00 C +ATOM 17 CA ARG A 17 292.477 276.039 262.013 1.00 0.00 C +ATOM 18 CA GLU A 18 293.841 278.685 259.635 1.00 0.00 C +ATOM 19 CA ALA A 19 291.095 281.261 259.052 1.00 0.00 C +ATOM 20 CA THR A 20 290.128 284.798 258.016 1.00 0.00 C +ATOM 21 CA ARG A 21 289.456 284.625 254.270 1.00 0.00 C +ATOM 22 CA PRO A 22 292.149 285.225 251.642 1.00 0.00 C +ATOM 23 CA ARG A 23 293.629 282.393 249.566 1.00 0.00 C +ATOM 24 CA PRO A 24 294.363 278.792 250.571 1.00 0.00 C +ATOM 25 CA ASP A 25 292.424 276.093 252.434 1.00 0.00 C +ATOM 26 CA GLY A 26 290.362 272.890 252.520 1.00 0.00 C +ATOM 27 CA ARG A 27 287.184 270.929 251.766 1.00 0.00 C +ATOM 28 CA ARG A 28 283.390 271.255 251.891 1.00 0.00 C +ATOM 29 CA ARG A 29 281.454 267.992 252.230 1.00 0.00 C +ATOM 30 CA ARG A 30 280.886 264.256 252.718 1.00 0.00 C +ATOM 31 CA PRO A 31 279.012 261.056 253.592 1.00 0.00 C +ATOM 32 CA PRO A 32 275.807 261.723 255.542 1.00 0.00 C +ATOM 33 CA ALA A 33 276.435 263.107 259.036 1.00 0.00 C +ATOM 34 CA ARG A 34 279.388 264.835 260.712 1.00 0.00 C +ATOM 35 CA ARG A 35 280.786 268.378 260.607 1.00 0.00 C +ATOM 36 CA SER A 36 282.538 270.875 262.889 1.00 0.00 C +ATOM 37 CA GLY A 37 282.749 273.545 265.599 1.00 0.00 C +ATOM 38 CA GLY A 38 282.705 276.482 268.025 1.00 0.00 C +ATOM 39 CA ARG A 39 285.408 278.673 269.578 1.00 0.00 C +ATOM 40 CA GLU A 40 285.760 282.446 269.183 1.00 0.00 C +ATOM 41 CA ARG A 41 282.330 284.104 269.145 1.00 0.00 C +ATOM 42 CA GLY A 42 281.574 284.983 265.516 1.00 0.00 C +ATOM 43 CA GLY A 43 281.868 286.154 261.902 1.00 0.00 C +ATOM 44 CA LYS A 44 280.093 285.512 258.593 1.00 0.00 C +ATOM 45 CA GLY A 45 279.065 283.927 255.284 1.00 0.00 C +ATOM 46 CA GLU A 46 278.680 284.702 251.573 1.00 0.00 C +ATOM 47 CA VAL A 47 280.063 282.710 248.634 1.00 0.00 C +ATOM 48 CA LYS A 48 278.740 280.014 246.289 1.00 0.00 C +ATOM 49 CA ARG A 49 276.557 277.664 248.346 1.00 0.00 C +ATOM 50 CA ARG A 50 275.988 274.833 250.831 1.00 0.00 C +ATOM 51 CA SER A 51 277.942 275.375 254.056 1.00 0.00 C +ATOM 52 CA SER A 52 280.777 277.524 255.422 1.00 0.00 C +ATOM 53 CA ALA A 53 284.275 278.374 254.172 1.00 0.00 C +ATOM 54 CA HIS A 54 285.821 280.626 251.516 1.00 0.00 C +ATOM 55 CA PRO A 55 286.133 283.332 248.852 1.00 0.00 C +ATOM 56 CA GLY A 56 286.599 285.068 245.493 1.00 0.00 C +ATOM 57 CA SER A 57 284.007 283.432 243.230 1.00 0.00 C +ATOM 58 CA THR A 58 283.003 281.202 240.308 1.00 0.00 C +ATOM 59 CA ALA A 59 281.579 280.482 236.848 1.00 0.00 C +ATOM 60 CA THR A 60 278.275 282.368 236.651 1.00 0.00 C +ATOM 61 CA THR A 61 275.881 283.898 239.189 1.00 0.00 C +ATOM 62 CA GLY A 62 274.666 281.646 242.013 1.00 0.00 C +ATOM 63 CA THR A 63 270.972 281.527 242.937 1.00 0.00 C +ATOM 64 CA ALA A 64 268.931 284.249 244.652 1.00 0.00 C +ATOM 65 CA THR A 65 266.242 286.241 246.473 1.00 0.00 C +ATOM 66 CA GLU A 66 265.541 287.240 250.082 1.00 0.00 C +ATOM 67 CA ALA A 67 262.403 288.369 251.926 1.00 0.00 C +ATOM 68 CA GLU A 68 259.340 286.104 251.966 1.00 0.00 C +ATOM 69 CA ARG A 69 259.225 282.899 249.910 1.00 0.00 C +ATOM 70 CA GLY A 70 257.977 282.544 246.328 1.00 0.00 C +ATOM 71 CA GLY A 71 260.465 281.898 243.516 1.00 0.00 C +ATOM 72 CA GLY A 72 260.390 278.545 241.709 1.00 0.00 C +ATOM 73 CA ALA A 73 258.448 275.289 242.083 1.00 0.00 C +ATOM 74 CA ALA A 74 256.575 272.598 244.025 1.00 0.00 C +ATOM 75 CA ARG A 75 257.429 271.398 247.539 1.00 0.00 C +ATOM 76 CA VAL A 76 256.012 272.601 250.864 1.00 0.00 C +ATOM 77 CA ASP A 77 256.677 270.072 253.635 1.00 0.00 C +ATOM 78 CA GLU A 78 257.873 266.512 254.278 1.00 0.00 C +ATOM 79 CA ASP A 79 259.230 263.174 253.039 1.00 0.00 C +ATOM 80 CA GLY A 80 262.425 261.541 251.759 1.00 0.00 C +ATOM 81 CA GLY A 81 264.219 258.186 251.556 1.00 0.00 C +ATOM 82 CA ALA A 82 267.777 256.856 251.259 1.00 0.00 C +ATOM 83 CA PRO A 83 270.061 256.483 248.233 1.00 0.00 C +ATOM 84 CA ALA A 84 269.508 257.292 244.551 1.00 0.00 C +ATOM 85 CA VAL A 85 267.632 256.957 241.252 1.00 0.00 C +ATOM 86 CA GLY A 86 264.788 254.680 240.139 1.00 0.00 C +ATOM 87 CA GLY A 87 262.487 254.696 237.102 1.00 0.00 C +ATOM 88 CA ARG A 88 258.837 254.039 236.228 1.00 0.00 C +ATOM 89 CA ASN A 89 258.032 250.340 236.656 1.00 0.00 C +ATOM 90 CA GLY A 90 258.527 248.827 240.118 1.00 0.00 C +ATOM 91 CA GLY A 91 255.769 246.410 241.152 1.00 0.00 C +ATOM 92 CA VAL A 92 254.878 244.584 244.374 1.00 0.00 C +ATOM 93 CA ASP A 93 252.392 241.704 244.167 1.00 0.00 C +ATOM 94 CA GLU A 94 251.685 239.539 241.112 1.00 0.00 C +ATOM 95 CA VAL A 95 247.928 239.187 240.585 1.00 0.00 C +ATOM 96 CA ASP A 96 245.148 236.739 239.691 1.00 0.00 C +ATOM 97 CA GLU A 97 242.319 236.977 237.151 1.00 0.00 C +ATOM 98 CA ASP A 98 239.298 236.689 234.847 1.00 0.00 C +ATOM 99 CA VAL A 99 236.535 235.082 232.773 1.00 0.00 C +ATOM 100 CA ALA A 100 235.622 231.801 234.481 1.00 0.00 C +ATOM 101 CA LYS A 101 233.498 230.850 237.497 1.00 0.00 C +ATOM 102 CA PRO A 102 230.970 228.110 236.711 1.00 0.00 C +ATOM 103 CA LYS A 103 228.867 225.255 238.105 1.00 0.00 C +ATOM 104 CA GLU A 104 227.867 225.157 241.781 1.00 0.00 C +ATOM 105 CA ALA A 105 224.980 225.054 244.264 1.00 0.00 C +ATOM 106 CA MET A 106 224.985 226.935 247.577 1.00 0.00 C +ATOM 107 CA PRO A 107 221.986 227.290 249.899 1.00 0.00 C +ATOM 108 CA LYS A 108 219.525 225.382 252.095 1.00 0.00 C +ATOM 109 CA ARG A 109 217.677 228.014 254.139 1.00 0.00 C +ATOM 110 CA GLU A 110 215.649 230.127 256.575 1.00 0.00 C +ATOM 111 CA GLU A 111 212.381 231.579 255.262 1.00 0.00 C +ATOM 112 CA VAL A 112 209.787 228.997 254.204 1.00 0.00 C +ATOM 113 CA ARG A 113 206.357 228.024 252.861 1.00 0.00 C +ATOM 114 CA CYS A 114 202.911 227.417 251.352 1.00 0.00 C +ATOM 115 CA ASP A 115 199.388 228.711 250.701 1.00 0.00 C +ATOM 116 CA ASP A 116 196.360 229.374 252.917 1.00 0.00 C +ATOM 117 CA GLY A 117 192.734 230.462 252.488 1.00 0.00 C +ATOM 118 CA GLY A 118 189.108 231.584 252.153 1.00 0.00 C +ATOM 119 CA GLU A 119 187.220 231.875 255.449 1.00 0.00 C +ATOM 120 CA PRO A 120 185.592 231.819 258.894 1.00 0.00 C +ATOM 121 CA LYS A 121 185.046 233.632 262.200 1.00 0.00 C +ATOM 122 CA LEU A 122 186.962 231.897 264.999 1.00 0.00 C +ATOM 123 CA GLY A 123 188.843 228.584 264.972 1.00 0.00 C +ATOM 124 CA GLY A 124 188.801 226.237 261.972 1.00 0.00 C +ATOM 125 CA ASP A 125 189.778 222.564 262.242 1.00 0.00 C +ATOM 126 CA GLY A 126 192.186 219.985 260.803 1.00 0.00 C +ATOM 127 CA GLY A 127 193.767 219.285 257.408 1.00 0.00 C +ATOM 128 CA GLU A 128 195.642 220.226 254.228 1.00 0.00 C +ATOM 129 CA ARG A 129 198.467 219.925 251.690 1.00 0.00 C +ATOM 130 CA GLY A 130 199.460 216.247 251.781 1.00 0.00 C +ATOM 131 CA ARG A 131 199.234 212.782 250.214 1.00 0.00 C +ATOM 132 CA ARG A 132 198.360 209.641 248.242 1.00 0.00 C +ATOM 133 CA ARG A 133 196.585 206.350 248.973 1.00 0.00 C +ATOM 134 CA GLU A 134 194.506 203.434 247.671 1.00 0.00 C +ATOM 135 CA LEU A 135 195.027 199.660 247.613 1.00 0.00 C +ATOM 136 CA ASP A 136 195.853 196.004 246.929 1.00 0.00 C +ATOM 137 CA SER A 137 196.726 193.708 244.017 1.00 0.00 C +ATOM 138 CA GLY A 138 198.647 192.324 241.032 1.00 0.00 C +ATOM 139 CA GLY A 139 202.344 191.527 240.568 1.00 0.00 C +ATOM 140 CA GLU A 140 205.410 191.688 238.312 1.00 0.00 C +ATOM 141 CA ARG A 141 206.415 193.526 235.130 1.00 0.00 C +ATOM 142 CA GLU A 142 205.543 196.799 233.385 1.00 0.00 C +ATOM 143 CA ARG A 143 203.392 199.196 235.421 1.00 0.00 C +ATOM 144 CA ARG A 144 204.153 202.736 236.606 1.00 0.00 C +ATOM 145 CA VAL A 145 205.359 205.508 238.925 1.00 0.00 C +ATOM 146 CA ALA A 146 205.709 209.215 239.734 1.00 0.00 C +ATOM 147 CA GLU A 147 207.546 209.325 243.070 1.00 0.00 C +ATOM 148 CA THR A 148 211.061 209.043 244.512 1.00 0.00 C +ATOM 149 CA GLU A 149 214.185 208.305 242.459 1.00 0.00 C +ATOM 150 CA GLU A 150 214.144 204.594 241.594 1.00 0.00 C +ATOM 151 CA GLY A 151 210.881 202.702 241.057 1.00 0.00 C +ATOM 152 CA GLY A 152 210.757 201.624 237.405 1.00 0.00 C +ATOM 153 CA THR A 153 211.336 204.447 234.913 1.00 0.00 C +ATOM 154 CA GLY A 154 210.391 207.183 232.435 1.00 0.00 C +ATOM 155 CA SER A 155 206.877 208.639 232.663 1.00 0.00 C +ATOM 156 CA ALA A 156 206.225 212.044 234.243 1.00 0.00 C +TER 157 ALA A 156 +END diff --git a/Plants/Q84TR8/Q84TR8.dcd b/Plants/Q84TR8/Q84TR8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..9295dd4bb9b39984df5fb998388139b1222f0cb6 --- /dev/null +++ b/Plants/Q84TR8/Q84TR8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:d51ef5fdebf8c2572b3b6f087990ec06f9daf088f637034f7aafcac91ca948bd +size 10520276 diff --git a/Plants/Q84TR8/top.pdb b/Plants/Q84TR8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..1c379d06d0ca8c0cb92fe6b49b0cd8b526860469 --- /dev/null +++ b/Plants/Q84TR8/top.pdb @@ -0,0 +1,85 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 214.295 257.228 275.024 1.00 0.00 C +ATOM 2 CA ALA A 2 216.769 259.692 276.547 1.00 0.00 C +ATOM 3 CA GLY A 3 216.372 263.373 275.645 1.00 0.00 C +ATOM 4 CA ASP A 4 216.370 267.133 275.034 1.00 0.00 C +ATOM 5 CA GLU A 5 217.550 269.926 272.726 1.00 0.00 C +ATOM 6 CA GLY A 6 219.875 270.687 269.805 1.00 0.00 C +ATOM 7 CA ALA A 7 223.410 272.093 270.009 1.00 0.00 C +ATOM 8 CA ALA A 8 226.015 274.540 268.690 1.00 0.00 C +ATOM 9 CA THR A 9 228.821 275.027 271.220 1.00 0.00 C +ATOM 10 CA ALA A 10 232.450 275.016 270.059 1.00 0.00 C +ATOM 11 CA ALA A 11 234.793 272.073 270.665 1.00 0.00 C +ATOM 12 CA ARG A 12 236.977 270.258 273.204 1.00 0.00 C +ATOM 13 CA LEU A 13 239.978 272.525 273.811 1.00 0.00 C +ATOM 14 CA ALA A 14 241.698 274.834 276.306 1.00 0.00 C +ATOM 15 CA ARG A 15 244.856 276.593 275.102 1.00 0.00 C +ATOM 16 CA GLY A 16 247.620 276.298 277.708 1.00 0.00 C +ATOM 17 CA GLY A 17 249.927 273.338 277.052 1.00 0.00 C +ATOM 18 CA GLY A 18 250.804 269.710 276.290 1.00 0.00 C +ATOM 19 CA ALA A 19 251.523 267.508 273.264 1.00 0.00 C +ATOM 20 CA PRO A 20 255.064 268.422 272.194 1.00 0.00 C +ATOM 21 CA VAL A 21 255.839 267.397 268.607 1.00 0.00 C +ATOM 22 CA THR A 22 256.435 265.142 265.595 1.00 0.00 C +ATOM 23 CA GLY A 23 256.326 263.856 262.010 1.00 0.00 C +ATOM 24 CA ASP A 24 253.257 261.601 261.891 1.00 0.00 C +ATOM 25 CA GLY A 25 250.453 260.143 264.019 1.00 0.00 C +ATOM 26 CA LYS A 26 249.477 256.740 262.610 1.00 0.00 C +ATOM 27 CA GLY A 27 250.815 253.196 262.201 1.00 0.00 C +ATOM 28 CA ARG A 28 248.114 250.834 260.919 1.00 0.00 C +ATOM 29 CA VAL A 29 248.565 247.627 258.913 1.00 0.00 C +ATOM 30 CA ALA A 30 251.270 245.112 257.976 1.00 0.00 C +ATOM 31 CA GLU A 31 253.437 242.376 256.448 1.00 0.00 C +ATOM 32 CA LEU A 32 256.461 240.888 254.672 1.00 0.00 C +ATOM 33 CA PRO A 33 258.256 240.802 251.312 1.00 0.00 C +ATOM 34 CA LEU A 34 258.180 244.113 249.428 1.00 0.00 C +ATOM 35 CA THR A 35 260.479 245.763 246.877 1.00 0.00 C +ATOM 36 CA THR A 36 264.039 245.256 248.137 1.00 0.00 C +ATOM 37 CA ALA A 37 266.190 245.381 244.995 1.00 0.00 C +ATOM 38 CA HIS A 38 269.641 243.836 244.524 1.00 0.00 C +ATOM 39 CA PRO A 39 270.984 240.300 244.982 1.00 0.00 C +ATOM 40 CA THR A 40 271.794 236.724 246.018 1.00 0.00 C +ATOM 41 CA VAL A 41 272.651 236.006 249.661 1.00 0.00 C +ATOM 42 CA VAL A 42 274.649 234.773 252.661 1.00 0.00 C +ATOM 43 CA THR A 43 273.021 235.819 255.943 1.00 0.00 C +ATOM 44 CA ALA A 44 271.162 239.065 256.666 1.00 0.00 C +ATOM 45 CA THR A 45 268.912 239.288 259.733 1.00 0.00 C +ATOM 46 CA GLY A 46 267.084 242.630 259.781 1.00 0.00 C +ATOM 47 CA GLU A 47 267.156 244.457 256.438 1.00 0.00 C +ATOM 48 CA ASP A 48 264.910 242.841 253.820 1.00 0.00 C +ATOM 49 CA ASP A 49 266.531 239.931 251.970 1.00 0.00 C +ATOM 50 CA GLY A 50 264.700 239.140 248.724 1.00 0.00 C +ATOM 51 CA ASP A 51 263.987 238.435 245.048 1.00 0.00 C +ATOM 52 CA GLY A 52 261.888 235.902 243.126 1.00 0.00 C +ATOM 53 CA GLY A 53 261.277 232.476 241.575 1.00 0.00 C +ATOM 54 CA ALA A 54 258.437 230.228 242.758 1.00 0.00 C +ATOM 55 CA ALA A 55 258.586 226.522 243.631 1.00 0.00 C +ATOM 56 CA ALA A 56 257.700 223.293 241.813 1.00 0.00 C +ATOM 57 CA PRO A 57 254.571 223.316 239.639 1.00 0.00 C +ATOM 58 CA ASP A 58 251.327 224.819 238.325 1.00 0.00 C +ATOM 59 CA MET A 59 248.294 226.818 239.476 1.00 0.00 C +ATOM 60 CA ALA A 60 247.114 229.764 241.584 1.00 0.00 C +ATOM 61 CA GLY A 61 248.617 233.265 241.533 1.00 0.00 C +ATOM 62 CA GLY A 62 252.126 234.422 242.463 1.00 0.00 C +ATOM 63 CA ASP A 63 254.182 237.619 242.727 1.00 0.00 C +ATOM 64 CA GLY A 64 252.512 239.895 245.286 1.00 0.00 C +ATOM 65 CA LEU A 65 249.102 241.409 244.513 1.00 0.00 C +ATOM 66 CA LEU A 66 249.030 242.644 240.909 1.00 0.00 C +ATOM 67 CA GLY A 67 248.707 244.842 237.814 1.00 0.00 C +ATOM 68 CA GLY A 68 246.191 245.654 235.071 1.00 0.00 C +ATOM 69 CA GLY A 69 245.647 245.954 231.312 1.00 0.00 C +ATOM 70 CA GLY A 70 245.845 245.438 227.542 1.00 0.00 C +ATOM 71 CA ASP A 71 245.860 247.133 224.130 1.00 0.00 C +ATOM 72 CA GLY A 72 247.294 249.911 221.953 1.00 0.00 C +ATOM 73 CA ALA A 73 249.941 250.440 219.264 1.00 0.00 C +ATOM 74 CA THR A 74 249.129 249.645 215.627 1.00 0.00 C +ATOM 75 CA GLU A 75 248.755 250.573 211.951 1.00 0.00 C +ATOM 76 CA HIS A 76 245.180 249.837 210.858 1.00 0.00 C +ATOM 77 CA GLY A 77 242.765 249.059 208.016 1.00 0.00 C +ATOM 78 CA LYS A 78 243.843 248.873 204.366 1.00 0.00 C +ATOM 79 CA ALA A 79 241.182 250.187 201.977 1.00 0.00 C +ATOM 80 CA TRP A 80 238.779 252.581 200.242 1.00 0.00 C +ATOM 81 CA GLU A 81 236.184 251.736 197.584 1.00 0.00 C +TER 82 GLU A 81 +END diff --git a/Plants/Q84TY0/Q84TY0.dcd b/Plants/Q84TY0/Q84TY0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..dde9019af61c57666798133ab26baa3ecfff4058 --- /dev/null +++ b/Plants/Q84TY0/Q84TY0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:3c4a832228b074773dccc4844b6b1cbfbe0dca4356c364507d6f2c8bbef75c74 +size 12320276 diff --git a/Plants/Q84TY0/top.pdb b/Plants/Q84TY0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..260e3fb26bad79c03210f34ab03808ab79e32482 --- /dev/null +++ b/Plants/Q84TY0/top.pdb @@ -0,0 +1,100 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 267.907 231.014 237.837 1.00 0.00 C +ATOM 2 CA GLY A 2 269.204 234.584 238.132 1.00 0.00 C +ATOM 3 CA PRO A 3 268.828 238.375 238.073 1.00 0.00 C +ATOM 4 CA ILE A 4 271.515 240.376 239.887 1.00 0.00 C +ATOM 5 CA TRP A 5 269.965 243.121 242.027 1.00 0.00 C +ATOM 6 CA GLN A 6 267.949 244.101 245.108 1.00 0.00 C +ATOM 7 CA ARG A 7 267.036 245.472 248.544 1.00 0.00 C +ATOM 8 CA GLN A 8 269.142 245.698 251.711 1.00 0.00 C +ATOM 9 CA VAL A 9 268.216 244.368 255.159 1.00 0.00 C +ATOM 10 CA GLY A 10 265.369 243.647 257.585 1.00 0.00 C +ATOM 11 CA ARG A 11 263.799 240.185 257.852 1.00 0.00 C +ATOM 12 CA ARG A 12 261.507 237.209 258.489 1.00 0.00 C +ATOM 13 CA PRO A 13 263.586 234.016 258.466 1.00 0.00 C +ATOM 14 CA ALA A 14 264.734 231.027 256.401 1.00 0.00 C +ATOM 15 CA GLY A 15 263.580 231.262 252.777 1.00 0.00 C +ATOM 16 CA ARG A 16 263.214 233.983 250.135 1.00 0.00 C +ATOM 17 CA GLY A 17 265.382 237.014 249.345 1.00 0.00 C +ATOM 18 CA ARG A 18 263.652 239.948 247.637 1.00 0.00 C +ATOM 19 CA ARG A 19 260.688 240.813 249.869 1.00 0.00 C +ATOM 20 CA GLY A 20 258.766 239.603 252.928 1.00 0.00 C +ATOM 21 CA GLY A 21 256.437 236.622 252.468 1.00 0.00 C +ATOM 22 CA ALA A 22 257.747 233.339 253.890 1.00 0.00 C +ATOM 23 CA ALA A 23 255.238 230.561 254.603 1.00 0.00 C +ATOM 24 CA ALA A 24 253.015 228.395 252.394 1.00 0.00 C +ATOM 25 CA ASP A 25 251.321 228.382 248.981 1.00 0.00 C +ATOM 26 CA GLY A 26 254.009 229.373 246.469 1.00 0.00 C +ATOM 27 CA GLY A 27 253.362 231.847 243.645 1.00 0.00 C +ATOM 28 CA GLY A 28 253.708 231.137 239.917 1.00 0.00 C +ATOM 29 CA GLY A 29 255.458 228.619 237.656 1.00 0.00 C +ATOM 30 CA GLY A 30 253.442 226.703 235.053 1.00 0.00 C +ATOM 31 CA SER A 31 250.439 224.538 235.955 1.00 0.00 C +ATOM 32 CA MET A 32 248.689 221.709 234.098 1.00 0.00 C +ATOM 33 CA GLY A 33 245.328 222.258 232.388 1.00 0.00 C +ATOM 34 CA GLY A 34 244.049 223.035 228.884 1.00 0.00 C +ATOM 35 CA GLY A 35 243.114 224.913 225.704 1.00 0.00 C +ATOM 36 CA GLU A 36 240.932 226.950 223.337 1.00 0.00 C +ATOM 37 CA GLY A 37 238.576 229.737 224.431 1.00 0.00 C +ATOM 38 CA GLY A 38 237.641 232.258 227.131 1.00 0.00 C +ATOM 39 CA ALA A 39 234.547 231.153 229.060 1.00 0.00 C +ATOM 40 CA TRP A 40 233.625 231.208 232.757 1.00 0.00 C +ATOM 41 CA GLY A 41 233.749 234.857 233.847 1.00 0.00 C +ATOM 42 CA GLY A 42 230.629 236.211 235.564 1.00 0.00 C +ATOM 43 CA PRO A 43 229.116 237.849 238.653 1.00 0.00 C +ATOM 44 CA THR A 44 225.875 239.834 238.928 1.00 0.00 C +ATOM 45 CA ALA A 45 223.344 238.625 236.350 1.00 0.00 C +ATOM 46 CA ARG A 46 222.736 234.955 237.174 1.00 0.00 C +ATOM 47 CA LEU A 47 224.543 234.051 240.405 1.00 0.00 C +ATOM 48 CA PRO A 48 224.576 232.944 244.050 1.00 0.00 C +ATOM 49 CA ARG A 49 222.137 235.270 245.827 1.00 0.00 C +ATOM 50 CA ARG A 50 222.831 238.790 244.543 1.00 0.00 C +ATOM 51 CA ARG A 51 224.113 242.082 245.970 1.00 0.00 C +ATOM 52 CA CYS A 52 226.723 244.742 246.763 1.00 0.00 C +ATOM 53 CA GLY A 53 229.448 246.777 245.046 1.00 0.00 C +ATOM 54 CA ALA A 54 230.830 250.058 243.689 1.00 0.00 C +ATOM 55 CA PRO A 55 233.145 252.994 242.958 1.00 0.00 C +ATOM 56 CA SER A 56 235.369 256.087 242.901 1.00 0.00 C +ATOM 57 CA TRP A 57 236.164 258.935 240.498 1.00 0.00 C +ATOM 58 CA LEU A 58 239.283 258.824 238.312 1.00 0.00 C +ATOM 59 CA ARG A 59 240.486 256.930 235.232 1.00 0.00 C +ATOM 60 CA GLU A 60 242.257 257.463 231.901 1.00 0.00 C +ATOM 61 CA ARG A 61 240.978 260.387 229.819 1.00 0.00 C +ATOM 62 CA LEU A 62 242.637 263.694 230.727 1.00 0.00 C +ATOM 63 CA SER A 63 243.604 267.286 231.551 1.00 0.00 C +ATOM 64 CA THR A 64 242.408 270.375 229.670 1.00 0.00 C +ATOM 65 CA MET A 65 244.725 273.325 228.998 1.00 0.00 C +ATOM 66 CA ARG A 66 247.112 275.066 231.404 1.00 0.00 C +ATOM 67 CA ASN A 67 249.146 278.017 232.696 1.00 0.00 C +ATOM 68 CA GLY A 68 248.034 278.813 236.252 1.00 0.00 C +ATOM 69 CA THR A 69 248.807 279.280 239.954 1.00 0.00 C +ATOM 70 CA ALA A 70 247.491 281.168 242.990 1.00 0.00 C +ATOM 71 CA ARG A 71 248.426 281.338 246.680 1.00 0.00 C +ATOM 72 CA HIS A 72 248.196 277.722 247.856 1.00 0.00 C +ATOM 73 CA ARG A 73 245.370 276.454 250.074 1.00 0.00 C +ATOM 74 CA ALA A 74 246.248 273.099 251.652 1.00 0.00 C +ATOM 75 CA GLY A 75 248.629 274.010 254.483 1.00 0.00 C +ATOM 76 CA GLY A 76 247.855 272.972 258.066 1.00 0.00 C +ATOM 77 CA GLU A 77 249.213 273.626 261.565 1.00 0.00 C +ATOM 78 CA ARG A 78 248.254 273.315 265.239 1.00 0.00 C +ATOM 79 CA GLY A 79 250.776 271.890 267.713 1.00 0.00 C +ATOM 80 CA GLY A 80 252.429 274.414 270.040 1.00 0.00 C +ATOM 81 CA GLY A 81 256.166 274.198 270.747 1.00 0.00 C +ATOM 82 CA ARG A 82 256.976 274.753 274.428 1.00 0.00 C +ATOM 83 CA ARG A 83 259.254 272.673 276.665 1.00 0.00 C +ATOM 84 CA ARG A 84 259.847 269.865 279.171 1.00 0.00 C +ATOM 85 CA ALA A 85 263.590 269.771 279.877 1.00 0.00 C +ATOM 86 CA THR A 86 264.443 266.107 280.481 1.00 0.00 C +ATOM 87 CA LEU A 87 268.208 265.558 280.682 1.00 0.00 C +ATOM 88 CA VAL A 88 270.130 268.227 282.606 1.00 0.00 C +ATOM 89 CA PRO A 89 269.237 268.105 286.308 1.00 0.00 C +ATOM 90 CA ALA A 90 265.754 268.285 287.842 1.00 0.00 C +ATOM 91 CA GLY A 91 262.338 269.971 287.764 1.00 0.00 C +ATOM 92 CA TRP A 92 258.589 269.384 288.099 1.00 0.00 C +ATOM 93 CA ARG A 93 258.288 266.188 290.150 1.00 0.00 C +ATOM 94 CA ASP A 94 259.980 263.447 292.185 1.00 0.00 C +ATOM 95 CA GLY A 95 259.210 260.049 290.642 1.00 0.00 C +ATOM 96 CA GLY A 96 255.578 260.336 289.528 1.00 0.00 C +TER 97 GLY A 96 +END diff --git a/Plants/Q84V51/Q84V51.dcd b/Plants/Q84V51/Q84V51.dcd new file mode 100644 index 0000000000000000000000000000000000000000..fd791beed4af8728a013ee5baaeb05b1c855dbfe --- /dev/null +++ b/Plants/Q84V51/Q84V51.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:7650198fd94d54599b47f748a96b60b23b7f709273271edb2e8c32105a750745 +size 16040276 diff --git a/Plants/Q84V51/top.pdb b/Plants/Q84V51/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..7877567608cc0026fccf19bb1b05f942fd326045 --- /dev/null +++ b/Plants/Q84V51/top.pdb @@ -0,0 +1,131 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA ILE A 1 283.588 302.712 234.276 1.00 0.00 C +ATOM 2 CA ARG A 2 286.142 302.288 237.071 1.00 0.00 C +ATOM 3 CA VAL A 3 285.980 303.868 240.535 1.00 0.00 C +ATOM 4 CA ASP A 4 284.874 304.003 244.178 1.00 0.00 C +ATOM 5 CA GLN A 5 286.028 302.166 247.310 1.00 0.00 C +ATOM 6 CA TYR A 6 286.744 300.388 250.603 1.00 0.00 C +ATOM 7 CA GLY A 7 284.835 300.816 253.872 1.00 0.00 C +ATOM 8 CA ASN A 8 284.494 304.273 255.437 1.00 0.00 C +ATOM 9 CA THR A 9 284.185 304.686 259.212 1.00 0.00 C +ATOM 10 CA VAL A 10 286.413 302.480 261.377 1.00 0.00 C +ATOM 11 CA ARG A 11 287.287 298.910 262.382 1.00 0.00 C +ATOM 12 CA THR A 12 289.822 296.230 261.433 1.00 0.00 C +ATOM 13 CA ASP A 13 288.993 292.586 260.691 1.00 0.00 C +ATOM 14 CA GLU A 14 286.082 290.640 259.189 1.00 0.00 C +ATOM 15 CA TYR A 15 285.911 288.655 255.941 1.00 0.00 C +ATOM 16 CA GLY A 16 283.887 286.136 253.923 1.00 0.00 C +ATOM 17 CA ASN A 17 285.740 282.920 253.065 1.00 0.00 C +ATOM 18 CA PRO A 18 284.785 279.489 251.711 1.00 0.00 C +ATOM 19 CA ILE A 19 281.483 277.955 250.586 1.00 0.00 C +ATOM 20 CA ARG A 20 280.843 275.500 247.744 1.00 0.00 C +ATOM 21 CA THR A 21 278.012 272.990 247.299 1.00 0.00 C +ATOM 22 CA ASP A 22 278.409 270.617 250.254 1.00 0.00 C +ATOM 23 CA GLU A 23 277.634 271.545 253.867 1.00 0.00 C +ATOM 24 CA TYR A 24 274.616 272.148 256.114 1.00 0.00 C +ATOM 25 CA GLY A 25 272.465 271.387 259.165 1.00 0.00 C +ATOM 26 CA ASN A 26 269.431 271.274 261.466 1.00 0.00 C +ATOM 27 CA PRO A 27 269.025 268.370 263.899 1.00 0.00 C +ATOM 28 CA ILE A 28 267.632 264.948 264.826 1.00 0.00 C +ATOM 29 CA HIS A 29 265.470 261.862 264.258 1.00 0.00 C +ATOM 30 CA HIS A 30 263.630 259.393 262.015 1.00 0.00 C +ATOM 31 CA THR A 31 260.945 258.232 259.573 1.00 0.00 C +ATOM 32 CA ALA A 32 257.362 257.928 260.831 1.00 0.00 C +ATOM 33 CA GLY A 33 255.156 255.283 259.201 1.00 0.00 C +ATOM 34 CA THR A 34 252.472 252.927 260.526 1.00 0.00 C +ATOM 35 CA THR A 35 249.289 250.887 260.052 1.00 0.00 C +ATOM 36 CA ALA A 36 247.466 251.374 256.742 1.00 0.00 C +ATOM 37 CA GLY A 37 249.242 253.951 254.568 1.00 0.00 C +ATOM 38 CA TYR A 38 247.743 256.416 252.080 1.00 0.00 C +ATOM 39 CA GLY A 39 244.932 258.163 250.193 1.00 0.00 C +ATOM 40 CA ALA A 40 242.153 255.799 249.094 1.00 0.00 C +ATOM 41 CA GLY A 41 240.365 255.539 245.740 1.00 0.00 C +ATOM 42 CA GLY A 42 238.395 254.558 242.630 1.00 0.00 C +ATOM 43 CA PHE A 43 237.185 252.921 239.409 1.00 0.00 C +ATOM 44 CA ASP A 44 235.569 250.139 237.369 1.00 0.00 C +ATOM 45 CA THR A 45 233.737 250.848 234.104 1.00 0.00 C +ATOM 46 CA THR A 46 233.534 253.018 230.980 1.00 0.00 C +ATOM 47 CA THR A 47 235.280 253.583 227.641 1.00 0.00 C +ATOM 48 CA PRO A 48 238.892 252.459 228.095 1.00 0.00 C +ATOM 49 CA GLN A 49 239.825 253.600 231.608 1.00 0.00 C +ATOM 50 CA GLY A 50 241.855 256.604 232.779 1.00 0.00 C +ATOM 51 CA MET A 51 244.815 258.241 234.532 1.00 0.00 C +ATOM 52 CA ARG A 52 248.555 257.525 234.393 1.00 0.00 C +ATOM 53 CA HIS A 53 249.219 255.029 237.194 1.00 0.00 C +ATOM 54 CA ASP A 54 247.356 251.742 236.699 1.00 0.00 C +ATOM 55 CA VAL A 55 244.400 250.541 238.780 1.00 0.00 C +ATOM 56 CA THR A 56 243.975 248.151 241.718 1.00 0.00 C +ATOM 57 CA GLY A 57 243.288 244.480 242.470 1.00 0.00 C +ATOM 58 CA THR A 58 245.378 241.375 241.759 1.00 0.00 C +ATOM 59 CA ARG A 59 246.800 237.845 241.942 1.00 0.00 C +ATOM 60 CA GLY A 60 249.199 237.652 244.895 1.00 0.00 C +ATOM 61 CA VAL A 61 252.048 235.229 244.171 1.00 0.00 C +ATOM 62 CA SER A 62 255.825 235.233 244.671 1.00 0.00 C +ATOM 63 CA GLY A 63 259.382 236.207 243.713 1.00 0.00 C +ATOM 64 CA LYS A 64 261.452 233.018 243.471 1.00 0.00 C +ATOM 65 CA LEU A 65 261.002 229.394 242.386 1.00 0.00 C +ATOM 66 CA HIS A 66 259.661 229.003 238.841 1.00 0.00 C +ATOM 67 CA ARG A 67 256.623 228.466 236.605 1.00 0.00 C +ATOM 68 CA SER A 68 254.759 231.253 234.797 1.00 0.00 C +ATOM 69 CA SER A 69 251.283 232.305 235.951 1.00 0.00 C +ATOM 70 CA GLU A 70 248.590 230.908 233.647 1.00 0.00 C +ATOM 71 CA ASP A 71 250.254 228.862 230.898 1.00 0.00 C +ATOM 72 CA ASP A 72 252.935 230.682 228.894 1.00 0.00 C +ATOM 73 CA GLY A 73 251.808 230.345 225.271 1.00 0.00 C +ATOM 74 CA HIS A 74 248.122 230.968 224.532 1.00 0.00 C +ATOM 75 CA GLY A 75 247.345 228.805 221.493 1.00 0.00 C +ATOM 76 CA GLY A 76 244.724 226.082 221.971 1.00 0.00 C +ATOM 77 CA ARG A 77 245.927 223.981 224.913 1.00 0.00 C +ATOM 78 CA ARG A 78 244.073 224.677 228.168 1.00 0.00 C +ATOM 79 CA LYS A 79 241.830 223.731 231.098 1.00 0.00 C +ATOM 80 CA LYS A 80 241.619 226.923 233.168 1.00 0.00 C +ATOM 81 CA LYS A 81 238.364 228.823 232.607 1.00 0.00 C +ATOM 82 CA GLY A 82 236.431 231.323 230.479 1.00 0.00 C +ATOM 83 CA LEU A 83 233.763 234.044 230.460 1.00 0.00 C +ATOM 84 CA ALA A 84 230.448 235.303 229.068 1.00 0.00 C +ATOM 85 CA GLU A 85 227.067 236.918 229.760 1.00 0.00 C +ATOM 86 CA LYS A 86 227.807 240.613 230.321 1.00 0.00 C +ATOM 87 CA ILE A 87 228.322 244.365 229.903 1.00 0.00 C +ATOM 88 CA LYS A 88 226.247 246.816 231.952 1.00 0.00 C +ATOM 89 CA GLU A 89 223.261 248.813 233.223 1.00 0.00 C +ATOM 90 CA LYS A 90 221.858 250.474 236.352 1.00 0.00 C +ATOM 91 CA ILE A 91 223.446 250.593 239.813 1.00 0.00 C +ATOM 92 CA PRO A 92 226.930 249.978 241.228 1.00 0.00 C +ATOM 93 CA GLY A 93 229.548 250.636 243.916 1.00 0.00 C +ATOM 94 CA VAL A 94 233.311 251.214 243.764 1.00 0.00 C +ATOM 95 CA GLY A 95 234.179 253.336 246.807 1.00 0.00 C +ATOM 96 CA ASN A 96 233.020 255.272 249.877 1.00 0.00 C +ATOM 97 CA LYS A 97 231.002 254.020 252.856 1.00 0.00 C +ATOM 98 CA ASP A 98 230.130 251.693 255.745 1.00 0.00 C +ATOM 99 CA HIS A 99 231.305 248.074 255.937 1.00 0.00 C +ATOM 100 CA ARG A 100 231.759 244.418 256.910 1.00 0.00 C +ATOM 101 CA SER A 101 229.379 242.144 258.828 1.00 0.00 C +ATOM 102 CA ASN A 102 230.535 241.077 262.297 1.00 0.00 C +ATOM 103 CA THR A 103 230.179 239.421 265.710 1.00 0.00 C +ATOM 104 CA SER A 104 228.983 237.053 268.445 1.00 0.00 C +ATOM 105 CA ALA A 105 231.489 234.184 268.554 1.00 0.00 C +ATOM 106 CA THR A 106 234.842 232.395 268.827 1.00 0.00 C +ATOM 107 CA THR A 107 238.122 230.715 267.861 1.00 0.00 C +ATOM 108 CA THR A 108 241.003 232.321 269.767 1.00 0.00 C +ATOM 109 CA GLN A 109 241.945 230.122 272.732 1.00 0.00 C +ATOM 110 CA ALA A 110 245.000 230.176 275.008 1.00 0.00 C +ATOM 111 CA TYR A 111 245.460 228.243 278.258 1.00 0.00 C +ATOM 112 CA ASP A 112 242.877 225.450 278.459 1.00 0.00 C +ATOM 113 CA GLU A 113 239.608 225.706 280.398 1.00 0.00 C +ATOM 114 CA GLY A 114 237.370 228.734 279.812 1.00 0.00 C +ATOM 115 CA GLU A 115 235.644 229.857 276.606 1.00 0.00 C +ATOM 116 CA LEU A 116 232.414 230.000 274.591 1.00 0.00 C +ATOM 117 CA ARG A 117 232.159 227.131 272.096 1.00 0.00 C +ATOM 118 CA GLN A 118 231.689 224.409 269.472 1.00 0.00 C +ATOM 119 CA HIS A 119 230.056 221.656 267.406 1.00 0.00 C +ATOM 120 CA GLU A 120 227.310 219.631 269.101 1.00 0.00 C +ATOM 121 CA LYS A 121 228.047 217.218 271.957 1.00 0.00 C +ATOM 122 CA LYS A 122 228.884 215.169 275.058 1.00 0.00 C +ATOM 123 CA GLY A 123 232.008 213.106 275.764 1.00 0.00 C +ATOM 124 CA VAL A 124 235.420 211.956 277.010 1.00 0.00 C +ATOM 125 CA MET A 125 238.806 212.855 275.513 1.00 0.00 C +ATOM 126 CA GLU A 126 242.015 211.082 274.475 1.00 0.00 C +ATOM 127 CA LYS A 127 242.477 207.346 275.064 1.00 0.00 C +TER 128 LYS A 127 +END diff --git a/Plants/Q84W99/Q84W99.dcd b/Plants/Q84W99/Q84W99.dcd new file mode 100644 index 0000000000000000000000000000000000000000..bddf0a7374bfa9e056e8689022d695dd692a353d --- /dev/null +++ b/Plants/Q84W99/Q84W99.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f30045002dddd4479fbc931925457aba7d4b815f477e91fb650a636eb886f1ee +size 20600276 diff --git a/Plants/Q84W99/top.pdb b/Plants/Q84W99/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..9485b79032e1d2411799169e1f63aff07edbac15 --- /dev/null +++ b/Plants/Q84W99/top.pdb @@ -0,0 +1,169 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 193.528 252.928 269.771 1.00 0.00 C +ATOM 2 CA THR A 2 190.697 251.070 268.025 1.00 0.00 C +ATOM 3 CA HIS A 3 189.984 249.703 264.541 1.00 0.00 C +ATOM 4 CA VAL A 4 191.204 246.151 263.901 1.00 0.00 C +ATOM 5 CA GLU A 5 190.061 245.159 260.404 1.00 0.00 C +ATOM 6 CA ASP A 6 188.655 241.619 260.496 1.00 0.00 C +ATOM 7 CA ASP A 7 186.158 238.865 259.660 1.00 0.00 C +ATOM 8 CA LYS A 8 187.129 237.538 256.223 1.00 0.00 C +ATOM 9 CA GLU A 9 186.525 239.590 253.070 1.00 0.00 C +ATOM 10 CA PHE A 10 185.940 237.222 250.144 1.00 0.00 C +ATOM 11 CA LYS A 11 183.382 238.250 247.514 1.00 0.00 C +ATOM 12 CA GLU A 12 185.290 238.120 244.219 1.00 0.00 C +ATOM 13 CA LYS A 13 185.554 241.084 241.840 1.00 0.00 C +ATOM 14 CA PRO A 14 187.391 240.018 238.677 1.00 0.00 C +ATOM 15 CA LEU A 15 191.109 240.256 237.880 1.00 0.00 C +ATOM 16 CA VAL A 16 194.652 241.610 238.242 1.00 0.00 C +ATOM 17 CA GLN A 17 197.968 242.754 239.729 1.00 0.00 C +ATOM 18 CA VAL A 18 200.181 243.717 242.677 1.00 0.00 C +ATOM 19 CA LEU A 19 198.435 246.450 244.677 1.00 0.00 C +ATOM 20 CA SER A 20 197.207 247.761 248.037 1.00 0.00 C +ATOM 21 CA ASP A 21 197.525 247.017 251.760 1.00 0.00 C +ATOM 22 CA ASP A 22 194.861 246.856 254.479 1.00 0.00 C +ATOM 23 CA ASN A 23 195.454 249.152 257.461 1.00 0.00 C +ATOM 24 CA SER A 24 197.026 252.478 258.451 1.00 0.00 C +ATOM 25 CA GLU A 25 199.389 254.927 256.739 1.00 0.00 C +ATOM 26 CA VAL A 26 197.529 258.240 256.452 1.00 0.00 C +ATOM 27 CA LYS A 27 196.504 260.957 253.986 1.00 0.00 C +ATOM 28 CA GLU A 28 196.153 264.687 253.292 1.00 0.00 C +ATOM 29 CA ALA A 29 196.078 266.869 256.414 1.00 0.00 C +ATOM 30 CA LYS A 30 198.625 266.586 259.234 1.00 0.00 C +ATOM 31 CA ASP A 31 201.992 268.362 259.089 1.00 0.00 C +ATOM 32 CA GLY A 32 203.161 271.677 257.619 1.00 0.00 C +ATOM 33 CA GLY A 33 206.612 272.422 256.186 1.00 0.00 C +ATOM 34 CA GLY A 34 207.439 275.079 253.585 1.00 0.00 C +ATOM 35 CA GLU A 35 210.141 273.530 251.391 1.00 0.00 C +ATOM 36 CA GLU A 36 210.268 272.737 247.666 1.00 0.00 C +ATOM 37 CA VAL A 37 208.631 269.782 245.905 1.00 0.00 C +ATOM 38 CA THR A 38 208.166 266.001 245.831 1.00 0.00 C +ATOM 39 CA GLY A 39 207.550 262.467 244.548 1.00 0.00 C +ATOM 40 CA GLY A 40 207.464 261.232 240.945 1.00 0.00 C +ATOM 41 CA ASP A 41 208.961 263.770 238.530 1.00 0.00 C +ATOM 42 CA GLY A 42 207.379 263.603 235.068 1.00 0.00 C +ATOM 43 CA GLU A 43 206.987 261.752 231.762 1.00 0.00 C +ATOM 44 CA GLY A 44 209.444 258.860 231.412 1.00 0.00 C +ATOM 45 CA GLU A 45 211.047 255.550 230.418 1.00 0.00 C +ATOM 46 CA ALA A 46 210.289 252.268 232.200 1.00 0.00 C +ATOM 47 CA ASN A 47 213.506 251.114 233.885 1.00 0.00 C +ATOM 48 CA VAL A 48 213.853 248.195 236.309 1.00 0.00 C +ATOM 49 CA GLU A 49 215.272 244.698 235.785 1.00 0.00 C +ATOM 50 CA GLU A 50 214.467 241.659 233.633 1.00 0.00 C +ATOM 51 CA GLU A 51 214.412 239.959 230.224 1.00 0.00 C +ATOM 52 CA ASP A 52 216.958 237.798 228.389 1.00 0.00 C +ATOM 53 CA ASP A 53 219.659 235.159 227.886 1.00 0.00 C +ATOM 54 CA GLU A 54 219.437 232.223 225.468 1.00 0.00 C +ATOM 55 CA ALA A 55 220.929 232.643 221.987 1.00 0.00 C +ATOM 56 CA GLU A 56 222.690 235.256 219.846 1.00 0.00 C +ATOM 57 CA ASN A 57 223.243 237.436 216.770 1.00 0.00 C +ATOM 58 CA GLU A 58 225.564 237.627 213.755 1.00 0.00 C +ATOM 59 CA ASP A 59 229.197 238.015 214.833 1.00 0.00 C +ATOM 60 CA ASP A 60 231.984 239.275 217.105 1.00 0.00 C +ATOM 61 CA ASP A 61 235.383 239.626 215.422 1.00 0.00 C +ATOM 62 CA ASP A 62 236.457 236.987 212.893 1.00 0.00 C +ATOM 63 CA ASP A 63 240.087 237.002 211.735 1.00 0.00 C +ATOM 64 CA ASP A 64 242.864 238.856 213.572 1.00 0.00 C +ATOM 65 CA ASP A 65 243.127 240.550 216.974 1.00 0.00 C +ATOM 66 CA ASP A 66 245.267 243.690 217.250 1.00 0.00 C +ATOM 67 CA ASP A 67 245.884 244.672 220.879 1.00 0.00 C +ATOM 68 CA ASP A 68 244.743 246.307 224.126 1.00 0.00 C +ATOM 69 CA ASP A 69 246.779 248.746 226.229 1.00 0.00 C +ATOM 70 CA ASP A 70 249.535 248.137 228.788 1.00 0.00 C +ATOM 71 CA ASP A 71 252.028 245.525 230.004 1.00 0.00 C +ATOM 72 CA GLU A 72 252.065 245.932 233.792 1.00 0.00 C +ATOM 73 CA ASP A 73 250.378 244.328 236.809 1.00 0.00 C +ATOM 74 CA GLU A 74 248.484 246.531 239.274 1.00 0.00 C +ATOM 75 CA ASP A 75 247.127 247.133 242.782 1.00 0.00 C +ATOM 76 CA ASP A 76 249.659 248.430 245.317 1.00 0.00 C +ATOM 77 CA GLU A 77 251.008 248.504 248.879 1.00 0.00 C +ATOM 78 CA GLU A 78 254.666 247.500 248.524 1.00 0.00 C +ATOM 79 CA GLY A 79 257.365 249.899 249.739 1.00 0.00 C +ATOM 80 CA GLU A 80 256.957 253.117 251.738 1.00 0.00 C +ATOM 81 CA GLU A 81 260.254 254.553 252.996 1.00 0.00 C +ATOM 82 CA ASP A 82 263.111 255.080 250.531 1.00 0.00 C +ATOM 83 CA LEU A 83 265.391 253.197 248.129 1.00 0.00 C +ATOM 84 CA GLY A 84 268.869 251.670 247.833 1.00 0.00 C +ATOM 85 CA THR A 85 268.991 248.451 249.867 1.00 0.00 C +ATOM 86 CA GLU A 86 269.292 244.716 249.177 1.00 0.00 C +ATOM 87 CA TYR A 87 266.585 242.229 250.180 1.00 0.00 C +ATOM 88 CA LEU A 88 264.139 244.041 252.471 1.00 0.00 C +ATOM 89 CA VAL A 89 265.520 244.556 255.985 1.00 0.00 C +ATOM 90 CA ARG A 90 268.448 246.952 256.431 1.00 0.00 C +ATOM 91 CA PRO A 91 272.209 247.542 256.596 1.00 0.00 C +ATOM 92 CA VAL A 92 275.198 245.222 257.040 1.00 0.00 C +ATOM 93 CA GLY A 93 275.595 243.617 260.472 1.00 0.00 C +ATOM 94 CA GLU A 94 274.114 241.755 263.448 1.00 0.00 C +ATOM 95 CA VAL A 95 270.398 242.583 263.305 1.00 0.00 C +ATOM 96 CA GLU A 96 268.147 239.787 264.579 1.00 0.00 C +ATOM 97 CA ASP A 97 266.952 240.018 268.190 1.00 0.00 C +ATOM 98 CA GLU A 98 267.265 241.359 271.742 1.00 0.00 C +ATOM 99 CA ASP A 99 267.262 245.128 272.299 1.00 0.00 C +ATOM 100 CA ASP A 100 268.038 248.396 270.500 1.00 0.00 C +ATOM 101 CA ALA A 101 269.485 250.798 273.079 1.00 0.00 C +ATOM 102 CA SER A 102 267.444 253.999 273.407 1.00 0.00 C +ATOM 103 CA ASP A 103 263.784 254.508 272.480 1.00 0.00 C +ATOM 104 CA PHE A 104 262.504 251.103 271.347 1.00 0.00 C +ATOM 105 CA ASP A 105 258.949 250.448 270.144 1.00 0.00 C +ATOM 106 CA PRO A 106 257.859 250.166 266.504 1.00 0.00 C +ATOM 107 CA GLU A 107 254.198 250.156 265.449 1.00 0.00 C +ATOM 108 CA GLU A 108 252.434 253.044 263.698 1.00 0.00 C +ATOM 109 CA ASN A 109 254.850 255.984 263.885 1.00 0.00 C +ATOM 110 CA GLY A 110 258.589 255.945 263.156 1.00 0.00 C +ATOM 111 CA LEU A 111 261.578 255.330 260.874 1.00 0.00 C +ATOM 112 CA ASP A 112 264.932 255.984 262.560 1.00 0.00 C +ATOM 113 CA GLU A 113 267.142 256.426 265.631 1.00 0.00 C +ATOM 114 CA GLU A 114 269.533 259.331 265.029 1.00 0.00 C +ATOM 115 CA GLU A 115 270.956 262.799 265.705 1.00 0.00 C +ATOM 116 CA GLY A 116 272.298 265.975 264.082 1.00 0.00 C +ATOM 117 CA ASP A 117 271.647 269.429 262.614 1.00 0.00 C +ATOM 118 CA GLU A 118 270.770 273.014 263.560 1.00 0.00 C +ATOM 119 CA VAL A 119 267.715 273.890 265.662 1.00 0.00 C +ATOM 120 CA ILE A 120 264.434 272.527 264.285 1.00 0.00 C +ATOM 121 CA GLU A 121 261.719 271.192 261.969 1.00 0.00 C +ATOM 122 CA GLU A 122 261.222 267.445 262.446 1.00 0.00 C +ATOM 123 CA GLY A 123 261.974 263.977 261.057 1.00 0.00 C +ATOM 124 CA ASP A 124 263.514 262.785 257.783 1.00 0.00 C +ATOM 125 CA VAL A 125 267.172 261.754 257.509 1.00 0.00 C +ATOM 126 CA ASP A 126 270.044 259.553 258.701 1.00 0.00 C +ATOM 127 CA GLU A 127 273.242 260.876 257.107 1.00 0.00 C +ATOM 128 CA ASP A 128 275.916 261.674 254.513 1.00 0.00 C +ATOM 129 CA ILE A 129 275.504 262.260 250.771 1.00 0.00 C +ATOM 130 CA SER A 130 273.618 260.327 248.084 1.00 0.00 C +ATOM 131 CA LEU A 131 273.503 256.547 248.553 1.00 0.00 C +ATOM 132 CA SER A 132 275.758 254.014 246.817 1.00 0.00 C +ATOM 133 CA ALA A 133 277.676 250.726 246.980 1.00 0.00 C +ATOM 134 CA GLY A 134 280.843 250.468 249.082 1.00 0.00 C +ATOM 135 CA LYS A 135 282.256 254.002 249.246 1.00 0.00 C +ATOM 136 CA SER A 136 284.263 254.960 246.152 1.00 0.00 C +ATOM 137 CA GLU A 137 287.265 256.926 247.433 1.00 0.00 C +ATOM 138 CA PRO A 138 290.555 255.006 247.362 1.00 0.00 C +ATOM 139 CA LEU A 139 293.447 254.330 244.975 1.00 0.00 C +ATOM 140 CA SER A 140 297.079 253.784 245.989 1.00 0.00 C +ATOM 141 CA LYS A 141 299.558 254.465 243.178 1.00 0.00 C +ATOM 142 CA ARG A 142 301.634 251.337 242.530 1.00 0.00 C +ATOM 143 CA LYS A 143 304.120 249.032 244.269 1.00 0.00 C +ATOM 144 CA ARG A 144 305.462 250.072 247.679 1.00 0.00 C +ATOM 145 CA VAL A 145 309.070 248.848 247.659 1.00 0.00 C +ATOM 146 CA ALA A 146 311.062 246.040 246.027 1.00 0.00 C +ATOM 147 CA LYS A 147 314.655 246.528 247.196 1.00 0.00 C +ATOM 148 CA ASP A 148 317.483 247.210 249.656 1.00 0.00 C +ATOM 149 CA HIS A 149 318.114 245.318 252.903 1.00 0.00 C +ATOM 150 CA SER A 150 319.082 243.701 256.214 1.00 0.00 C +ATOM 151 CA GLU A 151 317.792 240.335 257.447 1.00 0.00 C +ATOM 152 CA GLN A 152 314.845 237.920 257.454 1.00 0.00 C +ATOM 153 CA GLY A 153 311.601 239.426 258.767 1.00 0.00 C +ATOM 154 CA ASP A 154 311.879 242.673 260.742 1.00 0.00 C +ATOM 155 CA VAL A 155 313.732 243.315 264.009 1.00 0.00 C +ATOM 156 CA THR A 156 314.369 241.214 267.122 1.00 0.00 C +ATOM 157 CA GLY A 157 316.744 241.727 270.057 1.00 0.00 C +ATOM 158 CA ASP A 158 320.535 241.473 269.780 1.00 0.00 C +ATOM 159 CA ASN A 159 321.534 237.803 269.990 1.00 0.00 C +ATOM 160 CA ILE A 160 325.156 236.623 269.920 1.00 0.00 C +ATOM 161 CA ARG A 161 328.759 237.863 269.890 1.00 0.00 C +ATOM 162 CA PRO A 162 332.147 236.122 269.864 1.00 0.00 C +ATOM 163 CA SER A 163 335.145 234.174 268.546 1.00 0.00 C +ATOM 164 CA LYS A 164 337.587 233.490 265.702 1.00 0.00 C +ATOM 165 CA ARG A 165 337.726 229.716 265.197 1.00 0.00 C +TER 166 ARG A 165 +END diff --git a/Plants/Q84WM0/Q84WM0.dcd b/Plants/Q84WM0/Q84WM0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..95694022fe829d0ebf6c4e0e293cb4bfe1be4c81 --- /dev/null +++ b/Plants/Q84WM0/Q84WM0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:507799eb93ac6060f1dfd24cefe572fcab713443c6101e4d2c780b646d881e57 +size 8120276 diff --git a/Plants/Q84WM0/top.pdb b/Plants/Q84WM0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..2de74747853e6cf82e0702a574da8a364073e363 --- /dev/null +++ b/Plants/Q84WM0/top.pdb @@ -0,0 +1,65 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 250.629 218.183 271.537 1.00 0.00 C +ATOM 2 CA ALA A 2 252.756 220.883 269.893 1.00 0.00 C +ATOM 3 CA LYS A 3 253.177 223.136 266.850 1.00 0.00 C +ATOM 4 CA SER A 4 255.807 225.880 266.585 1.00 0.00 C +ATOM 5 CA LYS A 5 258.949 225.738 264.435 1.00 0.00 C +ATOM 6 CA ASN A 6 261.837 226.697 262.142 1.00 0.00 C +ATOM 7 CA HIS A 7 263.309 229.946 260.802 1.00 0.00 C +ATOM 8 CA THR A 8 263.110 230.456 257.031 1.00 0.00 C +ATOM 9 CA ALA A 9 260.965 232.621 254.745 1.00 0.00 C +ATOM 10 CA HIS A 10 259.172 235.963 254.375 1.00 0.00 C +ATOM 11 CA ASN A 11 257.973 238.133 251.482 1.00 0.00 C +ATOM 12 CA GLN A 12 257.634 239.350 247.888 1.00 0.00 C +ATOM 13 CA SER A 13 258.194 242.190 245.411 1.00 0.00 C +ATOM 14 CA ALA A 14 261.083 243.715 243.450 1.00 0.00 C +ATOM 15 CA LYS A 15 263.503 245.951 245.362 1.00 0.00 C +ATOM 16 CA ALA A 16 264.802 247.398 248.638 1.00 0.00 C +ATOM 17 CA HIS A 17 266.024 247.420 252.247 1.00 0.00 C +ATOM 18 CA LYS A 18 263.149 247.764 254.723 1.00 0.00 C +ATOM 19 CA ASN A 19 259.612 247.366 256.084 1.00 0.00 C +ATOM 20 CA GLY A 20 256.761 249.002 254.159 1.00 0.00 C +ATOM 21 CA ILE A 21 256.170 250.937 250.930 1.00 0.00 C +ATOM 22 CA LYS A 22 255.096 254.356 249.638 1.00 0.00 C +ATOM 23 CA LYS A 23 256.088 257.837 248.450 1.00 0.00 C +ATOM 24 CA PRO A 24 253.628 260.587 249.403 1.00 0.00 C +ATOM 25 CA ARG A 25 252.126 262.423 246.422 1.00 0.00 C +ATOM 26 CA ARG A 26 253.563 264.976 243.986 1.00 0.00 C +ATOM 27 CA HIS A 27 255.852 267.983 244.469 1.00 0.00 C +ATOM 28 CA ARG A 28 254.605 269.614 247.679 1.00 0.00 C +ATOM 29 CA HIS A 29 253.066 272.665 249.364 1.00 0.00 C +ATOM 30 CA THR A 30 250.492 275.237 248.236 1.00 0.00 C +ATOM 31 CA PRO A 31 249.389 274.617 244.642 1.00 0.00 C +ATOM 32 CA THR A 32 250.933 271.833 242.549 1.00 0.00 C +ATOM 33 CA ARG A 33 248.847 269.632 240.242 1.00 0.00 C +ATOM 34 CA GLY A 34 251.119 267.009 238.670 1.00 0.00 C +ATOM 35 CA MET A 35 251.588 263.249 238.275 1.00 0.00 C +ATOM 36 CA ASP A 36 255.262 262.613 237.493 1.00 0.00 C +ATOM 37 CA PRO A 37 257.757 260.882 235.192 1.00 0.00 C +ATOM 38 CA LYS A 38 256.328 257.492 234.199 1.00 0.00 C +ATOM 39 CA PHE A 39 253.854 254.816 233.089 1.00 0.00 C +ATOM 40 CA LEU A 40 251.198 253.560 230.663 1.00 0.00 C +ATOM 41 CA ARG A 41 248.061 254.280 228.625 1.00 0.00 C +ATOM 42 CA ASN A 42 245.984 256.759 230.639 1.00 0.00 C +ATOM 43 CA GLN A 43 244.744 256.624 234.239 1.00 0.00 C +ATOM 44 CA ARG A 44 242.306 254.326 236.053 1.00 0.00 C +ATOM 45 CA TYR A 45 241.036 253.100 239.429 1.00 0.00 C +ATOM 46 CA ALA A 46 239.246 252.312 242.699 1.00 0.00 C +ATOM 47 CA ARG A 47 239.843 255.381 244.876 1.00 0.00 C +ATOM 48 CA LYS A 48 239.093 254.228 248.429 1.00 0.00 C +ATOM 49 CA HIS A 49 239.183 252.910 252.003 1.00 0.00 C +ATOM 50 CA ASN A 50 238.059 249.269 252.035 1.00 0.00 C +ATOM 51 CA VAL A 51 241.191 247.128 251.690 1.00 0.00 C +ATOM 52 CA LYS A 52 240.902 243.534 252.921 1.00 0.00 C +ATOM 53 CA SER A 53 241.851 243.309 256.603 1.00 0.00 C +ATOM 54 CA GLY A 54 239.183 242.738 259.262 1.00 0.00 C +ATOM 55 CA GLU A 55 236.934 244.465 261.807 1.00 0.00 C +ATOM 56 CA ASN A 56 233.711 246.473 262.117 1.00 0.00 C +ATOM 57 CA ALA A 57 234.469 250.185 261.708 1.00 0.00 C +ATOM 58 CA GLY A 58 231.381 252.086 262.874 1.00 0.00 C +ATOM 59 CA VAL A 59 227.737 253.185 263.046 1.00 0.00 C +ATOM 60 CA GLU A 60 225.542 250.108 262.565 1.00 0.00 C +ATOM 61 CA GLU A 61 224.135 247.489 264.948 1.00 0.00 C +TER 62 GLU A 61 +END diff --git a/Plants/Q84WZ5/Q84WZ5.dcd b/Plants/Q84WZ5/Q84WZ5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..3380cc38b73a14319327335efed57c96d0e4cac8 --- /dev/null +++ b/Plants/Q84WZ5/Q84WZ5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:7ba9aaabc669100d7f75ee4689e89c9e73e21537e7ccc7ebb8bf5e8de48f4d7f +size 17840276 diff --git a/Plants/Q84WZ5/top.pdb b/Plants/Q84WZ5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..1ec13fded9f516cf414ab8940a4b075ee0a43c98 --- /dev/null +++ b/Plants/Q84WZ5/top.pdb @@ -0,0 +1,146 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 208.346 297.890 189.665 1.00 0.00 C +ATOM 2 CA ASP A 2 212.007 297.230 188.841 1.00 0.00 C +ATOM 3 CA LYS A 3 215.422 298.659 187.939 1.00 0.00 C +ATOM 4 CA LYS A 4 218.733 297.285 189.231 1.00 0.00 C +ATOM 5 CA LYS A 5 217.983 293.700 190.280 1.00 0.00 C +ATOM 6 CA SER A 6 220.549 290.971 189.584 1.00 0.00 C +ATOM 7 CA VAL A 7 219.701 287.341 190.371 1.00 0.00 C +ATOM 8 CA SER A 8 220.458 286.326 193.965 1.00 0.00 C +ATOM 9 CA GLY A 9 222.082 283.449 195.863 1.00 0.00 C +ATOM 10 CA SER A 10 224.493 280.576 196.530 1.00 0.00 C +ATOM 11 CA SER A 11 226.359 277.631 198.069 1.00 0.00 C +ATOM 12 CA SER A 12 226.434 276.719 201.767 1.00 0.00 C +ATOM 13 CA SER A 13 223.822 274.874 203.839 1.00 0.00 C +ATOM 14 CA SER A 14 220.080 274.369 204.345 1.00 0.00 C +ATOM 15 CA SER A 15 216.899 273.328 206.165 1.00 0.00 C +ATOM 16 CA SER A 16 217.542 270.532 208.671 1.00 0.00 C +ATOM 17 CA SER A 17 219.812 271.979 211.367 1.00 0.00 C +ATOM 18 CA LEU A 18 217.951 271.277 214.617 1.00 0.00 C +ATOM 19 CA ASP A 19 219.147 271.106 218.230 1.00 0.00 C +ATOM 20 CA HIS A 20 216.914 272.720 220.861 1.00 0.00 C +ATOM 21 CA ILE A 21 215.483 276.160 221.657 1.00 0.00 C +ATOM 22 CA PHE A 22 213.081 279.031 220.947 1.00 0.00 C +ATOM 23 CA GLY A 23 209.897 279.139 223.037 1.00 0.00 C +ATOM 24 CA PRO A 24 206.487 280.190 221.703 1.00 0.00 C +ATOM 25 CA ARG A 25 205.407 277.277 219.497 1.00 0.00 C +ATOM 26 CA VAL A 26 206.183 273.990 221.260 1.00 0.00 C +ATOM 27 CA SER A 27 208.938 273.058 223.721 1.00 0.00 C +ATOM 28 CA HIS A 28 207.682 270.359 226.100 1.00 0.00 C +ATOM 29 CA SER A 29 210.351 269.789 228.758 1.00 0.00 C +ATOM 30 CA TYR A 30 211.201 271.018 232.263 1.00 0.00 C +ATOM 31 CA SER A 31 208.448 273.086 233.894 1.00 0.00 C +ATOM 32 CA SER A 32 210.258 275.559 236.158 1.00 0.00 C +ATOM 33 CA SER A 33 209.544 274.578 239.770 1.00 0.00 C +ATOM 34 CA THR A 34 212.260 274.060 242.391 1.00 0.00 C +ATOM 35 CA THR A 35 213.144 274.262 246.092 1.00 0.00 C +ATOM 36 CA GLY A 36 214.742 271.200 247.700 1.00 0.00 C +ATOM 37 CA LEU A 37 217.027 268.156 247.869 1.00 0.00 C +ATOM 38 CA PHE A 38 220.494 267.297 246.543 1.00 0.00 C +ATOM 39 CA LYS A 39 221.990 264.051 247.860 1.00 0.00 C +ATOM 40 CA SER A 40 225.745 264.673 248.042 1.00 0.00 C +ATOM 41 CA ILE A 41 228.873 262.796 246.944 1.00 0.00 C +ATOM 42 CA PHE A 42 232.286 261.535 245.812 1.00 0.00 C +ATOM 43 CA PRO A 43 233.612 262.193 242.302 1.00 0.00 C +ATOM 44 CA PRO A 44 233.242 264.465 239.265 1.00 0.00 C +ATOM 45 CA PRO A 45 235.238 266.619 236.838 1.00 0.00 C +ATOM 46 CA SER A 46 235.586 269.019 233.899 1.00 0.00 C +ATOM 47 CA ALA A 47 238.731 269.886 231.931 1.00 0.00 C +ATOM 48 CA VAL A 48 241.097 267.212 230.602 1.00 0.00 C +ATOM 49 CA THR A 49 243.596 264.341 230.774 1.00 0.00 C +ATOM 50 CA GLN A 50 242.961 262.001 227.835 1.00 0.00 C +ATOM 51 CA GLY A 51 243.157 262.876 224.132 1.00 0.00 C +ATOM 52 CA ASN A 52 240.073 264.457 222.549 1.00 0.00 C +ATOM 53 CA LEU A 53 236.773 262.964 223.728 1.00 0.00 C +ATOM 54 CA THR A 54 236.225 262.577 227.479 1.00 0.00 C +ATOM 55 CA SER A 55 233.378 262.709 230.008 1.00 0.00 C +ATOM 56 CA ARG A 56 230.966 262.492 232.948 1.00 0.00 C +ATOM 57 CA ASN A 57 228.925 259.618 234.397 1.00 0.00 C +ATOM 58 CA GLY A 58 229.370 257.615 237.607 1.00 0.00 C +ATOM 59 CA ALA A 59 228.212 257.460 241.233 1.00 0.00 C +ATOM 60 CA ALA A 60 228.111 254.603 243.751 1.00 0.00 C +ATOM 61 CA LYS A 61 230.236 251.574 242.844 1.00 0.00 C +ATOM 62 CA TYR A 62 233.587 251.268 244.632 1.00 0.00 C +ATOM 63 CA GLN A 63 235.588 248.205 245.695 1.00 0.00 C +ATOM 64 CA PRO A 64 236.858 248.829 249.232 1.00 0.00 C +ATOM 65 CA THR A 65 237.794 247.313 252.599 1.00 0.00 C +ATOM 66 CA ASN A 66 240.922 249.230 253.628 1.00 0.00 C +ATOM 67 CA PHE A 67 244.017 250.709 255.286 1.00 0.00 C +ATOM 68 CA GLU A 68 246.824 249.540 257.582 1.00 0.00 C +ATOM 69 CA THR A 69 250.151 249.061 255.789 1.00 0.00 C +ATOM 70 CA PRO A 70 253.672 249.545 254.416 1.00 0.00 C +ATOM 71 CA ASN A 71 256.677 247.366 253.555 1.00 0.00 C +ATOM 72 CA GLU A 72 258.250 244.146 254.848 1.00 0.00 C +ATOM 73 CA ARG A 73 256.953 241.312 257.040 1.00 0.00 C +ATOM 74 CA GLY A 74 254.986 238.686 258.976 1.00 0.00 C +ATOM 75 CA GLU A 75 253.095 236.756 261.663 1.00 0.00 C +ATOM 76 CA ARG A 76 252.960 236.966 265.465 1.00 0.00 C +ATOM 77 CA SER A 77 250.595 235.448 268.038 1.00 0.00 C +ATOM 78 CA LYS A 78 246.826 235.032 268.409 1.00 0.00 C +ATOM 79 CA ASN A 79 245.168 235.489 265.009 1.00 0.00 C +ATOM 80 CA LYS A 80 246.371 237.617 262.086 1.00 0.00 C +ATOM 81 CA GLU A 81 246.192 237.025 258.327 1.00 0.00 C +ATOM 82 CA ARG A 82 248.355 234.379 256.643 1.00 0.00 C +ATOM 83 CA LYS A 83 250.636 232.182 254.524 1.00 0.00 C +ATOM 84 CA SER A 84 250.630 233.758 251.055 1.00 0.00 C +ATOM 85 CA TYR A 85 252.498 235.282 248.105 1.00 0.00 C +ATOM 86 CA GLN A 86 252.959 235.783 244.356 1.00 0.00 C +ATOM 87 CA SER A 87 254.831 236.918 241.238 1.00 0.00 C +ATOM 88 CA GLU A 88 257.905 239.097 240.672 1.00 0.00 C +ATOM 89 CA GLU A 89 259.183 241.177 243.597 1.00 0.00 C +ATOM 90 CA THR A 90 259.505 241.542 247.376 1.00 0.00 C +ATOM 91 CA GLN A 91 256.692 239.972 249.410 1.00 0.00 C +ATOM 92 CA PRO A 92 257.401 236.971 251.648 1.00 0.00 C +ATOM 93 CA PRO A 93 259.325 235.421 254.548 1.00 0.00 C +ATOM 94 CA CYS A 94 261.385 235.668 257.743 1.00 0.00 C +ATOM 95 CA ASN A 95 261.695 234.207 261.248 1.00 0.00 C +ATOM 96 CA LEU A 96 265.344 233.960 262.317 1.00 0.00 C +ATOM 97 CA SER A 97 268.673 232.690 263.665 1.00 0.00 C +ATOM 98 CA SER A 98 271.784 234.779 262.979 1.00 0.00 C +ATOM 99 CA SER A 99 274.641 237.007 264.159 1.00 0.00 C +ATOM 100 CA ILE A 100 277.827 238.121 265.927 1.00 0.00 C +ATOM 101 CA TYR A 101 281.281 237.290 264.550 1.00 0.00 C +ATOM 102 CA TYR A 102 283.512 236.233 267.452 1.00 0.00 C +ATOM 103 CA GLY A 103 286.085 237.911 269.705 1.00 0.00 C +ATOM 104 CA GLY A 104 289.728 238.820 270.348 1.00 0.00 C +ATOM 105 CA GLN A 105 291.252 236.668 273.098 1.00 0.00 C +ATOM 106 CA ASP A 106 294.486 235.061 274.315 1.00 0.00 C +ATOM 107 CA ASN A 107 295.941 231.598 274.948 1.00 0.00 C +ATOM 108 CA TYR A 108 298.986 230.926 272.757 1.00 0.00 C +ATOM 109 CA SER A 109 302.626 231.489 271.784 1.00 0.00 C +ATOM 110 CA SER A 110 304.819 231.810 274.883 1.00 0.00 C +ATOM 111 CA SER A 111 304.214 229.160 277.553 1.00 0.00 C +ATOM 112 CA THR A 112 305.647 225.658 278.006 1.00 0.00 C +ATOM 113 CA THR A 113 303.354 222.871 276.787 1.00 0.00 C +ATOM 114 CA ASN A 114 300.178 221.560 278.434 1.00 0.00 C +ATOM 115 CA PRO A 115 298.388 223.952 280.798 1.00 0.00 C +ATOM 116 CA ASP A 116 295.558 226.487 281.087 1.00 0.00 C +ATOM 117 CA ALA A 117 292.656 228.358 282.697 1.00 0.00 C +ATOM 118 CA TYR A 118 289.898 228.844 285.280 1.00 0.00 C +ATOM 119 CA LYS A 119 286.699 226.959 286.136 1.00 0.00 C +ATOM 120 CA LYS A 120 283.133 225.931 285.275 1.00 0.00 C +ATOM 121 CA ASP A 121 281.124 228.981 284.190 1.00 0.00 C +ATOM 122 CA GLY A 122 278.652 229.048 281.291 1.00 0.00 C +ATOM 123 CA GLU A 123 280.552 230.522 278.335 1.00 0.00 C +ATOM 124 CA GLU A 124 279.923 234.156 277.379 1.00 0.00 C +ATOM 125 CA GLY A 125 279.792 236.765 280.153 1.00 0.00 C +ATOM 126 CA ASP A 126 277.822 237.136 283.393 1.00 0.00 C +ATOM 127 CA SER A 127 274.293 235.701 283.394 1.00 0.00 C +ATOM 128 CA GLU A 128 274.479 232.258 285.014 1.00 0.00 C +ATOM 129 CA SER A 129 276.031 231.397 288.385 1.00 0.00 C +ATOM 130 CA ALA A 130 277.966 228.288 289.435 1.00 0.00 C +ATOM 131 CA SER A 131 279.142 224.702 289.962 1.00 0.00 C +ATOM 132 CA ARG A 132 279.694 221.402 291.783 1.00 0.00 C +ATOM 133 CA GLY A 133 283.259 221.251 293.117 1.00 0.00 C +ATOM 134 CA ASN A 134 286.302 219.015 293.628 1.00 0.00 C +ATOM 135 CA TRP A 135 288.137 215.945 294.943 1.00 0.00 C +ATOM 136 CA TRP A 136 288.198 215.789 298.749 1.00 0.00 C +ATOM 137 CA GLU A 137 286.302 214.450 301.771 1.00 0.00 C +ATOM 138 CA GLY A 138 284.385 211.383 302.969 1.00 0.00 C +ATOM 139 CA SER A 139 280.762 212.508 303.314 1.00 0.00 C +ATOM 140 CA PHE A 140 277.052 213.262 303.741 1.00 0.00 C +ATOM 141 CA ASN A 141 273.389 212.337 303.248 1.00 0.00 C +ATOM 142 CA TYR A 142 271.804 213.751 300.085 1.00 0.00 C +TER 143 TYR A 142 +END diff --git a/Plants/Q84XG1/Q84XG1.dcd b/Plants/Q84XG1/Q84XG1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..e5f8acd90353dc27698749e03d07230a8b219b29 --- /dev/null +++ b/Plants/Q84XG1/Q84XG1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2608b20a1a577f0b827115c5441cf8f2266eb50037bce96f260c8872474f94e4 +size 5600276 diff --git a/Plants/Q84XG1/top.pdb b/Plants/Q84XG1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a3204b5133cf11ddd0f2f9a2e2f8236ab38e024b --- /dev/null +++ b/Plants/Q84XG1/top.pdb @@ -0,0 +1,44 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA SER A 1 245.545 262.081 241.869 1.00 0.00 C +ATOM 2 CA ARG A 2 247.600 263.614 239.051 1.00 0.00 C +ATOM 3 CA VAL A 3 245.458 264.514 236.031 1.00 0.00 C +ATOM 4 CA SER A 4 242.647 266.579 234.500 1.00 0.00 C +ATOM 5 CA VAL A 5 238.838 266.599 234.427 1.00 0.00 C +ATOM 6 CA THR A 6 237.339 268.659 237.260 1.00 0.00 C +ATOM 7 CA GLY A 7 238.949 267.390 240.472 1.00 0.00 C +ATOM 8 CA GLU A 8 239.380 269.580 243.559 1.00 0.00 C +ATOM 9 CA ALA A 9 239.800 268.633 247.226 1.00 0.00 C +ATOM 10 CA THR A 10 241.806 268.539 250.464 1.00 0.00 C +ATOM 11 CA PRO A 11 243.425 266.607 253.321 1.00 0.00 C +ATOM 12 CA SER A 12 243.015 262.955 254.324 1.00 0.00 C +ATOM 13 CA LEU A 13 243.706 259.634 252.590 1.00 0.00 C +ATOM 14 CA LYS A 14 246.972 260.148 250.697 1.00 0.00 C +ATOM 15 CA ALA A 15 246.774 257.798 247.704 1.00 0.00 C +ATOM 16 CA ASN A 16 248.339 255.685 244.946 1.00 0.00 C +ATOM 17 CA GLY A 17 251.335 253.335 244.817 1.00 0.00 C +ATOM 18 CA SER A 18 253.479 253.292 247.966 1.00 0.00 C +ATOM 19 CA ALA A 19 257.204 253.256 248.763 1.00 0.00 C +ATOM 20 CA PRO A 20 258.860 250.868 251.227 1.00 0.00 C +ATOM 21 CA VAL A 21 262.034 250.118 253.196 1.00 0.00 C +ATOM 22 CA PRO A 22 263.034 248.966 256.688 1.00 0.00 C +ATOM 23 CA SER A 23 265.910 250.681 258.504 1.00 0.00 C +ATOM 24 CA SER A 24 268.885 248.303 258.404 1.00 0.00 C +ATOM 25 CA LEU A 25 269.901 245.065 256.671 1.00 0.00 C +ATOM 26 CA PRO A 26 267.704 242.169 257.809 1.00 0.00 C +ATOM 27 CA THR A 27 264.184 241.410 256.565 1.00 0.00 C +ATOM 28 CA GLN A 28 262.335 239.796 253.651 1.00 0.00 C +ATOM 29 CA SER A 29 259.238 238.454 251.884 1.00 0.00 C +ATOM 30 CA TRP A 30 256.000 236.509 251.384 1.00 0.00 C +ATOM 31 CA GLN A 31 255.958 232.831 252.378 1.00 0.00 C +ATOM 32 CA LEU A 32 254.353 230.622 255.035 1.00 0.00 C +ATOM 33 CA SER A 33 250.615 231.337 255.220 1.00 0.00 C +ATOM 34 CA LYS A 34 248.935 232.125 251.892 1.00 0.00 C +ATOM 35 CA ASN A 35 245.874 232.978 249.789 1.00 0.00 C +ATOM 36 CA ARG A 36 242.961 230.633 250.519 1.00 0.00 C +ATOM 37 CA ASP A 37 241.398 231.538 253.873 1.00 0.00 C +ATOM 38 CA SER A 38 239.736 231.007 257.260 1.00 0.00 C +ATOM 39 CA THR A 39 237.127 233.080 259.107 1.00 0.00 C +ATOM 40 CA SER A 40 233.349 232.611 258.955 1.00 0.00 C +TER 41 SER A 40 +END diff --git a/Plants/Q84XX4/Q84XX4.dcd b/Plants/Q84XX4/Q84XX4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..08cb29ee7f18646c85bba967ca5661acc639d23d --- /dev/null +++ b/Plants/Q84XX4/Q84XX4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:20a63c5b9c6e49cc7ca57233671f219003fb78e99659fbdf14b3c7c7b7100826 +size 10400276 diff --git a/Plants/Q84XX4/top.pdb b/Plants/Q84XX4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..722715d625ba624b85206eb6b7f394cf2f8fd9a3 --- /dev/null +++ b/Plants/Q84XX4/top.pdb @@ -0,0 +1,84 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA THR A 1 216.837 224.228 244.135 1.00 0.00 C +ATOM 2 CA HIS A 2 218.334 224.394 240.635 1.00 0.00 C +ATOM 3 CA GLN A 3 220.973 224.005 237.915 1.00 0.00 C +ATOM 4 CA PHE A 4 224.407 225.556 238.481 1.00 0.00 C +ATOM 5 CA PHE A 5 228.073 226.482 238.016 1.00 0.00 C +ATOM 6 CA PRO A 6 231.019 227.858 236.030 1.00 0.00 C +ATOM 7 CA GLU A 7 234.082 225.603 236.259 1.00 0.00 C +ATOM 8 CA MET A 8 236.996 225.966 233.832 1.00 0.00 C +ATOM 9 CA GLU A 9 239.904 227.305 231.767 1.00 0.00 C +ATOM 10 CA SER A 10 241.186 228.831 228.520 1.00 0.00 C +ATOM 11 CA SER A 11 243.388 231.940 228.474 1.00 0.00 C +ATOM 12 CA VAL A 12 241.782 235.222 229.554 1.00 0.00 C +ATOM 13 CA GLY A 13 240.090 238.210 231.206 1.00 0.00 C +ATOM 14 CA ASP A 14 241.579 238.736 234.673 1.00 0.00 C +ATOM 15 CA ASN A 15 245.343 238.490 235.210 1.00 0.00 C +ATOM 16 CA GLY A 16 249.078 238.788 235.900 1.00 0.00 C +ATOM 17 CA GLY A 17 251.929 238.845 238.426 1.00 0.00 C +ATOM 18 CA GLY A 18 253.435 241.159 241.052 1.00 0.00 C +ATOM 19 CA GLY A 19 254.420 243.828 243.586 1.00 0.00 C +ATOM 20 CA THR A 20 253.519 246.194 246.434 1.00 0.00 C +ATOM 21 CA GLY A 21 250.205 245.766 248.263 1.00 0.00 C +ATOM 22 CA PRO A 22 248.107 244.503 251.182 1.00 0.00 C +ATOM 23 CA GLY A 23 250.525 243.752 254.028 1.00 0.00 C +ATOM 24 CA PHE A 24 253.165 243.423 256.755 1.00 0.00 C +ATOM 25 CA PRO A 25 252.824 240.221 258.791 1.00 0.00 C +ATOM 26 CA ARG A 26 254.112 237.379 260.978 1.00 0.00 C +ATOM 27 CA SER A 27 253.872 234.134 262.959 1.00 0.00 C +ATOM 28 CA HIS A 28 255.091 234.123 266.569 1.00 0.00 C +ATOM 29 CA TRP A 29 256.671 237.544 267.132 1.00 0.00 C +ATOM 30 CA PHE A 30 256.340 240.565 269.430 1.00 0.00 C +ATOM 31 CA GLY A 31 254.802 243.432 267.448 1.00 0.00 C +ATOM 32 CA VAL A 32 256.125 246.997 267.683 1.00 0.00 C +ATOM 33 CA GLN A 33 255.871 249.719 270.336 1.00 0.00 C +ATOM 34 CA PHE A 34 253.395 252.593 270.694 1.00 0.00 C +ATOM 35 CA SER A 35 251.563 253.957 273.744 1.00 0.00 C +ATOM 36 CA GLN A 36 253.947 255.715 276.140 1.00 0.00 C +ATOM 37 CA SER A 37 257.195 257.000 277.662 1.00 0.00 C +ATOM 38 CA ASP A 38 260.468 257.398 275.752 1.00 0.00 C +ATOM 39 CA LEU A 39 264.051 258.656 276.057 1.00 0.00 C +ATOM 40 CA ALA A 40 267.530 258.265 277.560 1.00 0.00 C +ATOM 41 CA THR A 41 270.847 256.638 276.629 1.00 0.00 C +ATOM 42 CA GLY A 42 272.420 254.765 273.708 1.00 0.00 C +ATOM 43 CA SER A 43 273.786 256.795 270.787 1.00 0.00 C +ATOM 44 CA SER A 44 272.259 257.788 267.441 1.00 0.00 C +ATOM 45 CA VAL A 45 271.344 260.859 265.380 1.00 0.00 C +ATOM 46 CA GLY A 46 268.913 263.678 264.571 1.00 0.00 C +ATOM 47 CA LYS A 47 270.987 266.874 264.577 1.00 0.00 C +ATOM 48 CA PRO A 48 271.218 270.674 264.723 1.00 0.00 C +ATOM 49 CA ALA A 49 268.691 272.187 262.307 1.00 0.00 C +ATOM 50 CA THR A 50 268.709 273.232 258.643 1.00 0.00 C +ATOM 51 CA VAL A 51 267.831 270.117 256.633 1.00 0.00 C +ATOM 52 CA GLY A 52 269.425 270.255 253.175 1.00 0.00 C +ATOM 53 CA ALA A 53 270.482 268.357 250.045 1.00 0.00 C +ATOM 54 CA VAL A 54 268.626 266.741 247.137 1.00 0.00 C +ATOM 55 CA VAL A 55 268.885 262.970 247.615 1.00 0.00 C +ATOM 56 CA GLU A 56 266.984 261.883 250.732 1.00 0.00 C +ATOM 57 CA PRO A 57 263.369 262.822 249.983 1.00 0.00 C +ATOM 58 CA THR A 58 261.726 263.749 246.672 1.00 0.00 C +ATOM 59 CA GLN A 59 260.390 261.834 243.662 1.00 0.00 C +ATOM 60 CA PRO A 60 257.711 261.387 240.990 1.00 0.00 C +ATOM 61 CA LEU A 61 254.721 259.069 240.537 1.00 0.00 C +ATOM 62 CA LYS A 62 252.869 255.930 241.647 1.00 0.00 C +ATOM 63 CA LYS A 63 252.371 252.720 243.638 1.00 0.00 C +ATOM 64 CA SER A 64 249.247 250.543 243.773 1.00 0.00 C +ATOM 65 CA ARG A 65 245.776 249.083 244.353 1.00 0.00 C +ATOM 66 CA ARG A 66 242.986 251.131 245.944 1.00 0.00 C +ATOM 67 CA GLY A 67 241.714 254.080 243.894 1.00 0.00 C +ATOM 68 CA PRO A 68 238.342 255.657 244.707 1.00 0.00 C +ATOM 69 CA ARG A 69 235.619 254.058 246.838 1.00 0.00 C +ATOM 70 CA SER A 70 231.829 253.671 246.857 1.00 0.00 C +ATOM 71 CA ARG A 71 229.856 256.849 246.134 1.00 0.00 C +ATOM 72 CA SER A 72 228.850 259.254 243.356 1.00 0.00 C +ATOM 73 CA SER A 73 228.336 258.575 239.642 1.00 0.00 C +ATOM 74 CA GLN A 74 228.208 259.261 235.896 1.00 0.00 C +ATOM 75 CA CYS A 75 230.139 262.456 235.136 1.00 0.00 C +ATOM 76 CA ARG A 76 230.312 262.740 231.341 1.00 0.00 C +ATOM 77 CA GLY A 77 231.067 259.469 229.540 1.00 0.00 C +ATOM 78 CA VAL A 78 233.478 259.038 226.621 1.00 0.00 C +ATOM 79 CA ASN A 79 237.272 258.699 226.706 1.00 0.00 C +ATOM 80 CA HIS A 80 240.173 257.332 228.763 1.00 0.00 C +TER 81 HIS A 80 +END diff --git a/Plants/Q84XX7/Q84XX7.dcd b/Plants/Q84XX7/Q84XX7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..ffb820ea9b284c1ceb3cf1de3af2e51482af26b6 --- /dev/null +++ b/Plants/Q84XX7/Q84XX7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:b68bdd2083139e8be1cf07aef308bbba272b6fb099f30411ad0a8adea103f7b7 +size 19640276 diff --git a/Plants/Q84XX7/top.pdb b/Plants/Q84XX7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..01546388cea29a8760278fb0f1973e37f17ff64e --- /dev/null +++ b/Plants/Q84XX7/top.pdb @@ -0,0 +1,161 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA GLY A 1 259.344 248.546 258.086 1.00 0.00 C +ATOM 2 CA THR A 2 257.379 245.470 256.993 1.00 0.00 C +ATOM 3 CA ALA A 3 257.245 245.032 253.211 1.00 0.00 C +ATOM 4 CA VAL A 4 256.802 248.389 251.463 1.00 0.00 C +ATOM 5 CA ALA A 5 257.163 251.790 249.785 1.00 0.00 C +ATOM 6 CA ARG A 6 253.755 252.894 248.487 1.00 0.00 C +ATOM 7 CA SER A 7 250.894 251.981 246.143 1.00 0.00 C +ATOM 8 CA GLY A 8 247.202 251.048 246.265 1.00 0.00 C +ATOM 9 CA THR A 9 244.464 249.333 244.245 1.00 0.00 C +ATOM 10 CA GLN A 10 241.596 251.836 244.088 1.00 0.00 C +ATOM 11 CA LEU A 11 242.504 255.519 243.729 1.00 0.00 C +ATOM 12 CA ARG A 12 239.726 257.226 241.758 1.00 0.00 C +ATOM 13 CA VAL A 13 239.743 257.911 238.011 1.00 0.00 C +ATOM 14 CA GLY A 14 236.374 257.002 236.480 1.00 0.00 C +ATOM 15 CA SER A 15 235.488 253.489 235.301 1.00 0.00 C +ATOM 16 CA MET A 16 234.233 250.245 236.855 1.00 0.00 C +ATOM 17 CA GLN A 17 232.168 249.846 240.032 1.00 0.00 C +ATOM 18 CA TRP A 18 229.289 252.063 241.176 1.00 0.00 C +ATOM 19 CA HIS A 19 230.837 255.046 242.972 1.00 0.00 C +ATOM 20 CA GLN A 20 233.219 254.191 245.819 1.00 0.00 C +ATOM 21 CA THR A 21 235.418 253.596 248.874 1.00 0.00 C +ATOM 22 CA ASN A 22 237.257 255.537 251.589 1.00 0.00 C +ATOM 23 CA GLU A 23 237.112 259.313 251.102 1.00 0.00 C +ATOM 24 CA GLN A 24 236.928 262.598 253.023 1.00 0.00 C +ATOM 25 CA SER A 25 239.121 263.950 255.829 1.00 0.00 C +ATOM 26 CA ILE A 26 238.917 267.700 256.477 1.00 0.00 C +ATOM 27 CA PRO A 27 240.858 270.847 257.395 1.00 0.00 C +ATOM 28 CA ARG A 28 241.958 273.235 254.637 1.00 0.00 C +ATOM 29 CA HIS A 29 240.430 272.556 251.213 1.00 0.00 C +ATOM 30 CA ALA A 30 241.081 269.632 248.859 1.00 0.00 C +ATOM 31 CA PRO A 31 242.838 267.804 246.015 1.00 0.00 C +ATOM 32 CA SER A 32 243.137 268.965 242.398 1.00 0.00 C +ATOM 33 CA ALA A 33 241.987 268.971 238.766 1.00 0.00 C +ATOM 34 CA TYR A 34 241.101 269.805 235.155 1.00 0.00 C +ATOM 35 CA SER A 35 239.404 272.302 232.831 1.00 0.00 C +ATOM 36 CA ASN A 36 236.419 274.505 231.965 1.00 0.00 C +ATOM 37 CA SER A 37 232.847 274.533 233.291 1.00 0.00 C +ATOM 38 CA ILE A 38 229.040 274.377 233.299 1.00 0.00 C +ATOM 39 CA THR A 39 227.408 277.070 235.443 1.00 0.00 C +ATOM 40 CA LEU A 40 228.993 277.846 238.819 1.00 0.00 C +ATOM 41 CA ALA A 41 230.356 276.431 242.083 1.00 0.00 C +ATOM 42 CA HIS A 42 228.860 277.459 245.433 1.00 0.00 C +ATOM 43 CA THR A 43 227.095 279.390 248.203 1.00 0.00 C +ATOM 44 CA GLU A 44 223.323 279.894 248.380 1.00 0.00 C +ATOM 45 CA ARG A 45 222.545 283.059 246.407 1.00 0.00 C +ATOM 46 CA GLU A 46 223.529 282.566 242.759 1.00 0.00 C +ATOM 47 CA GLN A 47 223.165 285.030 239.876 1.00 0.00 C +ATOM 48 CA GLN A 48 224.378 288.490 240.911 1.00 0.00 C +ATOM 49 CA GLN A 49 223.832 291.432 243.270 1.00 0.00 C +ATOM 50 CA TYR A 50 221.206 293.942 244.418 1.00 0.00 C +ATOM 51 CA MET A 51 218.784 295.891 246.620 1.00 0.00 C +ATOM 52 CA GLN A 52 220.114 299.160 248.055 1.00 0.00 C +ATOM 53 CA PRO A 53 222.660 301.772 246.952 1.00 0.00 C +ATOM 54 CA LYS A 54 226.301 301.904 248.066 1.00 0.00 C +ATOM 55 CA LEU A 55 228.230 299.300 246.062 1.00 0.00 C +ATOM 56 CA HIS A 56 229.409 296.974 243.284 1.00 0.00 C +ATOM 57 CA HIS A 57 233.087 297.791 242.719 1.00 0.00 C +ATOM 58 CA ASN A 58 235.897 299.243 244.843 1.00 0.00 C +ATOM 59 CA LEU A 59 238.765 300.897 242.957 1.00 0.00 C +ATOM 60 CA HIS A 60 242.567 301.087 243.120 1.00 0.00 C +ATOM 61 CA PHE A 61 246.253 301.686 243.872 1.00 0.00 C +ATOM 62 CA GLN A 62 249.158 301.315 246.310 1.00 0.00 C +ATOM 63 CA GLN A 63 247.555 300.750 249.720 1.00 0.00 C +ATOM 64 CA GLN A 64 247.345 296.959 250.040 1.00 0.00 C +ATOM 65 CA GLN A 65 248.046 293.577 248.432 1.00 0.00 C +ATOM 66 CA GLN A 66 250.097 290.393 248.015 1.00 0.00 C +ATOM 67 CA GLN A 67 252.456 289.955 245.055 1.00 0.00 C +ATOM 68 CA PRO A 68 254.942 291.326 242.513 1.00 0.00 C +ATOM 69 CA ILE A 69 255.961 288.646 240.004 1.00 0.00 C +ATOM 70 CA SER A 70 255.860 285.985 237.280 1.00 0.00 C +ATOM 71 CA THR A 71 256.091 283.463 234.432 1.00 0.00 C +ATOM 72 CA THR A 72 254.536 280.062 235.163 1.00 0.00 C +ATOM 73 CA SER A 73 252.764 276.772 235.902 1.00 0.00 C +ATOM 74 CA TYR A 74 252.735 273.023 235.225 1.00 0.00 C +ATOM 75 CA ALA A 75 252.262 269.470 233.933 1.00 0.00 C +ATOM 76 CA VAL A 76 252.074 267.290 230.814 1.00 0.00 C +ATOM 77 CA ARG A 77 252.011 263.559 231.585 1.00 0.00 C +ATOM 78 CA GLU A 78 254.180 260.626 230.485 1.00 0.00 C +ATOM 79 CA PRO A 79 257.797 261.423 229.595 1.00 0.00 C +ATOM 80 CA VAL A 80 259.979 262.433 232.550 1.00 0.00 C +ATOM 81 CA GLY A 81 263.503 263.290 231.382 1.00 0.00 C +ATOM 82 CA GLN A 82 265.537 265.744 233.469 1.00 0.00 C +ATOM 83 CA MET A 83 269.278 266.322 233.903 1.00 0.00 C +ATOM 84 CA GLY A 84 271.818 268.633 235.554 1.00 0.00 C +ATOM 85 CA THR A 85 274.109 270.017 238.265 1.00 0.00 C +ATOM 86 CA GLY A 86 275.990 267.551 240.478 1.00 0.00 C +ATOM 87 CA THR A 87 277.438 268.801 243.773 1.00 0.00 C +ATOM 88 CA SER A 88 275.756 272.162 244.397 1.00 0.00 C +ATOM 89 CA SER A 89 272.475 273.416 245.872 1.00 0.00 C +ATOM 90 CA SER A 90 270.038 274.561 243.177 1.00 0.00 C +ATOM 91 CA TRP A 91 269.244 278.124 242.086 1.00 0.00 C +ATOM 92 CA ARG A 92 266.536 278.735 239.476 1.00 0.00 C +ATOM 93 CA SER A 93 263.339 276.686 239.170 1.00 0.00 C +ATOM 94 CA GLN A 94 259.865 277.225 240.641 1.00 0.00 C +ATOM 95 CA GLN A 95 256.888 278.072 242.862 1.00 0.00 C +ATOM 96 CA SER A 96 256.809 276.068 246.101 1.00 0.00 C +ATOM 97 CA GLN A 97 257.038 273.026 248.383 1.00 0.00 C +ATOM 98 CA ASN A 98 258.189 270.185 250.647 1.00 0.00 C +ATOM 99 CA SER A 99 257.769 267.350 253.157 1.00 0.00 C +ATOM 100 CA TYR A 100 258.389 266.693 256.859 1.00 0.00 C +ATOM 101 CA TYR A 101 257.711 265.367 260.366 1.00 0.00 C +ATOM 102 CA SER A 102 257.885 267.994 263.120 1.00 0.00 C +ATOM 103 CA HIS A 103 261.500 268.295 264.288 1.00 0.00 C +ATOM 104 CA GLN A 104 263.586 265.140 263.826 1.00 0.00 C +ATOM 105 CA GLU A 105 261.554 262.118 264.947 1.00 0.00 C +ATOM 106 CA ASN A 106 260.359 260.208 268.019 1.00 0.00 C +ATOM 107 CA GLU A 107 261.671 256.851 269.256 1.00 0.00 C +ATOM 108 CA ILE A 108 260.732 253.159 269.303 1.00 0.00 C +ATOM 109 CA ALA A 109 260.794 250.249 266.845 1.00 0.00 C +ATOM 110 CA SER A 110 261.587 247.377 264.470 1.00 0.00 C +ATOM 111 CA ALA A 111 259.126 244.488 264.809 1.00 0.00 C +ATOM 112 CA SER A 112 258.602 241.652 267.298 1.00 0.00 C +ATOM 113 CA GLN A 113 257.010 240.117 270.401 1.00 0.00 C +ATOM 114 CA VAL A 114 255.463 236.637 270.303 1.00 0.00 C +ATOM 115 CA THR A 115 254.800 233.426 268.361 1.00 0.00 C +ATOM 116 CA SER A 116 257.321 231.168 266.611 1.00 0.00 C +ATOM 117 CA TYR A 117 255.297 228.080 265.671 1.00 0.00 C +ATOM 118 CA GLN A 118 252.763 225.948 267.555 1.00 0.00 C +ATOM 119 CA GLY A 119 253.335 222.212 267.072 1.00 0.00 C +ATOM 120 CA ASN A 120 254.644 219.505 269.412 1.00 0.00 C +ATOM 121 CA SER A 121 255.982 216.643 271.541 1.00 0.00 C +ATOM 122 CA GLN A 122 256.859 213.028 270.717 1.00 0.00 C +ATOM 123 CA TYR A 123 255.852 209.884 272.620 1.00 0.00 C +ATOM 124 CA MET A 124 253.545 207.680 274.702 1.00 0.00 C +ATOM 125 CA SER A 125 249.863 208.611 275.008 1.00 0.00 C +ATOM 126 CA SER A 126 246.636 209.750 273.334 1.00 0.00 C +ATOM 127 CA ASN A 127 242.997 210.279 272.338 1.00 0.00 C +ATOM 128 CA PRO A 128 241.091 207.172 273.448 1.00 0.00 C +ATOM 129 CA GLY A 129 242.187 203.559 273.958 1.00 0.00 C +ATOM 130 CA TYR A 130 245.097 201.742 272.301 1.00 0.00 C +ATOM 131 CA GLU A 131 246.171 201.162 268.692 1.00 0.00 C +ATOM 132 CA SER A 132 247.559 198.579 266.260 1.00 0.00 C +ATOM 133 CA TRP A 133 250.839 197.620 264.576 1.00 0.00 C +ATOM 134 CA SER A 134 254.387 196.770 265.675 1.00 0.00 C +ATOM 135 CA PRO A 135 255.566 193.897 263.468 1.00 0.00 C +ATOM 136 CA ASP A 136 252.741 191.364 263.129 1.00 0.00 C +ATOM 137 CA ASN A 137 252.144 188.713 260.459 1.00 0.00 C +ATOM 138 CA SER A 138 255.018 186.253 260.914 1.00 0.00 C +ATOM 139 CA PRO A 139 254.077 182.656 260.083 1.00 0.00 C +ATOM 140 CA SER A 140 257.135 181.091 258.435 1.00 0.00 C +ATOM 141 CA ARG A 141 258.102 177.985 260.419 1.00 0.00 C +ATOM 142 CA ASN A 142 261.195 175.785 260.087 1.00 0.00 C +ATOM 143 CA GLN A 143 262.184 173.262 257.410 1.00 0.00 C +ATOM 144 CA LEU A 144 264.797 170.639 256.509 1.00 0.00 C +ATOM 145 CA ASN A 145 266.385 167.396 257.726 1.00 0.00 C +ATOM 146 CA MET A 146 269.384 166.314 255.640 1.00 0.00 C +ATOM 147 CA ARG A 147 269.678 168.962 252.916 1.00 0.00 C +ATOM 148 CA GLY A 148 267.502 169.789 249.900 1.00 0.00 C +ATOM 149 CA GLN A 149 264.940 172.545 249.300 1.00 0.00 C +ATOM 150 CA GLN A 150 265.389 175.781 247.340 1.00 0.00 C +ATOM 151 CA GLN A 151 266.241 179.192 245.871 1.00 0.00 C +ATOM 152 CA GLN A 152 263.337 181.031 244.227 1.00 0.00 C +ATOM 153 CA ALA A 153 264.460 184.671 244.118 1.00 0.00 C +ATOM 154 CA SER A 154 265.257 186.141 240.695 1.00 0.00 C +ATOM 155 CA ARG A 155 267.241 186.688 237.489 1.00 0.00 C +ATOM 156 CA LYS A 156 270.932 185.931 238.058 1.00 0.00 C +ATOM 157 CA HIS A 157 273.594 184.363 235.829 1.00 0.00 C +TER 158 HIS A 157 +END diff --git a/Plants/Q84YN0/Q84YN0.dcd b/Plants/Q84YN0/Q84YN0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..48c4cd2d403624f3405d4c3350815783d4c6cae3 --- /dev/null +++ b/Plants/Q84YN0/Q84YN0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:ca0340707ce7e6360769373229d8e9c390f7469b642fe0e33ff618cfbee535e8 +size 14720276 diff --git a/Plants/Q84YN0/top.pdb b/Plants/Q84YN0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..df7929bc4deb48c0de0eefc2f171c006cfdf22b3 --- /dev/null +++ b/Plants/Q84YN0/top.pdb @@ -0,0 +1,120 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 316.662 297.422 208.229 1.00 0.00 C +ATOM 2 CA ASP A 2 319.621 297.277 210.624 1.00 0.00 C +ATOM 3 CA SER A 3 320.411 298.733 214.055 1.00 0.00 C +ATOM 4 CA PRO A 4 321.893 301.978 215.392 1.00 0.00 C +ATOM 5 CA ALA A 5 321.470 303.869 218.673 1.00 0.00 C +ATOM 6 CA THR A 6 321.916 303.000 222.355 1.00 0.00 C +ATOM 7 CA PRO A 7 320.977 303.201 226.042 1.00 0.00 C +ATOM 8 CA THR A 8 319.519 306.148 227.967 1.00 0.00 C +ATOM 9 CA ASP A 9 316.550 305.251 230.179 1.00 0.00 C +ATOM 10 CA PHE A 10 314.128 307.460 232.120 1.00 0.00 C +ATOM 11 CA SER A 11 314.488 306.502 235.790 1.00 0.00 C +ATOM 12 CA PRO A 12 311.412 304.646 237.059 1.00 0.00 C +ATOM 13 CA LEU A 13 310.384 301.797 239.370 1.00 0.00 C +ATOM 14 CA HIS A 14 307.255 302.425 241.451 1.00 0.00 C +ATOM 15 CA SER A 15 304.166 302.974 239.289 1.00 0.00 C +ATOM 16 CA LEU A 16 300.910 304.104 237.664 1.00 0.00 C +ATOM 17 CA ALA A 17 299.835 302.449 234.405 1.00 0.00 C +ATOM 18 CA PRO A 18 301.956 302.272 231.245 1.00 0.00 C +ATOM 19 CA GLN A 19 305.516 300.992 231.690 1.00 0.00 C +ATOM 20 CA ASN A 20 306.972 298.718 234.378 1.00 0.00 C +ATOM 21 CA THR A 21 306.334 295.019 235.035 1.00 0.00 C +ATOM 22 CA THR A 22 304.312 291.791 235.106 1.00 0.00 C +ATOM 23 CA ASP A 23 303.923 289.699 238.267 1.00 0.00 C +ATOM 24 CA ASP A 24 301.318 287.467 239.925 1.00 0.00 C +ATOM 25 CA ASP A 25 300.999 284.649 242.469 1.00 0.00 C +ATOM 26 CA GLU A 26 298.384 284.965 245.222 1.00 0.00 C +ATOM 27 CA ARG A 27 295.955 282.031 245.322 1.00 0.00 C +ATOM 28 CA ARG A 28 293.137 279.707 246.403 1.00 0.00 C +ATOM 29 CA PRO A 29 290.365 277.165 247.015 1.00 0.00 C +ATOM 30 CA ALA A 30 286.630 277.912 247.103 1.00 0.00 C +ATOM 31 CA THR A 31 284.111 275.127 247.750 1.00 0.00 C +ATOM 32 CA SER A 32 280.342 275.050 248.301 1.00 0.00 C +ATOM 33 CA SER A 33 276.972 274.552 250.008 1.00 0.00 C +ATOM 34 CA ASP A 34 274.057 276.759 248.935 1.00 0.00 C +ATOM 35 CA GLY A 35 270.991 275.657 246.961 1.00 0.00 C +ATOM 36 CA CYS A 36 270.452 271.894 246.702 1.00 0.00 C +ATOM 37 CA THR A 37 273.893 270.264 246.816 1.00 0.00 C +ATOM 38 CA ALA A 38 274.716 266.568 247.242 1.00 0.00 C +ATOM 39 CA ARG A 39 272.837 263.274 246.876 1.00 0.00 C +ATOM 40 CA VAL A 40 270.702 261.439 244.309 1.00 0.00 C +ATOM 41 CA GLY A 41 269.193 258.658 242.186 1.00 0.00 C +ATOM 42 CA ASN A 42 267.278 255.732 240.675 1.00 0.00 C +ATOM 43 CA GLY A 43 268.699 254.245 237.468 1.00 0.00 C +ATOM 44 CA GLY A 44 268.543 254.752 233.695 1.00 0.00 C +ATOM 45 CA SER A 45 268.636 251.403 231.881 1.00 0.00 C +ATOM 46 CA SER A 46 265.211 250.832 230.311 1.00 0.00 C +ATOM 47 CA PRO A 47 262.148 248.838 229.234 1.00 0.00 C +ATOM 48 CA ALA A 48 259.838 247.074 231.697 1.00 0.00 C +ATOM 49 CA THR A 49 260.064 243.528 233.072 1.00 0.00 C +ATOM 50 CA GLY A 50 256.552 242.524 234.154 1.00 0.00 C +ATOM 51 CA ASP A 51 255.260 239.611 232.065 1.00 0.00 C +ATOM 52 CA GLY A 52 255.494 236.848 229.452 1.00 0.00 C +ATOM 53 CA GLY A 53 253.424 234.999 226.842 1.00 0.00 C +ATOM 54 CA LYS A 54 251.036 234.105 224.011 1.00 0.00 C +ATOM 55 CA GLY A 55 247.575 234.835 225.426 1.00 0.00 C +ATOM 56 CA ALA A 56 244.133 234.754 227.058 1.00 0.00 C +ATOM 57 CA ALA A 57 242.611 236.876 229.832 1.00 0.00 C +ATOM 58 CA GLY A 58 241.200 235.995 233.260 1.00 0.00 C +ATOM 59 CA VAL A 59 238.888 238.608 234.790 1.00 0.00 C +ATOM 60 CA PRO A 60 236.426 240.190 237.230 1.00 0.00 C +ATOM 61 CA LEU A 61 235.228 243.192 239.247 1.00 0.00 C +ATOM 62 CA LEU A 62 238.263 244.772 240.923 1.00 0.00 C +ATOM 63 CA ARG A 63 240.228 243.071 243.709 1.00 0.00 C +ATOM 64 CA VAL A 64 241.993 241.249 246.552 1.00 0.00 C +ATOM 65 CA HIS A 65 239.854 238.983 248.743 1.00 0.00 C +ATOM 66 CA PRO A 66 236.302 239.656 249.946 1.00 0.00 C +ATOM 67 CA THR A 67 233.385 239.752 252.395 1.00 0.00 C +ATOM 68 CA THR A 68 230.547 238.718 254.717 1.00 0.00 C +ATOM 69 CA ALA A 69 230.199 236.062 257.426 1.00 0.00 C +ATOM 70 CA THR A 70 230.718 236.150 261.200 1.00 0.00 C +ATOM 71 CA ASP A 71 231.969 239.662 261.986 1.00 0.00 C +ATOM 72 CA GLY A 72 229.347 242.373 262.527 1.00 0.00 C +ATOM 73 CA ASN A 73 226.377 244.642 263.268 1.00 0.00 C +ATOM 74 CA GLY A 74 224.097 246.605 260.931 1.00 0.00 C +ATOM 75 CA ASN A 75 220.513 247.526 260.022 1.00 0.00 C +ATOM 76 CA GLY A 76 217.015 246.034 259.799 1.00 0.00 C +ATOM 77 CA TYR A 77 216.865 243.357 262.506 1.00 0.00 C +ATOM 78 CA ARG A 78 215.632 239.861 261.624 1.00 0.00 C +ATOM 79 CA GLY A 79 216.630 236.236 262.235 1.00 0.00 C +ATOM 80 CA GLY A 80 215.761 232.557 261.756 1.00 0.00 C +ATOM 81 CA ALA A 81 212.168 231.546 262.519 1.00 0.00 C +ATOM 82 CA ALA A 82 209.887 232.124 259.522 1.00 0.00 C +ATOM 83 CA ARG A 83 207.484 234.058 257.287 1.00 0.00 C +ATOM 84 CA LEU A 84 205.427 236.921 255.841 1.00 0.00 C +ATOM 85 CA ASP A 85 201.671 237.499 256.114 1.00 0.00 C +ATOM 86 CA GLY A 86 200.889 239.636 259.169 1.00 0.00 C +ATOM 87 CA ARG A 87 197.905 240.626 261.321 1.00 0.00 C +ATOM 88 CA GLN A 88 197.671 242.590 264.577 1.00 0.00 C +ATOM 89 CA TRP A 89 197.586 241.660 268.271 1.00 0.00 C +ATOM 90 CA ARG A 90 199.843 238.604 268.568 1.00 0.00 C +ATOM 91 CA ARG A 91 202.130 236.574 270.840 1.00 0.00 C +ATOM 92 CA ARG A 92 201.614 232.799 270.792 1.00 0.00 C +ATOM 93 CA LEU A 93 202.901 229.443 272.056 1.00 0.00 C +ATOM 94 CA GLY A 94 205.812 227.956 274.014 1.00 0.00 C +ATOM 95 CA GLN A 95 206.447 225.162 276.525 1.00 0.00 C +ATOM 96 CA SER A 96 206.989 222.459 279.155 1.00 0.00 C +ATOM 97 CA GLY A 97 204.837 219.429 278.316 1.00 0.00 C +ATOM 98 CA GLY A 98 204.757 215.655 277.796 1.00 0.00 C +ATOM 99 CA GLY A 99 204.154 213.836 274.503 1.00 0.00 C +ATOM 100 CA ALA A 100 204.190 210.052 274.946 1.00 0.00 C +ATOM 101 CA THR A 101 205.595 206.719 276.142 1.00 0.00 C +ATOM 102 CA GLY A 102 205.054 203.744 278.460 1.00 0.00 C +ATOM 103 CA ASP A 103 202.606 200.872 277.938 1.00 0.00 C +ATOM 104 CA GLU A 104 199.949 199.113 280.026 1.00 0.00 C +ATOM 105 CA GLY A 105 198.141 195.934 281.097 1.00 0.00 C +ATOM 106 CA ALA A 106 198.171 192.891 283.389 1.00 0.00 C +ATOM 107 CA ARG A 107 198.875 189.216 284.105 1.00 0.00 C +ATOM 108 CA ASP A 108 197.943 187.140 281.049 1.00 0.00 C +ATOM 109 CA LEU A 109 200.608 184.756 279.734 1.00 0.00 C +ATOM 110 CA GLY A 110 201.966 186.503 276.632 1.00 0.00 C +ATOM 111 CA GLN A 111 204.468 188.498 274.565 1.00 0.00 C +ATOM 112 CA THR A 112 208.092 188.738 273.414 1.00 0.00 C +ATOM 113 CA GLU A 113 209.538 186.275 270.892 1.00 0.00 C +ATOM 114 CA GLU A 114 209.635 188.029 267.511 1.00 0.00 C +ATOM 115 CA ASP A 115 209.174 191.731 266.738 1.00 0.00 C +ATOM 116 CA ASP A 116 206.224 194.137 266.578 1.00 0.00 C +TER 117 ASP A 116 +END diff --git a/Plants/Q84YQ7/Q84YQ7.dcd b/Plants/Q84YQ7/Q84YQ7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..af7fd401817968fb8c635f786ce8642bbc135974 --- /dev/null +++ b/Plants/Q84YQ7/Q84YQ7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:45c3f140570b00b9465ef374ac5c41310881f1a52673f2922fc719fbadaaabc1 +size 9800276 diff --git a/Plants/Q84YQ7/top.pdb b/Plants/Q84YQ7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..d843edbd2cf431cc0316becd06d2a246c00b2d9a --- /dev/null +++ b/Plants/Q84YQ7/top.pdb @@ -0,0 +1,79 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 233.373 249.246 250.627 1.00 0.00 C +ATOM 2 CA THR A 2 232.118 249.128 254.222 1.00 0.00 C +ATOM 3 CA GLY A 3 228.558 249.767 255.420 1.00 0.00 C +ATOM 4 CA ALA A 4 226.628 250.195 258.677 1.00 0.00 C +ATOM 5 CA GLU A 5 227.450 252.512 261.588 1.00 0.00 C +ATOM 6 CA ALA A 6 224.547 254.809 262.489 1.00 0.00 C +ATOM 7 CA PRO A 7 224.169 257.718 260.058 1.00 0.00 C +ATOM 8 CA ARG A 8 226.679 256.989 257.286 1.00 0.00 C +ATOM 9 CA PRO A 9 229.382 259.377 256.056 1.00 0.00 C +ATOM 10 CA THR A 10 230.172 258.352 252.472 1.00 0.00 C +ATOM 11 CA GLY A 11 232.225 260.898 250.519 1.00 0.00 C +ATOM 12 CA THR A 12 235.926 260.261 251.166 1.00 0.00 C +ATOM 13 CA GLU A 13 236.025 258.312 254.438 1.00 0.00 C +ATOM 14 CA ALA A 14 237.837 255.139 255.518 1.00 0.00 C +ATOM 15 CA ARG A 15 239.079 251.649 256.405 1.00 0.00 C +ATOM 16 CA ARG A 16 239.936 248.474 254.480 1.00 0.00 C +ATOM 17 CA PRO A 17 241.261 247.413 251.069 1.00 0.00 C +ATOM 18 CA ALA A 18 240.492 249.674 248.101 1.00 0.00 C +ATOM 19 CA SER A 19 239.983 248.652 244.466 1.00 0.00 C +ATOM 20 CA VAL A 20 238.954 245.840 242.111 1.00 0.00 C +ATOM 21 CA ALA A 21 240.515 244.999 238.738 1.00 0.00 C +ATOM 22 CA ALA A 22 238.504 243.962 235.673 1.00 0.00 C +ATOM 23 CA SER A 23 239.041 246.591 232.968 1.00 0.00 C +ATOM 24 CA ARG A 24 242.039 248.912 233.341 1.00 0.00 C +ATOM 25 CA SER A 25 245.844 248.789 233.206 1.00 0.00 C +ATOM 26 CA ALA A 26 249.145 249.471 231.429 1.00 0.00 C +ATOM 27 CA MET A 27 252.112 247.109 231.069 1.00 0.00 C +ATOM 28 CA SER A 28 252.553 244.202 233.492 1.00 0.00 C +ATOM 29 CA LEU A 29 254.503 241.781 235.694 1.00 0.00 C +ATOM 30 CA PRO A 30 254.998 238.839 238.064 1.00 0.00 C +ATOM 31 CA LEU A 31 256.119 235.500 236.611 1.00 0.00 C +ATOM 32 CA HIS A 32 257.747 233.289 233.969 1.00 0.00 C +ATOM 33 CA PRO A 33 258.161 231.840 230.469 1.00 0.00 C +ATOM 34 CA GLN A 34 259.474 233.516 227.310 1.00 0.00 C +ATOM 35 CA SER A 35 262.113 235.697 225.638 1.00 0.00 C +ATOM 36 CA ILE A 36 263.885 238.114 227.989 1.00 0.00 C +ATOM 37 CA VAL A 37 267.234 236.641 229.052 1.00 0.00 C +ATOM 38 CA LYS A 38 267.147 235.762 232.759 1.00 0.00 C +ATOM 39 CA ASN A 39 264.956 238.474 234.295 1.00 0.00 C +ATOM 40 CA ALA A 40 263.433 241.893 235.005 1.00 0.00 C +ATOM 41 CA HIS A 41 264.873 244.518 237.362 1.00 0.00 C +ATOM 42 CA PRO A 42 263.683 247.625 239.218 1.00 0.00 C +ATOM 43 CA THR A 43 260.902 246.549 241.590 1.00 0.00 C +ATOM 44 CA SER A 44 257.172 245.932 242.063 1.00 0.00 C +ATOM 45 CA ASP A 45 255.664 244.152 245.075 1.00 0.00 C +ATOM 46 CA ASP A 46 256.169 240.376 245.034 1.00 0.00 C +ATOM 47 CA ASP A 47 254.845 236.818 244.714 1.00 0.00 C +ATOM 48 CA GLU A 48 251.038 236.759 244.571 1.00 0.00 C +ATOM 49 CA ILE A 49 247.448 237.673 245.461 1.00 0.00 C +ATOM 50 CA GLY A 50 245.374 240.722 244.501 1.00 0.00 C +ATOM 51 CA GLY A 51 243.921 243.930 245.955 1.00 0.00 C +ATOM 52 CA GLY A 52 246.588 246.089 247.610 1.00 0.00 C +ATOM 53 CA ARG A 53 249.624 248.244 246.804 1.00 0.00 C +ATOM 54 CA GLY A 54 252.695 250.120 245.552 1.00 0.00 C +ATOM 55 CA GLY A 55 255.182 252.993 245.270 1.00 0.00 C +ATOM 56 CA GLY A 56 258.070 255.242 246.327 1.00 0.00 C +ATOM 57 CA GLU A 57 260.067 257.242 248.882 1.00 0.00 C +ATOM 58 CA VAL A 58 261.870 255.877 251.948 1.00 0.00 C +ATOM 59 CA ASN A 59 265.212 255.366 253.706 1.00 0.00 C +ATOM 60 CA PRO A 60 266.086 251.808 254.751 1.00 0.00 C +ATOM 61 CA ASP A 61 266.586 251.071 258.455 1.00 0.00 C +ATOM 62 CA SER A 62 264.526 253.122 260.918 1.00 0.00 C +ATOM 63 CA ARG A 63 264.602 253.303 264.723 1.00 0.00 C +ATOM 64 CA TRP A 64 262.264 254.904 267.270 1.00 0.00 C +ATOM 65 CA GLY A 65 260.010 257.195 269.316 1.00 0.00 C +ATOM 66 CA ARG A 66 261.241 258.396 272.716 1.00 0.00 C +ATOM 67 CA GLY A 67 262.067 257.086 276.197 1.00 0.00 C +ATOM 68 CA MET A 68 261.156 259.968 278.516 1.00 0.00 C +ATOM 69 CA LEU A 69 261.161 263.615 277.411 1.00 0.00 C +ATOM 70 CA ALA A 70 259.171 266.786 278.115 1.00 0.00 C +ATOM 71 CA VAL A 71 255.592 267.020 276.829 1.00 0.00 C +ATOM 72 CA THR A 72 254.106 270.468 277.474 1.00 0.00 C +ATOM 73 CA GLY A 73 251.327 272.905 278.399 1.00 0.00 C +ATOM 74 CA CYS A 74 247.774 273.070 279.764 1.00 0.00 C +ATOM 75 CA GLY A 75 247.618 273.268 283.566 1.00 0.00 C +TER 76 GLY A 75 +END diff --git a/Plants/Q84YS1/Q84YS1.dcd b/Plants/Q84YS1/Q84YS1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..98c12a11eadf6efb209ee946434e9a176a3fc234 --- /dev/null +++ b/Plants/Q84YS1/Q84YS1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:16f5a2a93a2495b1b8349b97e6ca7e1f153941dd0ab434a4472d96d7ed5f6eea +size 8600276 diff --git a/Plants/Q84YS1/top.pdb b/Plants/Q84YS1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..bcfffb74752e74523ac27ba3487ffb79f6597422 --- /dev/null +++ b/Plants/Q84YS1/top.pdb @@ -0,0 +1,69 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 269.503 245.506 239.029 1.00 0.00 C +ATOM 2 CA GLY A 2 266.540 243.201 238.380 1.00 0.00 C +ATOM 3 CA THR A 3 263.301 242.559 240.280 1.00 0.00 C +ATOM 4 CA VAL A 4 261.093 244.474 242.724 1.00 0.00 C +ATOM 5 CA ALA A 5 258.589 244.773 245.581 1.00 0.00 C +ATOM 6 CA LYS A 6 258.628 248.153 247.339 1.00 0.00 C +ATOM 7 CA GLY A 7 260.386 251.190 245.855 1.00 0.00 C +ATOM 8 CA THR A 8 258.672 254.501 245.070 1.00 0.00 C +ATOM 9 CA THR A 9 260.737 257.563 244.136 1.00 0.00 C +ATOM 10 CA ARG A 10 260.730 261.349 244.562 1.00 0.00 C +ATOM 11 CA ALA A 11 263.689 263.599 245.397 1.00 0.00 C +ATOM 12 CA ALA A 12 266.770 265.664 244.527 1.00 0.00 C +ATOM 13 CA VAL A 13 269.782 267.278 246.213 1.00 0.00 C +ATOM 14 CA HIS A 14 270.140 270.339 248.453 1.00 0.00 C +ATOM 15 CA GLY A 15 269.188 272.342 251.551 1.00 0.00 C +ATOM 16 CA SER A 16 266.967 272.962 254.584 1.00 0.00 C +ATOM 17 CA ARG A 17 264.381 272.974 257.381 1.00 0.00 C +ATOM 18 CA SER A 18 263.796 270.250 259.980 1.00 0.00 C +ATOM 19 CA PRO A 19 263.438 268.531 263.361 1.00 0.00 C +ATOM 20 CA ALA A 20 266.032 270.238 265.568 1.00 0.00 C +ATOM 21 CA THR A 21 269.381 268.442 265.289 1.00 0.00 C +ATOM 22 CA THR A 22 268.826 265.196 263.373 1.00 0.00 C +ATOM 23 CA THR A 23 271.098 262.638 261.696 1.00 0.00 C +ATOM 24 CA LEU A 24 272.664 260.100 259.326 1.00 0.00 C +ATOM 25 CA HIS A 25 275.909 259.972 257.333 1.00 0.00 C +ATOM 26 CA ASN A 26 276.085 258.802 253.712 1.00 0.00 C +ATOM 27 CA LYS A 27 273.273 257.305 251.623 1.00 0.00 C +ATOM 28 CA GLU A 28 270.299 259.198 250.177 1.00 0.00 C +ATOM 29 CA GLU A 29 267.498 257.311 248.415 1.00 0.00 C +ATOM 30 CA VAL A 30 264.092 256.922 250.078 1.00 0.00 C +ATOM 31 CA GLU A 31 261.885 259.131 252.261 1.00 0.00 C +ATOM 32 CA THR A 32 258.131 258.626 252.664 1.00 0.00 C +ATOM 33 CA ALA A 33 254.658 257.617 253.865 1.00 0.00 C +ATOM 34 CA VAL A 34 251.915 255.262 255.066 1.00 0.00 C +ATOM 35 CA GLU A 35 250.842 252.112 253.211 1.00 0.00 C +ATOM 36 CA ARG A 36 250.127 248.584 254.461 1.00 0.00 C +ATOM 37 CA GLY A 37 252.903 246.137 253.552 1.00 0.00 C +ATOM 38 CA ARG A 38 253.960 244.711 250.181 1.00 0.00 C +ATOM 39 CA GLU A 39 251.656 243.392 247.449 1.00 0.00 C +ATOM 40 CA GLN A 40 249.423 242.254 244.579 1.00 0.00 C +ATOM 41 CA LYS A 41 247.293 243.405 241.637 1.00 0.00 C +ATOM 42 CA HIS A 42 244.786 244.168 238.871 1.00 0.00 C +ATOM 43 CA LYS A 43 241.581 242.126 238.599 1.00 0.00 C +ATOM 44 CA ALA A 44 238.161 240.489 238.975 1.00 0.00 C +ATOM 45 CA ARG A 45 236.254 238.737 241.769 1.00 0.00 C +ATOM 46 CA GLU A 46 233.713 241.179 243.216 1.00 0.00 C +ATOM 47 CA GLU A 47 231.468 242.356 240.371 1.00 0.00 C +ATOM 48 CA VAL A 48 231.353 239.411 237.957 1.00 0.00 C +ATOM 49 CA GLU A 49 232.080 238.094 234.456 1.00 0.00 C +ATOM 50 CA ASP A 50 229.073 236.124 233.193 1.00 0.00 C +ATOM 51 CA LYS A 51 225.586 237.141 234.342 1.00 0.00 C +ATOM 52 CA VAL A 52 223.778 234.108 235.773 1.00 0.00 C +ATOM 53 CA ASP A 53 223.131 233.560 239.487 1.00 0.00 C +ATOM 54 CA ALA A 54 224.251 233.078 243.096 1.00 0.00 C +ATOM 55 CA SER A 55 223.420 234.174 246.650 1.00 0.00 C +ATOM 56 CA ILE A 56 224.792 235.529 249.935 1.00 0.00 C +ATOM 57 CA ALA A 57 223.725 234.185 253.337 1.00 0.00 C +ATOM 58 CA ASP A 58 226.518 234.009 255.922 1.00 0.00 C +ATOM 59 CA HIS A 59 224.876 233.268 259.279 1.00 0.00 C +ATOM 60 CA ARG A 60 224.403 234.563 262.831 1.00 0.00 C +ATOM 61 CA GLN A 61 225.159 234.863 266.553 1.00 0.00 C +ATOM 62 CA PRO A 62 222.646 237.065 268.384 1.00 0.00 C +ATOM 63 CA THR A 63 222.110 240.834 268.532 1.00 0.00 C +ATOM 64 CA THR A 64 220.558 243.192 265.973 1.00 0.00 C +ATOM 65 CA LYS A 65 222.295 243.183 262.583 1.00 0.00 C +TER 66 LYS A 65 +END diff --git a/Plants/Q84YS5/Q84YS5.dcd b/Plants/Q84YS5/Q84YS5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..c68395cf618572619a0f57631feb1605c5425c16 --- /dev/null +++ b/Plants/Q84YS5/Q84YS5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2c3c85516a4d6e41afa69bfcc272cbb88ea0e238ace3c14f54ad57155bda5493 +size 6800276 diff --git a/Plants/Q84YS5/top.pdb b/Plants/Q84YS5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..d51e2f8d043bcd77c846522eb2006e089324d455 --- /dev/null +++ b/Plants/Q84YS5/top.pdb @@ -0,0 +1,54 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 245.837 248.055 227.472 1.00 0.00 C +ATOM 2 CA ALA A 2 248.172 250.971 226.727 1.00 0.00 C +ATOM 3 CA VAL A 3 247.661 253.832 224.263 1.00 0.00 C +ATOM 4 CA GLY A 4 248.444 256.082 221.290 1.00 0.00 C +ATOM 5 CA GLY A 5 249.642 259.032 219.197 1.00 0.00 C +ATOM 6 CA GLY A 6 252.384 261.597 219.843 1.00 0.00 C +ATOM 7 CA GLY A 7 254.097 264.009 222.244 1.00 0.00 C +ATOM 8 CA SER A 8 251.916 266.188 224.483 1.00 0.00 C +ATOM 9 CA LEU A 9 248.720 264.434 225.587 1.00 0.00 C +ATOM 10 CA VAL A 10 245.215 264.157 227.056 1.00 0.00 C +ATOM 11 CA SER A 11 241.941 262.403 226.208 1.00 0.00 C +ATOM 12 CA ASN A 12 241.140 260.729 222.880 1.00 0.00 C +ATOM 13 CA GLU A 13 238.411 258.080 222.655 1.00 0.00 C +ATOM 14 CA THR A 14 237.898 254.925 224.729 1.00 0.00 C +ATOM 15 CA GLY A 15 240.144 254.867 227.806 1.00 0.00 C +ATOM 16 CA VAL A 16 240.776 253.235 231.190 1.00 0.00 C +ATOM 17 CA GLY A 17 243.691 254.583 233.240 1.00 0.00 C +ATOM 18 CA ASN A 18 247.047 255.591 234.736 1.00 0.00 C +ATOM 19 CA GLY A 19 248.759 255.355 238.131 1.00 0.00 C +ATOM 20 CA GLY A 20 248.715 256.963 241.585 1.00 0.00 C +ATOM 21 CA LYS A 21 251.774 256.352 243.772 1.00 0.00 C +ATOM 22 CA VAL A 22 253.699 253.527 245.455 1.00 0.00 C +ATOM 23 CA GLU A 23 256.127 253.449 248.390 1.00 0.00 C +ATOM 24 CA ARG A 24 258.804 251.932 250.636 1.00 0.00 C +ATOM 25 CA GLU A 25 260.641 248.642 250.069 1.00 0.00 C +ATOM 26 CA VAL A 26 264.344 249.130 250.822 1.00 0.00 C +ATOM 27 CA ARG A 27 265.443 251.259 253.785 1.00 0.00 C +ATOM 28 CA ARG A 28 267.073 253.443 256.447 1.00 0.00 C +ATOM 29 CA ARG A 29 264.760 254.239 259.368 1.00 0.00 C +ATOM 30 CA GLN A 30 262.284 251.474 260.228 1.00 0.00 C +ATOM 31 CA LEU A 31 262.500 247.671 260.293 1.00 0.00 C +ATOM 32 CA VAL A 32 265.974 246.410 261.219 1.00 0.00 C +ATOM 33 CA VAL A 33 265.831 242.801 262.431 1.00 0.00 C +ATOM 34 CA ARG A 34 264.871 239.154 261.891 1.00 0.00 C +ATOM 35 CA ASP A 35 263.291 237.013 264.617 1.00 0.00 C +ATOM 36 CA MET A 36 260.228 238.808 266.000 1.00 0.00 C +ATOM 37 CA THR A 37 257.222 239.250 268.298 1.00 0.00 C +ATOM 38 CA THR A 38 253.612 239.329 267.082 1.00 0.00 C +ATOM 39 CA GLY A 39 250.086 237.922 267.408 1.00 0.00 C +ATOM 40 CA LYS A 40 247.106 235.938 268.711 1.00 0.00 C +ATOM 41 CA ARG A 41 243.380 235.813 269.495 1.00 0.00 C +ATOM 42 CA ARG A 42 239.945 237.461 269.511 1.00 0.00 C +ATOM 43 CA GLY A 43 238.016 236.115 272.509 1.00 0.00 C +ATOM 44 CA ARG A 44 236.969 238.449 275.332 1.00 0.00 C +ATOM 45 CA GLY A 45 235.747 238.323 278.938 1.00 0.00 C +ATOM 46 CA GLY A 46 235.486 241.475 281.063 1.00 0.00 C +ATOM 47 CA GLY A 47 237.857 243.725 283.021 1.00 0.00 C +ATOM 48 CA ASN A 48 239.786 246.443 284.866 1.00 0.00 C +ATOM 49 CA THR A 49 237.671 248.885 286.886 1.00 0.00 C +ATOM 50 CA LEU A 50 238.868 250.476 290.135 1.00 0.00 C +TER 51 LEU A 50 +END diff --git a/Plants/Q84YU8/Q84YU8.dcd b/Plants/Q84YU8/Q84YU8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..367395b037eae1c0f138fbc961bdb76603bc4da7 --- /dev/null +++ b/Plants/Q84YU8/Q84YU8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:d5dc6b54cb6ea73f43372c09cee5b3e7417645f733663972df5d61f74f387982 +size 18200276 diff --git a/Plants/Q84YU8/top.pdb b/Plants/Q84YU8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..ae9dfd7f61d82e99a29da2bc094e7c42dd9c1c78 --- /dev/null +++ b/Plants/Q84YU8/top.pdb @@ -0,0 +1,149 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 235.843 220.917 289.841 1.00 0.00 C +ATOM 2 CA LEU A 2 236.524 222.264 286.343 1.00 0.00 C +ATOM 3 CA MET A 3 238.958 224.280 284.215 1.00 0.00 C +ATOM 4 CA ALA A 4 238.302 225.435 280.644 1.00 0.00 C +ATOM 5 CA ALA A 5 235.980 226.426 277.790 1.00 0.00 C +ATOM 6 CA ALA A 6 236.091 229.661 275.780 1.00 0.00 C +ATOM 7 CA ALA A 7 239.167 231.835 275.213 1.00 0.00 C +ATOM 8 CA TRP A 8 240.189 235.430 275.955 1.00 0.00 C +ATOM 9 CA ARG A 9 243.992 235.344 276.165 1.00 0.00 C +ATOM 10 CA GLY A 10 246.021 237.996 277.999 1.00 0.00 C +ATOM 11 CA SER A 11 245.628 241.127 275.863 1.00 0.00 C +ATOM 12 CA GLY A 12 243.817 240.572 272.558 1.00 0.00 C +ATOM 13 CA SER A 13 242.044 241.758 269.400 1.00 0.00 C +ATOM 14 CA SER A 14 241.909 245.559 269.622 1.00 0.00 C +ATOM 15 CA GLY A 15 242.747 249.098 270.757 1.00 0.00 C +ATOM 16 CA CYS A 16 243.036 251.674 267.965 1.00 0.00 C +ATOM 17 CA GLY A 17 246.310 251.157 266.086 1.00 0.00 C +ATOM 18 CA ALA A 18 249.952 250.535 267.014 1.00 0.00 C +ATOM 19 CA ARG A 19 251.233 247.704 269.219 1.00 0.00 C +ATOM 20 CA PRO A 20 252.900 246.955 272.562 1.00 0.00 C +ATOM 21 CA GLU A 21 255.928 248.874 273.854 1.00 0.00 C +ATOM 22 CA VAL A 22 259.554 247.722 273.666 1.00 0.00 C +ATOM 23 CA ALA A 23 260.647 244.998 276.096 1.00 0.00 C +ATOM 24 CA ALA A 24 259.622 243.494 279.443 1.00 0.00 C +ATOM 25 CA SER A 25 261.923 242.523 282.320 1.00 0.00 C +ATOM 26 CA GLY A 26 265.067 242.099 284.430 1.00 0.00 C +ATOM 27 CA GLY A 27 265.023 240.414 287.847 1.00 0.00 C +ATOM 28 CA ALA A 28 264.104 241.825 291.265 1.00 0.00 C +ATOM 29 CA SER A 29 264.106 242.705 294.972 1.00 0.00 C +ATOM 30 CA GLY A 30 266.770 244.588 296.940 1.00 0.00 C +ATOM 31 CA GLU A 31 270.218 246.039 296.219 1.00 0.00 C +ATOM 32 CA ARG A 32 273.698 245.129 294.963 1.00 0.00 C +ATOM 33 CA ARG A 33 276.715 247.368 295.591 1.00 0.00 C +ATOM 34 CA GLY A 34 278.017 249.214 292.523 1.00 0.00 C +ATOM 35 CA GLY A 35 279.678 248.562 289.157 1.00 0.00 C +ATOM 36 CA GLY A 36 278.905 248.900 285.441 1.00 0.00 C +ATOM 37 CA ARG A 37 275.569 250.685 284.991 1.00 0.00 C +ATOM 38 CA ARG A 38 273.520 249.971 281.860 1.00 0.00 C +ATOM 39 CA HIS A 39 272.402 248.394 278.576 1.00 0.00 C +ATOM 40 CA GLY A 40 270.069 245.610 277.427 1.00 0.00 C +ATOM 41 CA ARG A 41 267.534 245.376 274.593 1.00 0.00 C +ATOM 42 CA ALA A 42 265.283 245.201 271.524 1.00 0.00 C +ATOM 43 CA ARG A 43 263.092 242.090 271.335 1.00 0.00 C +ATOM 44 CA ARG A 44 260.137 239.703 271.040 1.00 0.00 C +ATOM 45 CA LYS A 45 257.453 241.775 269.302 1.00 0.00 C +ATOM 46 CA GLY A 46 256.822 242.067 265.556 1.00 0.00 C +ATOM 47 CA GLU A 47 254.136 244.133 263.815 1.00 0.00 C +ATOM 48 CA LYS A 48 250.839 242.461 262.894 1.00 0.00 C +ATOM 49 CA GLY A 49 248.123 245.124 263.105 1.00 0.00 C +ATOM 50 CA GLU A 50 245.591 247.420 261.421 1.00 0.00 C +ATOM 51 CA GLY A 51 242.593 249.663 260.713 1.00 0.00 C +ATOM 52 CA ASP A 52 240.913 251.420 257.779 1.00 0.00 C +ATOM 53 CA ALA A 53 240.318 249.303 254.668 1.00 0.00 C +ATOM 54 CA GLY A 54 239.131 250.121 251.142 1.00 0.00 C +ATOM 55 CA LYS A 55 238.591 247.457 248.471 1.00 0.00 C +ATOM 56 CA LEU A 56 240.723 246.490 245.466 1.00 0.00 C +ATOM 57 CA TYR A 57 238.562 246.061 242.358 1.00 0.00 C +ATOM 58 CA ARG A 58 236.390 245.425 239.293 1.00 0.00 C +ATOM 59 CA GLY A 59 233.060 245.939 237.513 1.00 0.00 C +ATOM 60 CA SER A 60 231.343 245.360 234.161 1.00 0.00 C +ATOM 61 CA ARG A 61 231.780 247.142 230.822 1.00 0.00 C +ATOM 62 CA GLY A 62 231.912 250.931 230.442 1.00 0.00 C +ATOM 63 CA ALA A 63 229.193 253.594 230.622 1.00 0.00 C +ATOM 64 CA ASP A 64 225.625 253.874 231.929 1.00 0.00 C +ATOM 65 CA MET A 65 222.081 254.923 232.851 1.00 0.00 C +ATOM 66 CA ALA A 66 219.083 257.167 232.148 1.00 0.00 C +ATOM 67 CA GLY A 67 216.121 254.861 231.497 1.00 0.00 C +ATOM 68 CA LYS A 68 214.240 251.713 230.463 1.00 0.00 C +ATOM 69 CA PRO A 69 211.036 250.388 232.043 1.00 0.00 C +ATOM 70 CA PRO A 70 210.582 251.311 235.711 1.00 0.00 C +ATOM 71 CA ARG A 71 210.361 248.331 238.076 1.00 0.00 C +ATOM 72 CA PHE A 72 213.517 246.220 237.769 1.00 0.00 C +ATOM 73 CA GLY A 73 213.044 244.237 234.550 1.00 0.00 C +ATOM 74 CA ARG A 74 212.366 240.668 233.401 1.00 0.00 C +ATOM 75 CA ARG A 75 214.587 237.626 233.976 1.00 0.00 C +ATOM 76 CA ARG A 76 218.336 237.864 234.612 1.00 0.00 C +ATOM 77 CA GLY A 77 220.596 237.091 237.580 1.00 0.00 C +ATOM 78 CA GLY A 78 222.652 239.352 239.854 1.00 0.00 C +ATOM 79 CA ARG A 79 223.911 242.541 238.191 1.00 0.00 C +ATOM 80 CA GLU A 80 227.594 243.309 238.788 1.00 0.00 C +ATOM 81 CA ARG A 81 227.917 244.359 242.436 1.00 0.00 C +ATOM 82 CA GLU A 82 227.072 247.117 244.926 1.00 0.00 C +ATOM 83 CA ARG A 83 225.182 246.761 248.214 1.00 0.00 C +ATOM 84 CA VAL A 84 223.127 246.861 251.422 1.00 0.00 C +ATOM 85 CA GLY A 85 220.845 249.911 251.478 1.00 0.00 C +ATOM 86 CA GLY A 86 222.384 252.903 249.691 1.00 0.00 C +ATOM 87 CA GLY A 87 222.051 254.466 246.232 1.00 0.00 C +ATOM 88 CA ILE A 88 222.579 254.571 242.461 1.00 0.00 C +ATOM 89 CA GLN A 89 225.729 252.657 241.495 1.00 0.00 C +ATOM 90 CA ILE A 90 227.692 252.902 238.239 1.00 0.00 C +ATOM 91 CA GLU A 91 227.527 256.600 237.337 1.00 0.00 C +ATOM 92 CA SER A 92 228.466 259.549 239.559 1.00 0.00 C +ATOM 93 CA ARG A 93 230.909 259.619 242.482 1.00 0.00 C +ATOM 94 CA PRO A 94 233.845 261.369 244.164 1.00 0.00 C +ATOM 95 CA PHE A 95 237.343 260.127 243.305 1.00 0.00 C +ATOM 96 CA ALA A 96 239.757 260.255 240.361 1.00 0.00 C +ATOM 97 CA GLY A 97 243.150 258.543 240.079 1.00 0.00 C +ATOM 98 CA ALA A 98 244.976 255.323 239.179 1.00 0.00 C +ATOM 99 CA ARG A 99 247.406 255.797 236.283 1.00 0.00 C +ATOM 100 CA ALA A 100 250.956 256.061 234.925 1.00 0.00 C +ATOM 101 CA GLY A 101 253.915 257.894 236.474 1.00 0.00 C +ATOM 102 CA GLY A 102 257.164 257.714 234.494 1.00 0.00 C +ATOM 103 CA ASN A 103 258.313 254.081 234.447 1.00 0.00 C +ATOM 104 CA GLY A 104 261.206 252.881 232.278 1.00 0.00 C +ATOM 105 CA GLY A 105 259.613 250.460 229.805 1.00 0.00 C +ATOM 106 CA GLU A 106 260.422 250.176 226.093 1.00 0.00 C +ATOM 107 CA GLY A 107 261.893 250.748 222.625 1.00 0.00 C +ATOM 108 CA GLY A 108 264.182 249.794 219.733 1.00 0.00 C +ATOM 109 CA ASP A 109 263.380 248.051 216.441 1.00 0.00 C +ATOM 110 CA VAL A 110 263.015 244.351 217.274 1.00 0.00 C +ATOM 111 CA GLY A 111 266.034 242.477 215.899 1.00 0.00 C +ATOM 112 CA THR A 112 268.437 241.802 218.777 1.00 0.00 C +ATOM 113 CA ARG A 113 270.702 244.814 219.339 1.00 0.00 C +ATOM 114 CA SER A 114 272.854 247.643 217.967 1.00 0.00 C +ATOM 115 CA GLY A 115 273.050 251.381 218.675 1.00 0.00 C +ATOM 116 CA GLY A 116 270.931 254.073 220.342 1.00 0.00 C +ATOM 117 CA ALA A 117 269.683 253.252 223.847 1.00 0.00 C +ATOM 118 CA ALA A 118 266.748 252.465 226.145 1.00 0.00 C +ATOM 119 CA TRP A 119 265.378 255.602 227.819 1.00 0.00 C +ATOM 120 CA SER A 120 266.242 258.993 226.313 1.00 0.00 C +ATOM 121 CA GLY A 121 266.326 259.341 222.520 1.00 0.00 C +ATOM 122 CA GLU A 122 266.664 259.130 218.731 1.00 0.00 C +ATOM 123 CA GLY A 123 263.481 258.044 216.941 1.00 0.00 C +ATOM 124 CA GLY A 124 261.253 256.696 219.722 1.00 0.00 C +ATOM 125 CA GLY A 125 258.486 258.839 221.227 1.00 0.00 C +ATOM 126 CA ALA A 126 258.584 261.833 223.581 1.00 0.00 C +ATOM 127 CA ASP A 127 258.623 263.237 227.123 1.00 0.00 C +ATOM 128 CA GLY A 128 259.294 266.258 229.345 1.00 0.00 C +ATOM 129 CA PHE A 129 258.559 269.869 228.376 1.00 0.00 C +ATOM 130 CA SER A 130 261.265 272.233 229.646 1.00 0.00 C +ATOM 131 CA GLY A 131 264.482 270.507 230.735 1.00 0.00 C +ATOM 132 CA GLY A 132 264.908 267.089 232.364 1.00 0.00 C +ATOM 133 CA CYS A 133 266.196 263.725 231.124 1.00 0.00 C +ATOM 134 CA ARG A 134 269.352 261.930 232.279 1.00 0.00 C +ATOM 135 CA ARG A 135 273.005 261.037 231.672 1.00 0.00 C +ATOM 136 CA GLY A 136 276.224 262.789 232.713 1.00 0.00 C +ATOM 137 CA ALA A 137 278.921 264.247 234.976 1.00 0.00 C +ATOM 138 CA GLY A 138 280.748 266.215 237.678 1.00 0.00 C +ATOM 139 CA GLY A 139 281.522 267.567 241.156 1.00 0.00 C +ATOM 140 CA TRP A 140 281.583 269.049 244.665 1.00 0.00 C +ATOM 141 CA ARG A 141 283.390 267.592 247.686 1.00 0.00 C +ATOM 142 CA LYS A 142 282.224 267.821 251.306 1.00 0.00 C +ATOM 143 CA GLY A 143 283.228 267.016 254.892 1.00 0.00 C +ATOM 144 CA THR A 144 283.849 267.486 258.622 1.00 0.00 C +ATOM 145 CA THR A 145 284.330 265.474 261.821 1.00 0.00 C +TER 146 THR A 145 +END diff --git a/Plants/Q84YX7/Q84YX7.dcd b/Plants/Q84YX7/Q84YX7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..f27ce345ab67ac97d9de358dcd3f02322e8f1265 --- /dev/null +++ b/Plants/Q84YX7/Q84YX7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:a9cab446e5e45eb68a7e65fc744da66faa3c0e5407a4e7b1db2f538323b4ed75 +size 11360276 diff --git a/Plants/Q84YX7/top.pdb b/Plants/Q84YX7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..9896c1b610ec42339279adf941b7557eda5bdda3 --- /dev/null +++ b/Plants/Q84YX7/top.pdb @@ -0,0 +1,92 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 288.336 278.709 225.697 1.00 0.00 C +ATOM 2 CA ALA A 2 285.463 279.511 223.325 1.00 0.00 C +ATOM 3 CA ARG A 3 281.888 280.825 223.268 1.00 0.00 C +ATOM 4 CA GLY A 4 279.163 278.191 222.871 1.00 0.00 C +ATOM 5 CA GLY A 5 278.568 277.003 219.301 1.00 0.00 C +ATOM 6 CA MET A 6 276.162 274.420 217.867 1.00 0.00 C +ATOM 7 CA ALA A 7 273.945 271.642 219.241 1.00 0.00 C +ATOM 8 CA ARG A 8 271.109 270.603 216.919 1.00 0.00 C +ATOM 9 CA VAL A 9 268.006 269.164 218.597 1.00 0.00 C +ATOM 10 CA GLN A 10 264.652 267.370 218.816 1.00 0.00 C +ATOM 11 CA ARG A 11 262.111 265.728 221.132 1.00 0.00 C +ATOM 12 CA ARG A 12 261.455 264.073 224.500 1.00 0.00 C +ATOM 13 CA ARG A 13 260.923 266.242 227.587 1.00 0.00 C +ATOM 14 CA LYS A 14 261.963 267.014 231.170 1.00 0.00 C +ATOM 15 CA ALA A 15 261.532 270.334 232.989 1.00 0.00 C +ATOM 16 CA ALA A 16 261.982 273.488 235.079 1.00 0.00 C +ATOM 17 CA THR A 17 262.713 274.745 238.600 1.00 0.00 C +ATOM 18 CA GLY A 18 259.467 274.999 240.579 1.00 0.00 C +ATOM 19 CA GLY A 19 256.744 272.363 240.966 1.00 0.00 C +ATOM 20 CA GLY A 20 255.112 271.103 244.170 1.00 0.00 C +ATOM 21 CA GLY A 21 254.604 267.787 245.976 1.00 0.00 C +ATOM 22 CA ARG A 22 251.409 265.899 245.114 1.00 0.00 C +ATOM 23 CA ARG A 23 249.482 266.705 241.928 1.00 0.00 C +ATOM 24 CA ARG A 24 246.830 264.033 241.347 1.00 0.00 C +ATOM 25 CA ARG A 25 243.268 265.015 242.277 1.00 0.00 C +ATOM 26 CA ASP A 26 240.570 264.820 239.594 1.00 0.00 C +ATOM 27 CA ASP A 27 236.910 264.925 240.647 1.00 0.00 C +ATOM 28 CA ALA A 28 233.498 266.105 241.864 1.00 0.00 C +ATOM 29 CA GLY A 29 230.964 263.561 243.139 1.00 0.00 C +ATOM 30 CA ASP A 30 228.721 261.636 245.543 1.00 0.00 C +ATOM 31 CA GLU A 31 225.219 260.585 246.613 1.00 0.00 C +ATOM 32 CA ALA A 32 223.396 260.404 249.954 1.00 0.00 C +ATOM 33 CA ALA A 33 225.845 258.874 252.440 1.00 0.00 C +ATOM 34 CA ALA A 34 227.078 257.180 255.622 1.00 0.00 C +ATOM 35 CA LYS A 35 230.787 256.393 255.989 1.00 0.00 C +ATOM 36 CA GLN A 36 231.207 254.166 259.052 1.00 0.00 C +ATOM 37 CA LEU A 37 234.379 252.128 258.500 1.00 0.00 C +ATOM 38 CA SER A 38 237.320 253.916 260.134 1.00 0.00 C +ATOM 39 CA GLY A 39 238.057 256.735 262.588 1.00 0.00 C +ATOM 40 CA GLY A 40 240.214 259.839 263.064 1.00 0.00 C +ATOM 41 CA ALA A 41 242.883 261.068 260.638 1.00 0.00 C +ATOM 42 CA ALA A 42 246.580 261.121 259.721 1.00 0.00 C +ATOM 43 CA ALA A 43 248.924 258.335 260.843 1.00 0.00 C +ATOM 44 CA SER A 44 250.010 255.847 263.516 1.00 0.00 C +ATOM 45 CA GLY A 45 247.307 253.659 265.074 1.00 0.00 C +ATOM 46 CA ALA A 46 247.131 249.920 264.361 1.00 0.00 C +ATOM 47 CA GLY A 47 245.530 246.590 263.433 1.00 0.00 C +ATOM 48 CA GLU A 48 242.487 245.242 265.287 1.00 0.00 C +ATOM 49 CA ARG A 49 241.679 241.599 264.518 1.00 0.00 C +ATOM 50 CA GLU A 50 241.181 239.890 267.887 1.00 0.00 C +ATOM 51 CA ARG A 51 243.239 236.684 267.880 1.00 0.00 C +ATOM 52 CA GLY A 52 241.633 233.343 268.759 1.00 0.00 C +ATOM 53 CA ARG A 53 244.081 230.424 268.717 1.00 0.00 C +ATOM 54 CA GLY A 54 245.551 227.128 269.939 1.00 0.00 C +ATOM 55 CA GLY A 55 247.379 224.317 271.748 1.00 0.00 C +ATOM 56 CA GLY A 56 249.480 221.309 272.776 1.00 0.00 C +ATOM 57 CA ILE A 57 250.323 218.959 269.898 1.00 0.00 C +ATOM 58 CA SER A 58 248.812 217.086 266.945 1.00 0.00 C +ATOM 59 CA PRO A 59 246.658 214.747 264.846 1.00 0.00 C +ATOM 60 CA THR A 60 247.973 212.972 261.741 1.00 0.00 C +ATOM 61 CA THR A 61 251.179 213.893 259.901 1.00 0.00 C +ATOM 62 CA THR A 62 253.043 217.209 260.117 1.00 0.00 C +ATOM 63 CA ASP A 63 256.797 217.373 259.488 1.00 0.00 C +ATOM 64 CA ASP A 64 258.387 219.158 262.455 1.00 0.00 C +ATOM 65 CA GLY A 65 255.751 221.265 264.223 1.00 0.00 C +ATOM 66 CA GLU A 66 255.909 225.044 263.758 1.00 0.00 C +ATOM 67 CA ARG A 67 252.977 227.115 265.032 1.00 0.00 C +ATOM 68 CA ARG A 68 251.192 228.574 261.998 1.00 0.00 C +ATOM 69 CA ARG A 69 248.232 230.721 260.929 1.00 0.00 C +ATOM 70 CA THR A 70 248.516 231.893 257.314 1.00 0.00 C +ATOM 71 CA ALA A 71 251.700 233.964 257.017 1.00 0.00 C +ATOM 72 CA ALA A 72 251.062 237.219 258.892 1.00 0.00 C +ATOM 73 CA THR A 73 250.150 240.882 259.407 1.00 0.00 C +ATOM 74 CA ALA A 74 247.426 243.114 257.953 1.00 0.00 C +ATOM 75 CA GLY A 75 244.019 244.351 256.779 1.00 0.00 C +ATOM 76 CA LEU A 76 241.720 246.597 254.732 1.00 0.00 C +ATOM 77 CA SER A 77 241.422 250.381 254.405 1.00 0.00 C +ATOM 78 CA PRO A 78 244.493 252.229 255.697 1.00 0.00 C +ATOM 79 CA GLU A 79 247.371 249.791 255.167 1.00 0.00 C +ATOM 80 CA PRO A 80 247.656 246.981 252.609 1.00 0.00 C +ATOM 81 CA PRO A 81 247.443 248.062 248.961 1.00 0.00 C +ATOM 82 CA SER A 82 248.045 245.145 246.585 1.00 0.00 C +ATOM 83 CA GLU A 83 246.726 242.043 248.360 1.00 0.00 C +ATOM 84 CA HIS A 84 246.598 238.641 246.650 1.00 0.00 C +ATOM 85 CA GLY A 85 249.256 235.928 246.342 1.00 0.00 C +ATOM 86 CA GLY A 86 248.007 232.435 247.210 1.00 0.00 C +ATOM 87 CA ARG A 87 248.527 230.145 244.209 1.00 0.00 C +ATOM 88 CA GLY A 88 246.502 231.376 241.226 1.00 0.00 C +TER 89 GLY A 88 +END diff --git a/Plants/Q84Z20/Q84Z20.dcd b/Plants/Q84Z20/Q84Z20.dcd new file mode 100644 index 0000000000000000000000000000000000000000..ce8a71bef38b80d879f2a9dcc374ee9c6ee899bd --- /dev/null +++ b/Plants/Q84Z20/Q84Z20.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:4fa6b87eb6bba4b20a119ff62a498f1f169612c8cc021b3fe11274a7e3a2c514 +size 11480276 diff --git a/Plants/Q84Z20/top.pdb b/Plants/Q84Z20/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..6fd00f4ad252ee2fb7de588c11deed52d116392e --- /dev/null +++ b/Plants/Q84Z20/top.pdb @@ -0,0 +1,93 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 251.490 257.308 235.035 1.00 0.00 C +ATOM 2 CA VAL A 2 249.284 257.177 238.138 1.00 0.00 C +ATOM 3 CA GLY A 3 245.597 256.530 238.848 1.00 0.00 C +ATOM 4 CA GLY A 4 242.502 255.492 236.883 1.00 0.00 C +ATOM 5 CA GLU A 5 238.820 256.320 236.362 1.00 0.00 C +ATOM 6 CA ALA A 6 235.369 254.763 235.937 1.00 0.00 C +ATOM 7 CA ALA A 7 233.444 251.521 236.485 1.00 0.00 C +ATOM 8 CA ALA A 8 230.722 249.956 234.326 1.00 0.00 C +ATOM 9 CA ALA A 9 229.284 246.707 235.700 1.00 0.00 C +ATOM 10 CA GLY A 10 228.560 243.326 234.099 1.00 0.00 C +ATOM 11 CA GLY A 11 231.011 241.638 231.721 1.00 0.00 C +ATOM 12 CA GLU A 12 234.344 242.202 229.962 1.00 0.00 C +ATOM 13 CA ALA A 13 237.452 241.605 232.084 1.00 0.00 C +ATOM 14 CA THR A 14 238.275 237.923 231.554 1.00 0.00 C +ATOM 15 CA THR A 15 240.763 236.862 234.238 1.00 0.00 C +ATOM 16 CA VAL A 16 240.193 234.049 236.744 1.00 0.00 C +ATOM 17 CA THR A 17 243.427 232.464 237.986 1.00 0.00 C +ATOM 18 CA CYS A 18 246.392 233.286 235.740 1.00 0.00 C +ATOM 19 CA GLY A 19 246.443 230.927 232.748 1.00 0.00 C +ATOM 20 CA SER A 20 249.440 231.791 230.560 1.00 0.00 C +ATOM 21 CA GLY A 21 252.337 232.925 232.761 1.00 0.00 C +ATOM 22 CA SER A 22 254.873 235.715 232.214 1.00 0.00 C +ATOM 23 CA ASN A 23 256.373 238.489 234.353 1.00 0.00 C +ATOM 24 CA GLU A 24 255.442 240.415 237.505 1.00 0.00 C +ATOM 25 CA ARG A 25 253.710 238.142 240.026 1.00 0.00 C +ATOM 26 CA ARG A 26 253.908 234.420 240.815 1.00 0.00 C +ATOM 27 CA ARG A 27 252.835 233.286 244.290 1.00 0.00 C +ATOM 28 CA GLU A 28 253.714 232.124 247.811 1.00 0.00 C +ATOM 29 CA GLU A 29 250.623 230.797 249.599 1.00 0.00 C +ATOM 30 CA ALA A 30 247.624 228.995 248.091 1.00 0.00 C +ATOM 31 CA THR A 31 244.943 228.786 245.392 1.00 0.00 C +ATOM 32 CA ALA A 32 244.646 225.140 244.327 1.00 0.00 C +ATOM 33 CA VAL A 33 241.836 223.279 246.105 1.00 0.00 C +ATOM 34 CA ALA A 34 241.007 220.711 248.794 1.00 0.00 C +ATOM 35 CA CYS A 35 241.818 222.186 252.212 1.00 0.00 C +ATOM 36 CA GLY A 36 242.254 223.213 255.855 1.00 0.00 C +ATOM 37 CA ALA A 37 244.954 222.338 258.397 1.00 0.00 C +ATOM 38 CA LEU A 38 247.019 220.054 260.641 1.00 0.00 C +ATOM 39 CA PRO A 39 248.183 217.573 263.288 1.00 0.00 C +ATOM 40 CA SER A 40 250.453 218.861 266.064 1.00 0.00 C +ATOM 41 CA ALA A 41 250.840 222.375 267.483 1.00 0.00 C +ATOM 42 CA ARG A 42 252.742 225.583 266.700 1.00 0.00 C +ATOM 43 CA PRO A 43 252.009 228.111 263.946 1.00 0.00 C +ATOM 44 CA GLY A 44 249.772 227.260 260.981 1.00 0.00 C +ATOM 45 CA GLU A 45 247.648 227.689 257.847 1.00 0.00 C +ATOM 46 CA TRP A 46 247.089 230.951 255.960 1.00 0.00 C +ATOM 47 CA GLY A 47 247.367 234.692 256.630 1.00 0.00 C +ATOM 48 CA GLY A 48 247.314 236.153 260.148 1.00 0.00 C +ATOM 49 CA ALA A 49 247.623 239.400 262.118 1.00 0.00 C +ATOM 50 CA SER A 50 250.063 241.664 263.971 1.00 0.00 C +ATOM 51 CA GLY A 51 250.344 245.319 262.932 1.00 0.00 C +ATOM 52 CA GLU A 52 250.038 248.234 260.498 1.00 0.00 C +ATOM 53 CA ARG A 53 250.610 249.258 256.872 1.00 0.00 C +ATOM 54 CA ARG A 54 253.171 250.779 254.497 1.00 0.00 C +ATOM 55 CA PRO A 55 256.868 251.631 254.845 1.00 0.00 C +ATOM 56 CA PRO A 56 258.621 254.791 253.635 1.00 0.00 C +ATOM 57 CA PRO A 57 262.393 255.114 253.209 1.00 0.00 C +ATOM 58 CA TYR A 58 263.068 258.557 251.724 1.00 0.00 C +ATOM 59 CA PRO A 59 266.635 259.737 251.091 1.00 0.00 C +ATOM 60 CA ILE A 60 267.692 261.555 254.268 1.00 0.00 C +ATOM 61 CA GLN A 61 270.176 264.200 255.429 1.00 0.00 C +ATOM 62 CA ARG A 62 269.571 267.937 255.856 1.00 0.00 C +ATOM 63 CA GLU A 63 266.773 268.485 258.383 1.00 0.00 C +ATOM 64 CA GLU A 64 264.837 271.759 258.155 1.00 0.00 C +ATOM 65 CA ARG A 65 263.037 273.309 255.177 1.00 0.00 C +ATOM 66 CA ARG A 66 263.731 273.710 251.452 1.00 0.00 C +ATOM 67 CA GLN A 67 261.327 271.962 249.067 1.00 0.00 C +ATOM 68 CA GLU A 68 259.802 274.045 246.266 1.00 0.00 C +ATOM 69 CA ARG A 69 259.934 276.007 243.003 1.00 0.00 C +ATOM 70 CA ARG A 70 258.941 277.713 239.744 1.00 0.00 C +ATOM 71 CA THR A 71 256.573 280.685 239.464 1.00 0.00 C +ATOM 72 CA ALA A 72 254.688 281.594 242.648 1.00 0.00 C +ATOM 73 CA PRO A 73 252.820 278.513 243.885 1.00 0.00 C +ATOM 74 CA SER A 74 254.217 276.466 246.779 1.00 0.00 C +ATOM 75 CA PRO A 75 254.572 275.626 250.478 1.00 0.00 C +ATOM 76 CA PRO A 76 252.657 272.538 251.623 1.00 0.00 C +ATOM 77 CA PRO A 77 253.855 270.987 254.891 1.00 0.00 C +ATOM 78 CA ASP A 78 252.776 272.998 257.941 1.00 0.00 C +ATOM 79 CA LEU A 79 254.823 271.940 260.975 1.00 0.00 C +ATOM 80 CA MET A 80 256.784 273.577 263.802 1.00 0.00 C +ATOM 81 CA GLY A 81 256.396 277.338 264.266 1.00 0.00 C +ATOM 82 CA GLY A 82 253.142 279.090 265.196 1.00 0.00 C +ATOM 83 CA GLU A 83 252.209 279.803 268.820 1.00 0.00 C +ATOM 84 CA ALA A 84 249.636 277.887 270.876 1.00 0.00 C +ATOM 85 CA ALA A 85 246.951 276.713 268.441 1.00 0.00 C +ATOM 86 CA GLY A 86 244.753 273.789 269.506 1.00 0.00 C +ATOM 87 CA GLY A 87 242.712 270.599 269.093 1.00 0.00 C +ATOM 88 CA ALA A 88 240.158 268.084 267.803 1.00 0.00 C +ATOM 89 CA PHE A 89 238.878 264.498 267.940 1.00 0.00 C +TER 90 PHE A 89 +END diff --git a/Plants/Q84Z73/Q84Z73.dcd b/Plants/Q84Z73/Q84Z73.dcd new file mode 100644 index 0000000000000000000000000000000000000000..2b75dd35bfc8a82ec2e5da39bc489b103cfd84bf --- /dev/null +++ b/Plants/Q84Z73/Q84Z73.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:48a852351ab0fbc9429e3bf6ad0b346069703c24c2bf75c871549a084635ad0e +size 9080276 diff --git a/Plants/Q84Z73/top.pdb b/Plants/Q84Z73/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..7aaca00624147153252c38ff351b6033dfdd6df3 --- /dev/null +++ b/Plants/Q84Z73/top.pdb @@ -0,0 +1,73 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 266.591 260.850 274.853 1.00 0.00 C +ATOM 2 CA ALA A 2 269.643 258.574 274.974 1.00 0.00 C +ATOM 3 CA VAL A 3 272.727 260.433 276.219 1.00 0.00 C +ATOM 4 CA ARG A 4 276.262 260.229 274.812 1.00 0.00 C +ATOM 5 CA ILE A 5 278.704 258.500 272.453 1.00 0.00 C +ATOM 6 CA SER A 6 277.784 254.891 271.647 1.00 0.00 C +ATOM 7 CA ARG A 7 274.210 253.786 272.367 1.00 0.00 C +ATOM 8 CA LYS A 8 270.518 252.845 272.335 1.00 0.00 C +ATOM 9 CA ARG A 9 268.912 255.198 269.805 1.00 0.00 C +ATOM 10 CA ARG A 10 267.843 258.187 267.699 1.00 0.00 C +ATOM 11 CA SER A 11 264.931 260.639 267.545 1.00 0.00 C +ATOM 12 CA PRO A 12 262.366 262.230 269.871 1.00 0.00 C +ATOM 13 CA PRO A 13 259.214 260.250 270.684 1.00 0.00 C +ATOM 14 CA THR A 14 256.337 261.506 268.524 1.00 0.00 C +ATOM 15 CA ARG A 15 254.244 263.975 266.515 1.00 0.00 C +ATOM 16 CA GLY A 16 254.789 264.668 262.808 1.00 0.00 C +ATOM 17 CA LEU A 17 253.667 262.867 259.643 1.00 0.00 C +ATOM 18 CA GLY A 18 252.738 265.531 257.082 1.00 0.00 C +ATOM 19 CA THR A 19 254.099 264.364 253.720 1.00 0.00 C +ATOM 20 CA SER A 20 254.865 261.467 251.367 1.00 0.00 C +ATOM 21 CA THR A 21 255.300 257.781 252.230 1.00 0.00 C +ATOM 22 CA THR A 22 253.230 257.265 255.386 1.00 0.00 C +ATOM 23 CA ALA A 23 249.530 257.715 254.594 1.00 0.00 C +ATOM 24 CA CYS A 24 247.552 259.848 257.054 1.00 0.00 C +ATOM 25 CA TRP A 25 248.432 259.268 260.715 1.00 0.00 C +ATOM 26 CA SER A 26 245.280 258.057 262.480 1.00 0.00 C +ATOM 27 CA ALA A 27 241.956 259.072 260.921 1.00 0.00 C +ATOM 28 CA SER A 28 238.692 260.730 259.865 1.00 0.00 C +ATOM 29 CA TRP A 29 236.311 260.615 256.893 1.00 0.00 C +ATOM 30 CA HIS A 30 235.691 257.761 254.446 1.00 0.00 C +ATOM 31 CA ALA A 31 238.206 257.494 251.596 1.00 0.00 C +ATOM 32 CA SER A 32 239.099 257.125 247.910 1.00 0.00 C +ATOM 33 CA ARG A 33 242.152 257.172 245.632 1.00 0.00 C +ATOM 34 CA ARG A 34 245.309 258.043 247.580 1.00 0.00 C +ATOM 35 CA THR A 35 248.302 255.695 247.365 1.00 0.00 C +ATOM 36 CA HIS A 36 249.896 252.431 248.514 1.00 0.00 C +ATOM 37 CA SER A 37 252.957 250.743 250.030 1.00 0.00 C +ATOM 38 CA SER A 38 255.999 248.594 250.832 1.00 0.00 C +ATOM 39 CA ALA A 39 257.769 248.072 254.166 1.00 0.00 C +ATOM 40 CA SER A 40 256.660 248.923 257.710 1.00 0.00 C +ATOM 41 CA ALA A 41 253.931 248.103 260.240 1.00 0.00 C +ATOM 42 CA PRO A 42 250.455 249.295 259.235 1.00 0.00 C +ATOM 43 CA SER A 43 247.802 252.029 259.167 1.00 0.00 C +ATOM 44 CA ALA A 44 244.608 252.354 257.115 1.00 0.00 C +ATOM 45 CA ALA A 45 243.997 253.011 253.412 1.00 0.00 C +ATOM 46 CA ASP A 46 245.213 249.839 251.686 1.00 0.00 C +ATOM 47 CA GLY A 47 243.337 246.621 250.886 1.00 0.00 C +ATOM 48 CA ALA A 48 244.343 244.775 247.708 1.00 0.00 C +ATOM 49 CA ARG A 49 242.822 241.329 247.134 1.00 0.00 C +ATOM 50 CA PRO A 50 245.200 238.741 248.605 1.00 0.00 C +ATOM 51 CA PRO A 51 247.805 236.911 246.513 1.00 0.00 C +ATOM 52 CA ARG A 52 247.771 233.245 245.475 1.00 0.00 C +ATOM 53 CA HIS A 53 247.869 232.874 241.684 1.00 0.00 C +ATOM 54 CA HIS A 54 249.932 233.397 238.524 1.00 0.00 C +ATOM 55 CA THR A 55 249.126 233.389 234.800 1.00 0.00 C +ATOM 56 CA CYS A 56 246.557 235.566 233.019 1.00 0.00 C +ATOM 57 CA ASP A 57 244.973 236.175 229.608 1.00 0.00 C +ATOM 58 CA ARG A 58 244.596 234.136 226.412 1.00 0.00 C +ATOM 59 CA ILE A 59 242.010 234.899 223.719 1.00 0.00 C +ATOM 60 CA PRO A 60 242.552 237.205 220.735 1.00 0.00 C +ATOM 61 CA SER A 61 240.545 240.033 219.156 1.00 0.00 C +ATOM 62 CA LEU A 62 237.370 238.671 217.550 1.00 0.00 C +ATOM 63 CA THR A 63 236.472 240.449 214.302 1.00 0.00 C +ATOM 64 CA PRO A 64 233.301 238.758 213.039 1.00 0.00 C +ATOM 65 CA THR A 65 231.990 235.944 215.248 1.00 0.00 C +ATOM 66 CA ALA A 66 230.230 232.594 215.690 1.00 0.00 C +ATOM 67 CA SER A 67 229.555 228.845 215.775 1.00 0.00 C +ATOM 68 CA PRO A 68 228.673 225.187 215.179 1.00 0.00 C +ATOM 69 CA GLN A 69 228.200 222.235 217.541 1.00 0.00 C +TER 70 GLN A 69 +END diff --git a/Plants/Q84ZA9/Q84ZA9.dcd b/Plants/Q84ZA9/Q84ZA9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..8821b299bbbdf01d279cc11080cb50a69e97ed8b --- /dev/null +++ b/Plants/Q84ZA9/Q84ZA9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:37c51c72e6b90339a71aa4708bfcfec5cea9b83e21ea90c208fc8001063dc343 +size 10280276 diff --git a/Plants/Q84ZA9/top.pdb b/Plants/Q84ZA9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..3b47db58753342ea78eaecb1c275cb181967fb76 --- /dev/null +++ b/Plants/Q84ZA9/top.pdb @@ -0,0 +1,83 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 243.663 299.213 257.112 1.00 0.00 C +ATOM 2 CA GLY A 2 246.441 296.869 258.254 1.00 0.00 C +ATOM 3 CA GLY A 3 249.321 294.514 259.076 1.00 0.00 C +ATOM 4 CA GLU A 4 252.972 295.582 259.297 1.00 0.00 C +ATOM 5 CA GLU A 5 256.409 295.564 257.653 1.00 0.00 C +ATOM 6 CA ALA A 6 259.823 295.665 259.341 1.00 0.00 C +ATOM 7 CA CYS A 7 262.206 293.682 257.127 1.00 0.00 C +ATOM 8 CA ARG A 8 265.210 292.443 259.116 1.00 0.00 C +ATOM 9 CA VAL A 9 268.247 293.099 256.910 1.00 0.00 C +ATOM 10 CA ARG A 10 270.559 290.101 256.486 1.00 0.00 C +ATOM 11 CA GLN A 11 274.276 289.652 257.195 1.00 0.00 C +ATOM 12 CA GLU A 12 274.586 290.212 260.950 1.00 0.00 C +ATOM 13 CA ARG A 13 274.945 293.771 262.262 1.00 0.00 C +ATOM 14 CA ARG A 14 272.453 296.572 262.941 1.00 0.00 C +ATOM 15 CA VAL A 15 269.331 294.775 264.183 1.00 0.00 C +ATOM 16 CA ARG A 16 268.551 291.439 265.849 1.00 0.00 C +ATOM 17 CA GLY A 17 271.601 289.174 266.147 1.00 0.00 C +ATOM 18 CA GLU A 18 270.200 285.632 266.224 1.00 0.00 C +ATOM 19 CA ALA A 19 271.057 282.276 264.636 1.00 0.00 C +ATOM 20 CA GLY A 20 268.497 280.224 262.700 1.00 0.00 C +ATOM 21 CA LEU A 21 269.477 276.768 261.431 1.00 0.00 C +ATOM 22 CA PRO A 22 271.754 273.845 262.321 1.00 0.00 C +ATOM 23 CA PRO A 23 273.828 271.718 259.936 1.00 0.00 C +ATOM 24 CA LEU A 24 275.482 272.671 256.638 1.00 0.00 C +ATOM 25 CA GLY A 25 274.107 270.699 253.683 1.00 0.00 C +ATOM 26 CA LYS A 26 272.486 272.946 251.068 1.00 0.00 C +ATOM 27 CA GLU A 27 268.868 273.596 252.070 1.00 0.00 C +ATOM 28 CA PRO A 28 265.484 275.025 253.081 1.00 0.00 C +ATOM 29 CA PRO A 29 263.417 273.266 255.755 1.00 0.00 C +ATOM 30 CA PRO A 30 260.006 271.933 254.704 1.00 0.00 C +ATOM 31 CA HIS A 31 256.962 270.069 256.037 1.00 0.00 C +ATOM 32 CA GLN A 32 256.809 267.275 258.623 1.00 0.00 C +ATOM 33 CA LYS A 33 255.946 264.048 256.791 1.00 0.00 C +ATOM 34 CA GLY A 34 252.257 263.118 256.579 1.00 0.00 C +ATOM 35 CA GLY A 35 250.978 263.108 260.168 1.00 0.00 C +ATOM 36 CA HIS A 36 248.748 260.124 260.968 1.00 0.00 C +ATOM 37 CA SER A 37 247.632 257.011 262.860 1.00 0.00 C +ATOM 38 CA LYS A 38 246.669 253.331 262.636 1.00 0.00 C +ATOM 39 CA ARG A 39 243.967 251.323 260.851 1.00 0.00 C +ATOM 40 CA LEU A 40 240.766 249.660 259.625 1.00 0.00 C +ATOM 41 CA ARG A 41 240.592 247.098 256.811 1.00 0.00 C +ATOM 42 CA ILE A 42 240.366 247.642 253.047 1.00 0.00 C +ATOM 43 CA GLY A 43 239.512 247.882 249.342 1.00 0.00 C +ATOM 44 CA SER A 44 236.319 249.836 248.630 1.00 0.00 C +ATOM 45 CA ASP A 45 236.655 251.332 245.143 1.00 0.00 C +ATOM 46 CA GLY A 46 236.643 251.307 241.333 1.00 0.00 C +ATOM 47 CA ALA A 47 235.116 248.082 239.997 1.00 0.00 C +ATOM 48 CA ASP A 48 235.947 247.298 236.362 1.00 0.00 C +ATOM 49 CA ASP A 49 237.948 244.075 236.008 1.00 0.00 C +ATOM 50 CA SER A 50 239.901 242.655 233.061 1.00 0.00 C +ATOM 51 CA ALA A 51 240.654 239.014 232.230 1.00 0.00 C +ATOM 52 CA PRO A 52 242.096 235.538 231.636 1.00 0.00 C +ATOM 53 CA LEU A 53 243.475 231.987 231.721 1.00 0.00 C +ATOM 54 CA GLY A 54 244.705 229.013 233.761 1.00 0.00 C +ATOM 55 CA LEU A 55 246.578 226.008 232.355 1.00 0.00 C +ATOM 56 CA VAL A 56 246.528 223.175 234.902 1.00 0.00 C +ATOM 57 CA VAL A 57 248.115 220.119 236.533 1.00 0.00 C +ATOM 58 CA ILE A 58 245.333 217.515 236.534 1.00 0.00 C +ATOM 59 CA GLY A 59 242.840 218.792 239.117 1.00 0.00 C +ATOM 60 CA GLY A 60 240.191 219.810 241.659 1.00 0.00 C +ATOM 61 CA SER A 61 239.116 218.018 244.845 1.00 0.00 C +ATOM 62 CA ARG A 62 238.819 216.570 248.356 1.00 0.00 C +ATOM 63 CA ARG A 63 236.624 218.179 251.021 1.00 0.00 C +ATOM 64 CA MET A 64 234.104 215.499 252.014 1.00 0.00 C +ATOM 65 CA GLN A 65 232.638 212.038 251.391 1.00 0.00 C +ATOM 66 CA SER A 66 231.840 208.486 250.266 1.00 0.00 C +ATOM 67 CA ARG A 67 231.493 204.997 248.776 1.00 0.00 C +ATOM 68 CA GLU A 68 234.566 203.134 247.513 1.00 0.00 C +ATOM 69 CA ALA A 69 235.374 199.709 246.051 1.00 0.00 C +ATOM 70 CA GLY A 70 236.568 196.160 246.755 1.00 0.00 C +ATOM 71 CA GLY A 71 236.390 193.631 243.912 1.00 0.00 C +ATOM 72 CA ALA A 72 235.143 194.516 240.422 1.00 0.00 C +ATOM 73 CA THR A 73 236.451 195.823 237.091 1.00 0.00 C +ATOM 74 CA GLY A 74 235.183 197.269 233.802 1.00 0.00 C +ATOM 75 CA ASP A 75 231.389 196.988 233.604 1.00 0.00 C +ATOM 76 CA ARG A 76 229.738 193.658 232.764 1.00 0.00 C +ATOM 77 CA TRP A 77 231.634 191.542 230.225 1.00 0.00 C +ATOM 78 CA GLN A 78 230.397 191.351 226.627 1.00 0.00 C +ATOM 79 CA GLY A 79 227.027 192.260 225.102 1.00 0.00 C +TER 80 GLY A 79 +END diff --git a/Plants/Q84ZE9/Q84ZE9.dcd b/Plants/Q84ZE9/Q84ZE9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..36afd0eebc6d2017cfd906a8d68e6fbacdb08f34 --- /dev/null +++ b/Plants/Q84ZE9/Q84ZE9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:408abcc16e186803706aeaf915fca94048361ac841e7abf0b2f96805e6f00aff +size 8600276 diff --git a/Plants/Q84ZE9/top.pdb b/Plants/Q84ZE9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..365043fe94c91fabc128c523d947dcc5f9847d83 --- /dev/null +++ b/Plants/Q84ZE9/top.pdb @@ -0,0 +1,69 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 225.378 220.434 247.271 1.00 0.00 C +ATOM 2 CA GLY A 2 228.104 218.141 245.919 1.00 0.00 C +ATOM 3 CA ARG A 3 229.599 219.306 242.614 1.00 0.00 C +ATOM 4 CA SER A 4 231.331 222.691 242.374 1.00 0.00 C +ATOM 5 CA ILE A 5 230.399 224.912 239.423 1.00 0.00 C +ATOM 6 CA HIS A 6 226.707 225.010 238.483 1.00 0.00 C +ATOM 7 CA GLU A 7 224.401 228.039 238.325 1.00 0.00 C +ATOM 8 CA GLU A 8 223.263 230.313 235.487 1.00 0.00 C +ATOM 9 CA ALA A 9 223.876 228.382 232.260 1.00 0.00 C +ATOM 10 CA ARG A 10 223.871 228.624 228.458 1.00 0.00 C +ATOM 11 CA ARG A 11 225.628 230.757 225.835 1.00 0.00 C +ATOM 12 CA LEU A 12 228.694 233.007 226.072 1.00 0.00 C +ATOM 13 CA GLY A 13 230.984 235.991 226.675 1.00 0.00 C +ATOM 14 CA HIS A 14 232.207 236.766 230.199 1.00 0.00 C +ATOM 15 CA ARG A 15 230.350 239.212 232.453 1.00 0.00 C +ATOM 16 CA GLY A 16 226.879 238.198 233.654 1.00 0.00 C +ATOM 17 CA LEU A 17 225.879 239.946 236.889 1.00 0.00 C +ATOM 18 CA LEU A 18 223.512 242.389 238.605 1.00 0.00 C +ATOM 19 CA SER A 19 222.326 243.401 242.081 1.00 0.00 C +ATOM 20 CA GLY A 20 225.158 244.569 244.346 1.00 0.00 C +ATOM 21 CA GLY A 21 228.005 247.093 244.553 1.00 0.00 C +ATOM 22 CA GLY A 22 230.821 247.234 247.115 1.00 0.00 C +ATOM 23 CA ALA A 23 231.380 244.533 249.744 1.00 0.00 C +ATOM 24 CA GLN A 24 233.150 244.226 253.103 1.00 0.00 C +ATOM 25 CA ILE A 25 236.863 244.804 252.476 1.00 0.00 C +ATOM 26 CA HIS A 26 239.791 247.211 252.868 1.00 0.00 C +ATOM 27 CA VAL A 27 242.285 248.561 255.413 1.00 0.00 C +ATOM 28 CA SER A 28 241.603 249.483 259.046 1.00 0.00 C +ATOM 29 CA SER A 29 242.164 253.204 259.638 1.00 0.00 C +ATOM 30 CA PHE A 30 243.858 256.131 261.393 1.00 0.00 C +ATOM 31 CA GLU A 31 245.708 259.449 261.104 1.00 0.00 C +ATOM 32 CA ALA A 32 247.723 262.683 261.140 1.00 0.00 C +ATOM 33 CA GLY A 33 251.525 262.558 261.351 1.00 0.00 C +ATOM 34 CA GLU A 34 254.362 263.748 259.103 1.00 0.00 C +ATOM 35 CA GLU A 35 254.908 267.274 257.767 1.00 0.00 C +ATOM 36 CA THR A 36 256.679 270.525 258.668 1.00 0.00 C +ATOM 37 CA SER A 37 260.388 270.140 257.884 1.00 0.00 C +ATOM 38 CA GLU A 38 262.909 269.631 255.073 1.00 0.00 C +ATOM 39 CA GLU A 39 265.027 267.478 252.750 1.00 0.00 C +ATOM 40 CA GLY A 40 266.827 269.772 250.299 1.00 0.00 C +ATOM 41 CA ASP A 41 269.675 272.284 249.992 1.00 0.00 C +ATOM 42 CA GLY A 42 269.468 275.317 252.289 1.00 0.00 C +ATOM 43 CA ASP A 43 268.687 277.317 255.436 1.00 0.00 C +ATOM 44 CA GLY A 44 269.746 276.846 259.065 1.00 0.00 C +ATOM 45 CA GLY A 45 271.703 273.579 259.176 1.00 0.00 C +ATOM 46 CA ASP A 46 273.469 270.203 259.222 1.00 0.00 C +ATOM 47 CA GLU A 47 274.149 266.699 257.890 1.00 0.00 C +ATOM 48 CA ALA A 48 271.740 264.626 255.789 1.00 0.00 C +ATOM 49 CA GLN A 49 269.647 261.442 255.797 1.00 0.00 C +ATOM 50 CA GLY A 50 266.901 262.020 258.374 1.00 0.00 C +ATOM 51 CA VAL A 51 268.722 263.226 261.496 1.00 0.00 C +ATOM 52 CA GLU A 52 271.820 262.719 263.655 1.00 0.00 C +ATOM 53 CA ALA A 53 273.381 259.575 265.136 1.00 0.00 C +ATOM 54 CA VAL A 54 271.434 256.322 264.763 1.00 0.00 C +ATOM 55 CA PRO A 55 270.934 253.893 261.871 1.00 0.00 C +ATOM 56 CA LYS A 56 269.091 253.101 258.632 1.00 0.00 C +ATOM 57 CA LEU A 57 271.213 252.716 255.491 1.00 0.00 C +ATOM 58 CA ALA A 58 273.878 251.992 252.866 1.00 0.00 C +ATOM 59 CA GLU A 59 275.401 248.770 251.518 1.00 0.00 C +ATOM 60 CA ALA A 60 276.038 245.700 253.681 1.00 0.00 C +ATOM 61 CA GLY A 61 274.386 242.327 254.325 1.00 0.00 C +ATOM 62 CA ARG A 62 270.618 242.841 254.108 1.00 0.00 C +ATOM 63 CA ARG A 63 267.514 243.782 252.108 1.00 0.00 C +ATOM 64 CA ARG A 64 267.354 247.492 251.256 1.00 0.00 C +ATOM 65 CA ARG A 65 268.507 249.381 248.154 1.00 0.00 C +TER 66 ARG A 65 +END diff --git a/Plants/Q84ZG4/Q84ZG4.dcd b/Plants/Q84ZG4/Q84ZG4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..2f175f7f429ef8310726f2a7a1e1b0d16d3cb463 --- /dev/null +++ b/Plants/Q84ZG4/Q84ZG4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:3b2b83a0ba5a3d15d677506b8c2e93cca585bf0225c44e3fa58e9e741ecf6309 +size 18920276 diff --git a/Plants/Q84ZG4/top.pdb b/Plants/Q84ZG4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..18e89f01bf9aced3f1d19972e4f0bf385ba1b706 --- /dev/null +++ b/Plants/Q84ZG4/top.pdb @@ -0,0 +1,155 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 230.558 223.857 244.750 1.00 0.00 C +ATOM 2 CA ALA A 2 233.666 223.045 246.800 1.00 0.00 C +ATOM 3 CA ARG A 3 236.411 223.455 249.410 1.00 0.00 C +ATOM 4 CA ALA A 4 239.768 223.760 251.186 1.00 0.00 C +ATOM 5 CA ALA A 5 241.405 227.135 250.519 1.00 0.00 C +ATOM 6 CA ALA A 6 240.323 230.758 250.053 1.00 0.00 C +ATOM 7 CA VAL A 7 236.879 232.341 249.665 1.00 0.00 C +ATOM 8 CA HIS A 8 233.528 232.009 251.447 1.00 0.00 C +ATOM 9 CA ALA A 9 233.422 233.627 254.895 1.00 0.00 C +ATOM 10 CA THR A 10 235.964 234.204 257.673 1.00 0.00 C +ATOM 11 CA THR A 11 237.480 231.835 260.243 1.00 0.00 C +ATOM 12 CA GLY A 12 240.850 230.351 259.263 1.00 0.00 C +ATOM 13 CA ASP A 13 240.879 226.589 258.659 1.00 0.00 C +ATOM 14 CA GLY A 14 243.540 225.313 256.249 1.00 0.00 C +ATOM 15 CA LYS A 15 247.096 224.952 254.932 1.00 0.00 C +ATOM 16 CA ARG A 16 249.536 222.387 256.341 1.00 0.00 C +ATOM 17 CA ARG A 17 251.520 219.388 257.599 1.00 0.00 C +ATOM 18 CA ARG A 18 252.019 216.205 255.564 1.00 0.00 C +ATOM 19 CA GLY A 19 255.005 214.098 256.642 1.00 0.00 C +ATOM 20 CA ARG A 20 255.627 210.348 256.896 1.00 0.00 C +ATOM 21 CA ARG A 21 252.355 208.968 258.280 1.00 0.00 C +ATOM 22 CA GLN A 22 249.331 207.771 260.264 1.00 0.00 C +ATOM 23 CA ARG A 23 247.584 206.162 263.243 1.00 0.00 C +ATOM 24 CA MET A 24 247.440 206.630 267.021 1.00 0.00 C +ATOM 25 CA ALA A 25 249.446 209.283 268.881 1.00 0.00 C +ATOM 26 CA PRO A 26 252.413 211.670 268.767 1.00 0.00 C +ATOM 27 CA ARG A 27 254.843 213.778 270.808 1.00 0.00 C +ATOM 28 CA ARG A 28 258.236 214.488 269.226 1.00 0.00 C +ATOM 29 CA ARG A 29 260.731 217.352 268.926 1.00 0.00 C +ATOM 30 CA ARG A 30 260.490 219.351 272.160 1.00 0.00 C +ATOM 31 CA ARG A 31 259.093 221.927 274.596 1.00 0.00 C +ATOM 32 CA PRO A 32 257.900 225.334 275.814 1.00 0.00 C +ATOM 33 CA LYS A 33 255.209 228.004 276.197 1.00 0.00 C +ATOM 34 CA ALA A 34 251.855 229.724 275.644 1.00 0.00 C +ATOM 35 CA THR A 35 248.251 228.493 275.752 1.00 0.00 C +ATOM 36 CA ALA A 36 246.261 225.991 277.826 1.00 0.00 C +ATOM 37 CA SER A 37 243.482 223.626 278.919 1.00 0.00 C +ATOM 38 CA ALA A 38 244.598 222.020 282.188 1.00 0.00 C +ATOM 39 CA GLY A 39 244.112 222.415 285.947 1.00 0.00 C +ATOM 40 CA GLY A 40 242.696 220.480 288.907 1.00 0.00 C +ATOM 41 CA GLY A 41 241.840 216.869 288.045 1.00 0.00 C +ATOM 42 CA GLY A 42 244.607 215.286 285.959 1.00 0.00 C +ATOM 43 CA ALA A 43 243.943 213.760 282.532 1.00 0.00 C +ATOM 44 CA ARG A 44 245.626 213.397 279.132 1.00 0.00 C +ATOM 45 CA GLY A 45 244.496 215.630 276.259 1.00 0.00 C +ATOM 46 CA ASN A 46 244.509 219.013 274.507 1.00 0.00 C +ATOM 47 CA GLY A 47 247.479 220.119 272.392 1.00 0.00 C +ATOM 48 CA GLU A 48 251.240 219.878 271.834 1.00 0.00 C +ATOM 49 CA GLY A 49 252.772 220.028 268.349 1.00 0.00 C +ATOM 50 CA LYS A 50 252.900 222.843 265.785 1.00 0.00 C +ATOM 51 CA GLU A 51 251.048 225.854 267.207 1.00 0.00 C +ATOM 52 CA ARG A 52 247.786 227.186 265.758 1.00 0.00 C +ATOM 53 CA GLY A 53 245.732 228.069 262.673 1.00 0.00 C +ATOM 54 CA GLY A 54 246.954 230.978 260.538 1.00 0.00 C +ATOM 55 CA VAL A 55 249.227 233.745 261.842 1.00 0.00 C +ATOM 56 CA LEU A 56 247.973 236.936 260.179 1.00 0.00 C +ATOM 57 CA THR A 57 247.782 240.193 258.212 1.00 0.00 C +ATOM 58 CA GLY A 58 245.768 243.203 259.394 1.00 0.00 C +ATOM 59 CA GLY A 59 247.341 246.305 257.839 1.00 0.00 C +ATOM 60 CA GLY A 60 246.545 250.002 257.370 1.00 0.00 C +ATOM 61 CA GLY A 61 247.657 252.283 260.212 1.00 0.00 C +ATOM 62 CA ASP A 62 249.298 255.689 259.746 1.00 0.00 C +ATOM 63 CA ASP A 63 248.703 259.388 259.054 1.00 0.00 C +ATOM 64 CA ARG A 64 247.216 261.751 256.462 1.00 0.00 C +ATOM 65 CA ARG A 65 245.707 263.051 253.213 1.00 0.00 C +ATOM 66 CA ARG A 66 243.666 260.389 251.407 1.00 0.00 C +ATOM 67 CA GLY A 67 245.734 257.364 250.364 1.00 0.00 C +ATOM 68 CA ALA A 68 246.340 254.501 247.924 1.00 0.00 C +ATOM 69 CA THR A 69 247.293 251.557 245.700 1.00 0.00 C +ATOM 70 CA GLU A 70 244.190 249.380 245.315 1.00 0.00 C +ATOM 71 CA GLY A 71 241.054 247.726 246.710 1.00 0.00 C +ATOM 72 CA GLY A 72 237.407 248.112 245.676 1.00 0.00 C +ATOM 73 CA ARG A 73 237.433 249.835 242.278 1.00 0.00 C +ATOM 74 CA GLN A 74 238.900 248.674 238.959 1.00 0.00 C +ATOM 75 CA ALA A 75 239.627 249.856 235.410 1.00 0.00 C +ATOM 76 CA ALA A 76 237.161 252.347 233.916 1.00 0.00 C +ATOM 77 CA ASP A 77 238.093 255.155 231.515 1.00 0.00 C +ATOM 78 CA GLY A 78 238.663 257.591 228.642 1.00 0.00 C +ATOM 79 CA VAL A 79 239.955 261.174 228.756 1.00 0.00 C +ATOM 80 CA ARG A 80 238.411 264.648 228.503 1.00 0.00 C +ATOM 81 CA ASP A 81 236.743 268.073 228.527 1.00 0.00 C +ATOM 82 CA ASP A 82 234.080 269.716 230.702 1.00 0.00 C +ATOM 83 CA LEU A 83 230.941 271.428 229.388 1.00 0.00 C +ATOM 84 CA LYS A 84 227.314 272.587 229.241 1.00 0.00 C +ATOM 85 CA ASN A 85 225.350 271.086 232.140 1.00 0.00 C +ATOM 86 CA GLU A 86 226.460 270.311 235.701 1.00 0.00 C +ATOM 87 CA LYS A 87 228.612 270.611 238.831 1.00 0.00 C +ATOM 88 CA GLU A 88 230.639 269.888 241.975 1.00 0.00 C +ATOM 89 CA LYS A 89 230.527 272.402 244.836 1.00 0.00 C +ATOM 90 CA ILE A 90 230.715 271.428 248.514 1.00 0.00 C +ATOM 91 CA ARG A 91 231.143 268.409 250.799 1.00 0.00 C +ATOM 92 CA GLU A 92 230.703 267.857 254.543 1.00 0.00 C +ATOM 93 CA GLY A 93 231.348 269.874 257.711 1.00 0.00 C +ATOM 94 CA GLU A 94 234.005 272.532 257.087 1.00 0.00 C +ATOM 95 CA ARG A 95 235.551 273.687 253.801 1.00 0.00 C +ATOM 96 CA GLY A 96 238.837 275.468 254.542 1.00 0.00 C +ATOM 97 CA HIS A 97 241.822 276.959 256.381 1.00 0.00 C +ATOM 98 CA ARG A 98 244.952 278.285 254.661 1.00 0.00 C +ATOM 99 CA ARG A 99 246.780 279.775 251.668 1.00 0.00 C +ATOM 100 CA ARG A 100 249.081 278.684 248.834 1.00 0.00 C +ATOM 101 CA GLU A 101 247.948 276.226 246.152 1.00 0.00 C +ATOM 102 CA ARG A 102 247.597 276.483 242.367 1.00 0.00 C +ATOM 103 CA TRP A 103 250.952 277.206 240.711 1.00 0.00 C +ATOM 104 CA PRO A 104 254.023 277.541 238.482 1.00 0.00 C +ATOM 105 CA LYS A 105 255.442 274.013 238.252 1.00 0.00 C +ATOM 106 CA ALA A 106 258.488 273.849 240.534 1.00 0.00 C +ATOM 107 CA ALA A 107 261.507 276.049 239.785 1.00 0.00 C +ATOM 108 CA ASP A 108 263.769 276.466 236.748 1.00 0.00 C +ATOM 109 CA MET A 109 261.936 275.600 233.522 1.00 0.00 C +ATOM 110 CA ALA A 110 260.891 272.470 231.617 1.00 0.00 C +ATOM 111 CA ALA A 111 258.405 270.074 233.228 1.00 0.00 C +ATOM 112 CA LEU A 112 259.317 267.027 235.325 1.00 0.00 C +ATOM 113 CA THR A 113 260.539 264.318 232.941 1.00 0.00 C +ATOM 114 CA VAL A 114 261.371 261.646 230.356 1.00 0.00 C +ATOM 115 CA ALA A 115 261.590 257.843 230.464 1.00 0.00 C +ATOM 116 CA ARG A 116 263.082 254.359 230.849 1.00 0.00 C +ATOM 117 CA ARG A 117 263.314 250.927 229.211 1.00 0.00 C +ATOM 118 CA GLU A 118 263.499 249.520 225.675 1.00 0.00 C +ATOM 119 CA TRP A 119 266.641 247.426 225.164 1.00 0.00 C +ATOM 120 CA ARG A 120 267.279 246.894 221.446 1.00 0.00 C +ATOM 121 CA SER A 121 268.437 249.943 219.476 1.00 0.00 C +ATOM 122 CA GLY A 122 271.675 251.830 218.792 1.00 0.00 C +ATOM 123 CA GLY A 123 272.706 255.451 218.210 1.00 0.00 C +ATOM 124 CA GLU A 124 273.709 259.110 217.854 1.00 0.00 C +ATOM 125 CA PRO A 125 275.760 262.295 218.254 1.00 0.00 C +ATOM 126 CA GLN A 126 273.820 264.930 216.302 1.00 0.00 C +ATOM 127 CA ARG A 127 271.199 266.605 218.503 1.00 0.00 C +ATOM 128 CA ARG A 128 270.310 265.736 222.104 1.00 0.00 C +ATOM 129 CA ARG A 129 271.887 262.636 223.659 1.00 0.00 C +ATOM 130 CA GLY A 130 271.632 262.059 227.417 1.00 0.00 C +ATOM 131 CA GLY A 131 271.390 264.669 230.181 1.00 0.00 C +ATOM 132 CA ARG A 132 269.474 267.179 232.314 1.00 0.00 C +ATOM 133 CA GLY A 133 266.047 267.023 233.972 1.00 0.00 C +ATOM 134 CA GLY A 134 265.706 268.061 237.622 1.00 0.00 C +ATOM 135 CA SER A 135 266.032 267.560 241.384 1.00 0.00 C +ATOM 136 CA ARG A 136 267.251 270.201 243.845 1.00 0.00 C +ATOM 137 CA PRO A 137 265.595 272.808 246.077 1.00 0.00 C +ATOM 138 CA ARG A 138 267.763 275.806 246.984 1.00 0.00 C +ATOM 139 CA GLU A 139 265.613 278.696 248.226 1.00 0.00 C +ATOM 140 CA PRO A 140 263.372 281.586 249.295 1.00 0.00 C +ATOM 141 CA ASP A 141 264.412 283.762 252.245 1.00 0.00 C +ATOM 142 CA GLY A 142 265.168 287.487 251.982 1.00 0.00 C +ATOM 143 CA GLY A 143 262.333 289.635 253.347 1.00 0.00 C +ATOM 144 CA ASP A 144 258.814 290.869 252.567 1.00 0.00 C +ATOM 145 CA GLY A 145 255.267 292.251 252.734 1.00 0.00 C +ATOM 146 CA ALA A 146 252.494 289.651 252.987 1.00 0.00 C +ATOM 147 CA VAL A 147 250.614 286.481 252.023 1.00 0.00 C +ATOM 148 CA ARG A 148 250.718 284.553 248.738 1.00 0.00 C +ATOM 149 CA ARG A 149 253.949 285.355 246.884 1.00 0.00 C +ATOM 150 CA ARG A 150 255.860 282.292 245.666 1.00 0.00 C +ATOM 151 CA ALA A 151 257.920 279.598 243.930 1.00 0.00 C +TER 152 ALA A 151 +END diff --git a/Plants/Q84ZL8/Q84ZL8.dcd b/Plants/Q84ZL8/Q84ZL8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..76873d9f67717592345f0d0c343f93b004744927 --- /dev/null +++ b/Plants/Q84ZL8/Q84ZL8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:262dca1823a7f5e6b6d8ecf222c52760db0613c68aa968435a24d2823f2fb9a4 +size 14480276 diff --git a/Plants/Q84ZL8/top.pdb b/Plants/Q84ZL8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..8b2397c468d79f33e94c6540485ec84b2159a6b6 --- /dev/null +++ b/Plants/Q84ZL8/top.pdb @@ -0,0 +1,118 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 233.854 244.075 239.906 1.00 0.00 C +ATOM 2 CA GLY A 2 233.663 247.880 239.903 1.00 0.00 C +ATOM 3 CA SER A 3 236.038 250.798 240.501 1.00 0.00 C +ATOM 4 CA GLY A 4 238.187 252.525 237.871 1.00 0.00 C +ATOM 5 CA ASP A 5 238.375 256.176 238.943 1.00 0.00 C +ATOM 6 CA LYS A 6 236.652 259.534 239.463 1.00 0.00 C +ATOM 7 CA ALA A 7 234.248 261.141 241.945 1.00 0.00 C +ATOM 8 CA ILE A 8 234.458 262.245 245.585 1.00 0.00 C +ATOM 9 CA PHE A 9 234.927 260.107 248.704 1.00 0.00 C +ATOM 10 CA GLY A 10 235.244 258.472 252.130 1.00 0.00 C +ATOM 11 CA ARG A 11 235.198 254.720 251.471 1.00 0.00 C +ATOM 12 CA GLY A 12 236.442 251.494 253.071 1.00 0.00 C +ATOM 13 CA ILE A 13 239.108 249.693 255.111 1.00 0.00 C +ATOM 14 CA PRO A 14 237.445 247.362 257.625 1.00 0.00 C +ATOM 15 CA LEU A 15 236.519 248.990 260.943 1.00 0.00 C +ATOM 16 CA THR A 16 232.831 249.847 261.366 1.00 0.00 C +ATOM 17 CA HIS A 17 230.339 247.085 260.541 1.00 0.00 C +ATOM 18 CA ALA A 18 227.776 244.870 258.798 1.00 0.00 C +ATOM 19 CA THR A 19 224.375 243.259 258.206 1.00 0.00 C +ATOM 20 CA HIS A 20 221.811 240.985 256.540 1.00 0.00 C +ATOM 21 CA THR A 21 222.336 237.211 256.526 1.00 0.00 C +ATOM 22 CA PRO A 22 224.392 235.608 259.305 1.00 0.00 C +ATOM 23 CA GLN A 23 227.008 237.322 261.480 1.00 0.00 C +ATOM 24 CA VAL A 24 230.288 236.679 259.653 1.00 0.00 C +ATOM 25 CA PRO A 25 233.277 235.671 257.516 1.00 0.00 C +ATOM 26 CA PRO A 26 233.959 236.931 253.985 1.00 0.00 C +ATOM 27 CA LEU A 27 231.246 238.176 251.616 1.00 0.00 C +ATOM 28 CA SER A 28 230.891 236.963 248.022 1.00 0.00 C +ATOM 29 CA GLY A 29 230.263 235.045 244.791 1.00 0.00 C +ATOM 30 CA LEU A 30 228.253 235.759 241.634 1.00 0.00 C +ATOM 31 CA GLN A 31 225.296 233.700 240.396 1.00 0.00 C +ATOM 32 CA ALA A 32 223.462 230.631 239.080 1.00 0.00 C +ATOM 33 CA THR A 33 224.895 227.159 239.721 1.00 0.00 C +ATOM 34 CA THR A 34 227.193 226.220 242.610 1.00 0.00 C +ATOM 35 CA SER A 35 229.210 223.262 243.914 1.00 0.00 C +ATOM 36 CA LYS A 36 232.268 221.907 242.090 1.00 0.00 C +ATOM 37 CA HIS A 37 235.372 223.358 240.422 1.00 0.00 C +ATOM 38 CA HIS A 38 236.923 226.691 239.423 1.00 0.00 C +ATOM 39 CA ARG A 39 240.150 227.957 241.004 1.00 0.00 C +ATOM 40 CA ARG A 40 240.446 226.853 244.639 1.00 0.00 C +ATOM 41 CA ASP A 41 237.557 227.075 247.114 1.00 0.00 C +ATOM 42 CA LYS A 42 235.693 230.389 246.879 1.00 0.00 C +ATOM 43 CA ASP A 43 232.275 230.568 248.553 1.00 0.00 C +ATOM 44 CA LYS A 44 228.521 230.200 249.092 1.00 0.00 C +ATOM 45 CA ASP A 45 226.952 231.001 252.469 1.00 0.00 C +ATOM 46 CA PRO A 46 228.545 231.026 255.930 1.00 0.00 C +ATOM 47 CA ASP A 47 230.734 230.174 258.930 1.00 0.00 C +ATOM 48 CA ARG A 48 233.739 227.833 259.028 1.00 0.00 C +ATOM 49 CA GLU A 49 236.942 228.881 257.252 1.00 0.00 C +ATOM 50 CA ARG A 50 240.133 228.247 259.235 1.00 0.00 C +ATOM 51 CA PRO A 51 243.343 229.091 257.364 1.00 0.00 C +ATOM 52 CA SER A 52 245.664 231.125 259.598 1.00 0.00 C +ATOM 53 CA SER A 53 249.439 231.568 259.339 1.00 0.00 C +ATOM 54 CA SER A 54 253.193 232.175 259.100 1.00 0.00 C +ATOM 55 CA ARG A 55 256.799 231.081 258.542 1.00 0.00 C +ATOM 56 CA HIS A 56 259.325 230.813 255.703 1.00 0.00 C +ATOM 57 CA HIS A 57 261.947 228.361 256.978 1.00 0.00 C +ATOM 58 CA HIS A 58 264.077 226.108 259.192 1.00 0.00 C +ATOM 59 CA HIS A 59 266.368 227.886 261.664 1.00 0.00 C +ATOM 60 CA HIS A 60 270.049 228.496 262.435 1.00 0.00 C +ATOM 61 CA HIS A 61 273.233 230.347 261.462 1.00 0.00 C +ATOM 62 CA HIS A 62 273.525 230.466 257.665 1.00 0.00 C +ATOM 63 CA ARG A 63 273.384 233.090 254.906 1.00 0.00 C +ATOM 64 CA ASP A 64 270.790 235.630 253.752 1.00 0.00 C +ATOM 65 CA ASP A 65 267.250 234.846 252.583 1.00 0.00 C +ATOM 66 CA LYS A 66 264.160 234.373 254.761 1.00 0.00 C +ATOM 67 CA ASP A 67 262.684 237.473 256.412 1.00 0.00 C +ATOM 68 CA GLY A 68 262.440 240.574 258.612 1.00 0.00 C +ATOM 69 CA GLU A 69 260.559 242.613 261.224 1.00 0.00 C +ATOM 70 CA ARG A 70 260.028 243.891 264.773 1.00 0.00 C +ATOM 71 CA ASP A 71 258.475 246.234 267.346 1.00 0.00 C +ATOM 72 CA ARG A 72 256.322 249.149 266.170 1.00 0.00 C +ATOM 73 CA ASP A 73 254.797 252.451 265.037 1.00 0.00 C +ATOM 74 CA ARG A 74 254.897 256.160 264.168 1.00 0.00 C +ATOM 75 CA ASP A 75 254.046 259.613 262.801 1.00 0.00 C +ATOM 76 CA ARG A 76 255.337 262.613 264.762 1.00 0.00 C +ATOM 77 CA HIS A 77 257.238 265.530 263.216 1.00 0.00 C +ATOM 78 CA HIS A 78 260.933 266.319 263.703 1.00 0.00 C +ATOM 79 CA ARG A 79 261.252 270.061 263.061 1.00 0.00 C +ATOM 80 CA GLU A 80 262.649 273.556 263.654 1.00 0.00 C +ATOM 81 CA LYS A 81 261.004 276.056 261.296 1.00 0.00 C +ATOM 82 CA GLU A 82 257.421 277.194 261.918 1.00 0.00 C +ATOM 83 CA ARG A 83 254.873 277.084 259.088 1.00 0.00 C +ATOM 84 CA ASP A 84 255.211 276.511 255.336 1.00 0.00 C +ATOM 85 CA ARG A 85 255.521 273.400 253.158 1.00 0.00 C +ATOM 86 CA GLU A 86 252.971 271.734 250.870 1.00 0.00 C +ATOM 87 CA GLU A 87 252.379 268.235 249.482 1.00 0.00 C +ATOM 88 CA ARG A 88 253.351 266.724 246.123 1.00 0.00 C +ATOM 89 CA LYS A 89 255.240 269.007 243.728 1.00 0.00 C +ATOM 90 CA ALA A 90 257.879 269.938 241.142 1.00 0.00 C +ATOM 91 CA ARG A 91 259.594 266.973 239.473 1.00 0.00 C +ATOM 92 CA GLU A 92 258.521 266.494 235.849 1.00 0.00 C +ATOM 93 CA ARG A 93 259.380 266.871 232.156 1.00 0.00 C +ATOM 94 CA ASP A 94 261.277 266.462 228.877 1.00 0.00 C +ATOM 95 CA LYS A 95 264.277 268.810 228.841 1.00 0.00 C +ATOM 96 CA GLU A 96 266.066 272.070 228.011 1.00 0.00 C +ATOM 97 CA LYS A 97 269.121 272.686 230.202 1.00 0.00 C +ATOM 98 CA GLU A 98 268.086 273.649 233.740 1.00 0.00 C +ATOM 99 CA ARG A 99 269.448 273.098 237.256 1.00 0.00 C +ATOM 100 CA ALA A 100 270.027 270.583 240.059 1.00 0.00 C +ATOM 101 CA ARG A 101 271.747 267.201 240.401 1.00 0.00 C +ATOM 102 CA ARG A 102 272.814 263.682 239.404 1.00 0.00 C +ATOM 103 CA ARG A 103 276.285 263.029 240.834 1.00 0.00 C +ATOM 104 CA GLU A 104 278.370 264.210 243.795 1.00 0.00 C +ATOM 105 CA GLU A 105 280.013 267.357 245.178 1.00 0.00 C +ATOM 106 CA SER A 106 279.292 270.810 243.737 1.00 0.00 C +ATOM 107 CA SER A 107 277.244 273.875 242.776 1.00 0.00 C +ATOM 108 CA ARG A 108 278.067 276.050 239.757 1.00 0.00 C +ATOM 109 CA SER A 109 279.384 278.838 237.520 1.00 0.00 C +ATOM 110 CA ARG A 110 278.479 281.136 234.619 1.00 0.00 C +ATOM 111 CA ARG A 111 276.081 283.977 233.785 1.00 0.00 C +ATOM 112 CA HIS A 112 275.540 287.714 234.293 1.00 0.00 C +ATOM 113 CA GLY A 113 273.843 289.532 237.180 1.00 0.00 C +ATOM 114 CA ALA A 114 271.285 287.561 239.203 1.00 0.00 C +TER 115 ALA A 114 +END diff --git a/Plants/Q84ZR2/Q84ZR2.dcd b/Plants/Q84ZR2/Q84ZR2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..6e69c6fe1c3b8762531e7f01cd84fdcf5ccd1d9d --- /dev/null +++ b/Plants/Q84ZR2/Q84ZR2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:9f7b090f5cce1bd675bab93bfbc62ae76665ce49cb32617b4539ea8917ed2051 +size 19640276 diff --git a/Plants/Q84ZR2/top.pdb b/Plants/Q84ZR2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..40189fe64d71a9482d4701e83a3ac5379aedd20d --- /dev/null +++ b/Plants/Q84ZR2/top.pdb @@ -0,0 +1,161 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 250.530 247.664 241.588 1.00 0.00 C +ATOM 2 CA GLY A 2 251.110 251.403 242.033 1.00 0.00 C +ATOM 3 CA PRO A 3 251.973 254.628 243.870 1.00 0.00 C +ATOM 4 CA THR A 4 253.648 256.137 246.942 1.00 0.00 C +ATOM 5 CA CYS A 5 257.431 255.724 247.125 1.00 0.00 C +ATOM 6 CA ARG A 6 259.134 258.904 248.351 1.00 0.00 C +ATOM 7 CA GLY A 7 257.695 261.370 250.873 1.00 0.00 C +ATOM 8 CA ARG A 8 257.439 261.395 254.675 1.00 0.00 C +ATOM 9 CA ARG A 9 258.963 259.735 257.746 1.00 0.00 C +ATOM 10 CA GLY A 10 257.951 261.029 261.184 1.00 0.00 C +ATOM 11 CA TRP A 11 256.017 264.306 261.368 1.00 0.00 C +ATOM 12 CA ALA A 12 256.876 266.364 264.457 1.00 0.00 C +ATOM 13 CA ALA A 13 257.731 269.069 267.000 1.00 0.00 C +ATOM 14 CA GLU A 14 259.505 272.304 266.050 1.00 0.00 C +ATOM 15 CA GLN A 15 259.767 276.079 266.499 1.00 0.00 C +ATOM 16 CA ALA A 16 262.702 276.536 268.885 1.00 0.00 C +ATOM 17 CA SER A 17 265.690 274.336 269.751 1.00 0.00 C +ATOM 18 CA SER A 18 266.050 270.557 269.417 1.00 0.00 C +ATOM 19 CA GLY A 19 264.033 267.374 269.974 1.00 0.00 C +ATOM 20 CA GLY A 20 264.747 264.062 271.717 1.00 0.00 C +ATOM 21 CA SER A 21 264.860 264.509 275.499 1.00 0.00 C +ATOM 22 CA GLY A 22 264.268 267.436 277.866 1.00 0.00 C +ATOM 23 CA GLY A 23 264.848 268.374 281.513 1.00 0.00 C +ATOM 24 CA ARG A 24 262.542 271.106 282.833 1.00 0.00 C +ATOM 25 CA GLY A 25 261.912 273.637 280.056 1.00 0.00 C +ATOM 26 CA ARG A 26 264.662 273.517 277.422 1.00 0.00 C +ATOM 27 CA ARG A 27 267.615 275.686 276.377 1.00 0.00 C +ATOM 28 CA ARG A 28 268.764 278.911 274.705 1.00 0.00 C +ATOM 29 CA PRO A 29 270.312 278.348 271.269 1.00 0.00 C +ATOM 30 CA PRO A 30 273.037 275.757 271.889 1.00 0.00 C +ATOM 31 CA THR A 31 273.453 272.263 273.348 1.00 0.00 C +ATOM 32 CA GLY A 32 277.098 271.169 273.535 1.00 0.00 C +ATOM 33 CA ALA A 33 279.624 270.263 270.831 1.00 0.00 C +ATOM 34 CA PRO A 34 281.611 271.180 267.712 1.00 0.00 C +ATOM 35 CA ALA A 35 281.767 271.965 263.987 1.00 0.00 C +ATOM 36 CA VAL A 36 279.223 270.970 261.331 1.00 0.00 C +ATOM 37 CA ARG A 37 275.672 272.123 260.572 1.00 0.00 C +ATOM 38 CA VAL A 38 272.882 273.626 262.687 1.00 0.00 C +ATOM 39 CA LYS A 39 270.660 276.644 262.002 1.00 0.00 C +ATOM 40 CA ALA A 40 267.943 276.674 259.331 1.00 0.00 C +ATOM 41 CA GLY A 41 265.533 274.555 257.277 1.00 0.00 C +ATOM 42 CA PRO A 42 263.774 271.475 258.668 1.00 0.00 C +ATOM 43 CA ALA A 43 262.722 268.375 256.718 1.00 0.00 C +ATOM 44 CA VAL A 44 260.827 269.499 253.609 1.00 0.00 C +ATOM 45 CA ARG A 45 262.561 272.651 252.354 1.00 0.00 C +ATOM 46 CA GLY A 46 263.164 275.714 250.170 1.00 0.00 C +ATOM 47 CA GLY A 47 261.828 275.302 246.626 1.00 0.00 C +ATOM 48 CA PRO A 48 259.696 277.126 244.048 1.00 0.00 C +ATOM 49 CA ALA A 49 257.157 277.768 241.282 1.00 0.00 C +ATOM 50 CA ALA A 50 255.560 274.650 239.783 1.00 0.00 C +ATOM 51 CA GLY A 51 251.808 274.727 239.124 1.00 0.00 C +ATOM 52 CA ALA A 52 249.248 272.005 239.865 1.00 0.00 C +ATOM 53 CA THR A 53 246.267 273.180 241.926 1.00 0.00 C +ATOM 54 CA ALA A 54 243.203 270.942 241.581 1.00 0.00 C +ATOM 55 CA ALA A 55 239.761 269.325 241.342 1.00 0.00 C +ATOM 56 CA ALA A 56 238.200 270.456 238.056 1.00 0.00 C +ATOM 57 CA ALA A 57 239.106 272.078 234.729 1.00 0.00 C +ATOM 58 CA GLY A 58 238.149 271.148 231.161 1.00 0.00 C +ATOM 59 CA GLY A 59 238.942 271.491 227.450 1.00 0.00 C +ATOM 60 CA GLY A 60 242.037 269.833 225.970 1.00 0.00 C +ATOM 61 CA SER A 61 244.437 269.232 228.867 1.00 0.00 C +ATOM 62 CA THR A 62 245.486 266.295 231.057 1.00 0.00 C +ATOM 63 CA GLY A 63 247.654 263.323 230.064 1.00 0.00 C +ATOM 64 CA ARG A 64 247.608 259.574 229.387 1.00 0.00 C +ATOM 65 CA ALA A 65 246.081 256.551 227.642 1.00 0.00 C +ATOM 66 CA ASP A 66 242.395 255.957 226.882 1.00 0.00 C +ATOM 67 CA GLU A 67 241.517 253.207 224.395 1.00 0.00 C +ATOM 68 CA ARG A 68 240.322 252.848 220.795 1.00 0.00 C +ATOM 69 CA GLY A 69 237.824 254.157 218.233 1.00 0.00 C +ATOM 70 CA GLY A 70 234.713 256.354 218.142 1.00 0.00 C +ATOM 71 CA SER A 71 231.529 257.023 216.159 1.00 0.00 C +ATOM 72 CA GLY A 72 228.450 257.696 218.300 1.00 0.00 C +ATOM 73 CA GLN A 73 226.574 260.672 216.837 1.00 0.00 C +ATOM 74 CA SER A 74 228.133 264.013 215.878 1.00 0.00 C +ATOM 75 CA GLY A 75 230.096 267.256 216.264 1.00 0.00 C +ATOM 76 CA GLY A 76 229.585 270.852 215.114 1.00 0.00 C +ATOM 77 CA THR A 77 228.514 272.909 218.137 1.00 0.00 C +ATOM 78 CA LYS A 78 226.818 276.121 219.288 1.00 0.00 C +ATOM 79 CA PRO A 79 226.918 277.032 222.986 1.00 0.00 C +ATOM 80 CA LYS A 80 229.596 275.340 225.103 1.00 0.00 C +ATOM 81 CA GLU A 81 229.203 273.567 228.452 1.00 0.00 C +ATOM 82 CA CYS A 82 228.424 270.137 229.916 1.00 0.00 C +ATOM 83 CA GLN A 83 229.388 266.998 231.849 1.00 0.00 C +ATOM 84 CA PRO A 84 231.548 266.136 234.867 1.00 0.00 C +ATOM 85 CA ARG A 85 232.440 262.467 235.380 1.00 0.00 C +ATOM 86 CA HIS A 86 230.865 259.038 234.852 1.00 0.00 C +ATOM 87 CA ARG A 87 229.377 255.579 234.272 1.00 0.00 C +ATOM 88 CA LEU A 88 229.652 252.121 232.697 1.00 0.00 C +ATOM 89 CA LEU A 89 230.950 248.584 233.262 1.00 0.00 C +ATOM 90 CA PRO A 90 230.728 246.215 236.237 1.00 0.00 C +ATOM 91 CA ALA A 91 228.703 243.209 237.411 1.00 0.00 C +ATOM 92 CA HIS A 92 228.791 240.432 234.804 1.00 0.00 C +ATOM 93 CA SER A 93 231.265 238.216 232.937 1.00 0.00 C +ATOM 94 CA ARG A 94 234.803 237.773 231.595 1.00 0.00 C +ATOM 95 CA GLY A 95 236.918 235.399 233.693 1.00 0.00 C +ATOM 96 CA ALA A 96 238.463 232.402 235.468 1.00 0.00 C +ATOM 97 CA ALA A 97 240.070 229.410 237.193 1.00 0.00 C +ATOM 98 CA GLY A 98 243.083 227.180 237.876 1.00 0.00 C +ATOM 99 CA GLY A 99 243.720 223.428 237.707 1.00 0.00 C +ATOM 100 CA GLY A 100 243.407 221.286 240.843 1.00 0.00 C +ATOM 101 CA ARG A 101 242.080 218.652 243.254 1.00 0.00 C +ATOM 102 CA SER A 102 242.122 214.849 243.024 1.00 0.00 C +ATOM 103 CA ARG A 103 245.147 212.539 243.193 1.00 0.00 C +ATOM 104 CA TRP A 104 246.089 208.875 242.742 1.00 0.00 C +ATOM 105 CA ALA A 105 247.162 205.820 244.752 1.00 0.00 C +ATOM 106 CA VAL A 106 246.802 205.826 248.545 1.00 0.00 C +ATOM 107 CA GLY A 107 247.614 209.254 249.995 1.00 0.00 C +ATOM 108 CA GLY A 108 245.576 210.052 253.114 1.00 0.00 C +ATOM 109 CA ALA A 109 246.561 213.467 254.485 1.00 0.00 C +ATOM 110 CA THR A 110 244.996 216.860 255.230 1.00 0.00 C +ATOM 111 CA THR A 111 243.057 218.134 252.208 1.00 0.00 C +ATOM 112 CA GLY A 112 244.038 216.217 249.065 1.00 0.00 C +ATOM 113 CA GLY A 113 246.842 218.070 247.271 1.00 0.00 C +ATOM 114 CA GLY A 114 249.683 220.315 248.457 1.00 0.00 C +ATOM 115 CA ARG A 115 252.322 221.008 251.115 1.00 0.00 C +ATOM 116 CA SER A 116 255.922 220.541 249.956 1.00 0.00 C +ATOM 117 CA ARG A 117 257.355 219.908 246.484 1.00 0.00 C +ATOM 118 CA TRP A 118 260.712 218.330 245.611 1.00 0.00 C +ATOM 119 CA ALA A 119 260.738 215.652 242.902 1.00 0.00 C +ATOM 120 CA VAL A 120 264.110 215.591 241.129 1.00 0.00 C +ATOM 121 CA GLY A 121 266.577 218.258 242.277 1.00 0.00 C +ATOM 122 CA GLY A 122 265.066 221.720 242.781 1.00 0.00 C +ATOM 123 CA ALA A 123 263.595 224.225 245.245 1.00 0.00 C +ATOM 124 CA THR A 124 266.463 224.994 247.633 1.00 0.00 C +ATOM 125 CA THR A 125 268.874 226.289 250.284 1.00 0.00 C +ATOM 126 CA GLY A 126 267.993 228.736 253.068 1.00 0.00 C +ATOM 127 CA GLY A 127 264.351 229.840 253.259 1.00 0.00 C +ATOM 128 CA GLY A 128 262.310 227.105 251.565 1.00 0.00 C +ATOM 129 CA ARG A 129 261.196 223.933 253.357 1.00 0.00 C +ATOM 130 CA ARG A 130 258.232 225.054 255.472 1.00 0.00 C +ATOM 131 CA GLY A 131 255.851 225.193 258.443 1.00 0.00 C +ATOM 132 CA GLU A 132 252.447 226.789 257.826 1.00 0.00 C +ATOM 133 CA SER A 133 248.850 226.768 259.080 1.00 0.00 C +ATOM 134 CA ALA A 134 248.446 228.898 262.213 1.00 0.00 C +ATOM 135 CA ALA A 135 250.013 229.945 265.524 1.00 0.00 C +ATOM 136 CA ARG A 136 252.558 232.759 265.869 1.00 0.00 C +ATOM 137 CA GLU A 137 252.915 235.963 263.837 1.00 0.00 C +ATOM 138 CA GLU A 138 250.554 238.937 264.140 1.00 0.00 C +ATOM 139 CA ALA A 139 247.103 237.935 262.875 1.00 0.00 C +ATOM 140 CA ASN A 140 243.559 239.247 262.388 1.00 0.00 C +ATOM 141 CA LEU A 141 240.359 238.348 260.526 1.00 0.00 C +ATOM 142 CA SER A 142 236.947 238.020 262.189 1.00 0.00 C +ATOM 143 CA GLY A 143 235.588 241.560 262.563 1.00 0.00 C +ATOM 144 CA ARG A 144 232.005 241.409 263.849 1.00 0.00 C +ATOM 145 CA PRO A 145 231.519 238.764 266.547 1.00 0.00 C +ATOM 146 CA ALA A 146 231.716 239.371 270.303 1.00 0.00 C +ATOM 147 CA GLY A 147 234.677 238.172 272.378 1.00 0.00 C +ATOM 148 CA GLU A 148 235.161 234.579 273.551 1.00 0.00 C +ATOM 149 CA GLU A 149 237.129 231.772 271.888 1.00 0.00 C +ATOM 150 CA ALA A 150 240.629 230.817 270.723 1.00 0.00 C +ATOM 151 CA ALA A 151 244.276 231.886 270.987 1.00 0.00 C +ATOM 152 CA ARG A 152 246.278 233.822 268.388 1.00 0.00 C +ATOM 153 CA ALA A 153 249.242 235.517 270.079 1.00 0.00 C +ATOM 154 CA GLY A 154 249.460 236.808 273.657 1.00 0.00 C +ATOM 155 CA ARG A 155 249.764 234.191 276.409 1.00 0.00 C +ATOM 156 CA TRP A 156 249.521 231.503 279.099 1.00 0.00 C +ATOM 157 CA GLU A 157 252.508 229.494 280.348 1.00 0.00 C +TER 158 GLU A 157 +END diff --git a/Plants/Q84ZS0/Q84ZS0.dcd b/Plants/Q84ZS0/Q84ZS0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..0c59cefa90112b646940ba9f4daac1f72bc559e8 --- /dev/null +++ b/Plants/Q84ZS0/Q84ZS0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:cd5714ab2100160ae1da6171a011833e93a3680952562f13828c44fc00d2942b +size 10520276 diff --git a/Plants/Q84ZS0/top.pdb b/Plants/Q84ZS0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..101f1a072c8fdcc01ed4ec7c90b9545ef98cb30b --- /dev/null +++ b/Plants/Q84ZS0/top.pdb @@ -0,0 +1,85 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 235.892 225.727 259.444 1.00 0.00 C +ATOM 2 CA GLY A 2 237.309 223.163 257.009 1.00 0.00 C +ATOM 3 CA PRO A 3 237.591 221.470 253.607 1.00 0.00 C +ATOM 4 CA ARG A 4 239.651 223.784 251.390 1.00 0.00 C +ATOM 5 CA ASN A 5 241.249 222.744 248.092 1.00 0.00 C +ATOM 6 CA PRO A 6 238.300 221.627 245.953 1.00 0.00 C +ATOM 7 CA VAL A 7 238.681 222.845 242.364 1.00 0.00 C +ATOM 8 CA GLY A 8 237.308 221.237 239.195 1.00 0.00 C +ATOM 9 CA ASP A 9 239.509 222.355 236.293 1.00 0.00 C +ATOM 10 CA PRO A 10 239.369 226.161 236.191 1.00 0.00 C +ATOM 11 CA ALA A 11 237.546 229.255 234.919 1.00 0.00 C +ATOM 12 CA PRO A 12 236.407 232.888 235.079 1.00 0.00 C +ATOM 13 CA ASP A 13 238.155 235.619 237.080 1.00 0.00 C +ATOM 14 CA SER A 14 236.658 239.081 237.616 1.00 0.00 C +ATOM 15 CA THR A 15 235.644 241.835 240.045 1.00 0.00 C +ATOM 16 CA THR A 16 236.994 243.627 243.125 1.00 0.00 C +ATOM 17 CA GLN A 17 238.202 247.064 244.239 1.00 0.00 C +ATOM 18 CA ASP A 18 240.841 249.524 243.013 1.00 0.00 C +ATOM 19 CA ASN A 19 239.782 253.035 244.048 1.00 0.00 C +ATOM 20 CA LEU A 20 238.443 256.509 244.855 1.00 0.00 C +ATOM 21 CA PRO A 21 239.845 260.042 244.598 1.00 0.00 C +ATOM 22 CA PRO A 22 237.769 263.223 244.897 1.00 0.00 C +ATOM 23 CA ARG A 23 234.136 262.108 245.164 1.00 0.00 C +ATOM 24 CA HIS A 24 232.431 262.108 248.571 1.00 0.00 C +ATOM 25 CA ALA A 25 233.407 264.433 251.427 1.00 0.00 C +ATOM 26 CA TRP A 26 236.767 264.222 253.211 1.00 0.00 C +ATOM 27 CA PRO A 27 238.076 262.416 256.300 1.00 0.00 C +ATOM 28 CA LEU A 28 239.280 258.906 257.163 1.00 0.00 C +ATOM 29 CA THR A 29 241.240 255.666 256.743 1.00 0.00 C +ATOM 30 CA PRO A 30 244.855 255.095 257.800 1.00 0.00 C +ATOM 31 CA VAL A 31 247.038 252.620 259.704 1.00 0.00 C +ATOM 32 CA PRO A 32 248.605 249.200 259.103 1.00 0.00 C +ATOM 33 CA PRO A 33 248.585 248.591 255.342 1.00 0.00 C +ATOM 34 CA ALA A 34 248.902 250.881 252.314 1.00 0.00 C +ATOM 35 CA SER A 35 252.181 252.640 251.494 1.00 0.00 C +ATOM 36 CA HIS A 36 253.517 255.296 253.876 1.00 0.00 C +ATOM 37 CA CYS A 37 257.306 255.562 253.576 1.00 0.00 C +ATOM 38 CA SER A 38 259.034 253.358 256.160 1.00 0.00 C +ATOM 39 CA THR A 39 262.020 253.780 258.487 1.00 0.00 C +ATOM 40 CA PRO A 40 265.396 255.424 257.842 1.00 0.00 C +ATOM 41 CA LEU A 41 267.257 258.678 257.159 1.00 0.00 C +ATOM 42 CA TRP A 42 268.427 258.761 253.534 1.00 0.00 C +ATOM 43 CA ARG A 43 267.484 260.670 250.375 1.00 0.00 C +ATOM 44 CA MET A 44 264.245 262.661 250.625 1.00 0.00 C +ATOM 45 CA HIS A 45 260.806 261.684 251.944 1.00 0.00 C +ATOM 46 CA PRO A 46 257.382 261.708 250.273 1.00 0.00 C +ATOM 47 CA ARG A 47 254.875 264.378 249.224 1.00 0.00 C +ATOM 48 CA ARG A 48 253.929 267.493 251.204 1.00 0.00 C +ATOM 49 CA ARG A 49 250.883 268.967 249.454 1.00 0.00 C +ATOM 50 CA MET A 50 249.292 269.130 245.996 1.00 0.00 C +ATOM 51 CA ARG A 51 248.853 266.594 243.187 1.00 0.00 C +ATOM 52 CA PRO A 52 247.993 264.357 240.225 1.00 0.00 C +ATOM 53 CA SER A 53 251.294 262.900 239.001 1.00 0.00 C +ATOM 54 CA LEU A 54 252.403 259.255 238.951 1.00 0.00 C +ATOM 55 CA THR A 55 251.573 257.309 242.120 1.00 0.00 C +ATOM 56 CA THR A 56 253.895 256.753 245.089 1.00 0.00 C +ATOM 57 CA GLY A 57 257.430 256.249 243.760 1.00 0.00 C +ATOM 58 CA GLU A 58 260.018 255.077 241.221 1.00 0.00 C +ATOM 59 CA HIS A 59 261.715 251.810 240.238 1.00 0.00 C +ATOM 60 CA GLU A 60 264.910 252.625 238.329 1.00 0.00 C +ATOM 61 CA PRO A 61 268.654 252.058 238.745 1.00 0.00 C +ATOM 62 CA PRO A 62 271.481 250.862 241.002 1.00 0.00 C +ATOM 63 CA PRO A 63 271.958 247.759 243.162 1.00 0.00 C +ATOM 64 CA ARG A 64 269.485 245.305 244.703 1.00 0.00 C +ATOM 65 CA HIS A 65 268.076 243.441 247.713 1.00 0.00 C +ATOM 66 CA GLY A 66 264.599 243.845 249.219 1.00 0.00 C +ATOM 67 CA GLY A 67 261.027 242.607 249.694 1.00 0.00 C +ATOM 68 CA LEU A 68 257.396 241.716 250.427 1.00 0.00 C +ATOM 69 CA ARG A 69 254.687 244.055 251.732 1.00 0.00 C +ATOM 70 CA TRP A 70 251.558 242.956 253.606 1.00 0.00 C +ATOM 71 CA MET A 71 252.631 240.262 256.077 1.00 0.00 C +ATOM 72 CA LEU A 72 253.892 240.561 259.660 1.00 0.00 C +ATOM 73 CA ARG A 73 252.760 244.029 260.757 1.00 0.00 C +ATOM 74 CA ARG A 74 253.677 247.128 262.776 1.00 0.00 C +ATOM 75 CA GLY A 75 254.678 249.563 265.530 1.00 0.00 C +ATOM 76 CA ALA A 76 256.244 252.700 267.021 1.00 0.00 C +ATOM 77 CA ASP A 77 254.178 255.857 266.494 1.00 0.00 C +ATOM 78 CA ALA A 78 253.434 259.341 267.847 1.00 0.00 C +ATOM 79 CA ALA A 79 250.252 261.213 268.786 1.00 0.00 C +ATOM 80 CA THR A 80 250.389 264.985 269.302 1.00 0.00 C +ATOM 81 CA GLU A 81 250.361 267.576 266.509 1.00 0.00 C +TER 82 GLU A 81 +END diff --git a/Plants/Q850G3/Q850G3.dcd b/Plants/Q850G3/Q850G3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..df00f894d37a269e6fc3da111905ccb97ac845b1 --- /dev/null +++ b/Plants/Q850G3/Q850G3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:a146db3d76c7cc539ac6d767515e60313355e2a8e45cc30155fdcb475cc881a7 +size 8480276 diff --git a/Plants/Q850G3/top.pdb b/Plants/Q850G3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..62e9a2b53f092006907db3752f1962b8ee3ef7bb --- /dev/null +++ b/Plants/Q850G3/top.pdb @@ -0,0 +1,68 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA ARG A 1 255.489 226.092 229.760 1.00 0.00 C +ATOM 2 CA GLU A 2 253.211 228.122 227.478 1.00 0.00 C +ATOM 3 CA HIS A 3 249.910 229.701 226.416 1.00 0.00 C +ATOM 4 CA GLY A 4 248.273 232.856 225.046 1.00 0.00 C +ATOM 5 CA HIS A 5 247.852 236.518 224.080 1.00 0.00 C +ATOM 6 CA VAL A 6 246.248 239.364 226.040 1.00 0.00 C +ATOM 7 CA GLN A 7 243.622 241.227 228.077 1.00 0.00 C +ATOM 8 CA GLU A 8 241.957 239.392 230.972 1.00 0.00 C +ATOM 9 CA HIS A 9 238.230 238.883 230.363 1.00 0.00 C +ATOM 10 CA HIS A 10 235.150 236.946 231.492 1.00 0.00 C +ATOM 11 CA PRO A 11 233.824 236.765 235.060 1.00 0.00 C +ATOM 12 CA GLY A 12 236.181 237.122 238.032 1.00 0.00 C +ATOM 13 CA GLU A 13 236.571 239.748 240.764 1.00 0.00 C +ATOM 14 CA GLN A 14 240.082 240.333 242.124 1.00 0.00 C +ATOM 15 CA GLN A 15 241.087 243.072 244.574 1.00 0.00 C +ATOM 16 CA HIS A 16 238.919 243.732 247.636 1.00 0.00 C +ATOM 17 CA LYS A 17 235.568 242.990 249.290 1.00 0.00 C +ATOM 18 CA GLU A 18 231.885 243.965 249.240 1.00 0.00 C +ATOM 19 CA GLY A 19 229.280 246.042 247.393 1.00 0.00 C +ATOM 20 CA LEU A 20 229.463 249.847 247.434 1.00 0.00 C +ATOM 21 CA VAL A 21 232.791 251.210 248.691 1.00 0.00 C +ATOM 22 CA ASP A 22 236.496 252.041 249.008 1.00 0.00 C +ATOM 23 CA LYS A 23 239.572 250.185 250.279 1.00 0.00 C +ATOM 24 CA ILE A 24 242.172 251.940 252.441 1.00 0.00 C +ATOM 25 CA LYS A 25 242.825 251.346 256.147 1.00 0.00 C +ATOM 26 CA ASP A 26 243.131 247.870 257.675 1.00 0.00 C +ATOM 27 CA LYS A 27 243.615 245.760 260.810 1.00 0.00 C +ATOM 28 CA ILE A 28 242.897 247.399 264.173 1.00 0.00 C +ATOM 29 CA HIS A 29 244.391 245.388 267.044 1.00 0.00 C +ATOM 30 CA GLY A 30 244.300 242.174 269.087 1.00 0.00 C +ATOM 31 CA GLY A 31 246.873 240.216 271.102 1.00 0.00 C +ATOM 32 CA ASP A 32 250.069 238.178 271.494 1.00 0.00 C +ATOM 33 CA GLY A 33 253.463 239.448 272.669 1.00 0.00 C +ATOM 34 CA ALA A 34 256.522 238.157 270.800 1.00 0.00 C +ATOM 35 CA GLU A 35 257.351 237.687 267.111 1.00 0.00 C +ATOM 36 CA GLY A 36 257.151 241.194 265.636 1.00 0.00 C +ATOM 37 CA GLU A 37 256.781 244.977 265.375 1.00 0.00 C +ATOM 38 CA LYS A 38 257.685 247.950 267.580 1.00 0.00 C +ATOM 39 CA LYS A 39 260.840 248.324 269.683 1.00 0.00 C +ATOM 40 CA LYS A 40 264.439 249.039 268.656 1.00 0.00 C +ATOM 41 CA LYS A 41 267.963 248.035 267.613 1.00 0.00 C +ATOM 42 CA LYS A 42 271.747 248.148 267.186 1.00 0.00 C +ATOM 43 CA ASP A 43 272.902 251.693 267.972 1.00 0.00 C +ATOM 44 CA LYS A 44 271.621 253.979 265.207 1.00 0.00 C +ATOM 45 CA LYS A 45 271.592 257.275 263.296 1.00 0.00 C +ATOM 46 CA LYS A 46 269.878 259.907 265.454 1.00 0.00 C +ATOM 47 CA GLY A 47 267.484 262.651 264.333 1.00 0.00 C +ATOM 48 CA GLU A 48 266.224 266.233 264.015 1.00 0.00 C +ATOM 49 CA HIS A 49 263.737 266.771 261.180 1.00 0.00 C +ATOM 50 CA GLY A 50 260.359 265.012 261.089 1.00 0.00 C +ATOM 51 CA HIS A 51 260.238 263.058 257.820 1.00 0.00 C +ATOM 52 CA ASP A 52 261.689 261.676 254.580 1.00 0.00 C +ATOM 53 CA HIS A 53 258.699 260.572 252.493 1.00 0.00 C +ATOM 54 CA GLY A 54 257.385 262.029 249.227 1.00 0.00 C +ATOM 55 CA HIS A 55 256.298 263.857 246.066 1.00 0.00 C +ATOM 56 CA ASP A 56 252.538 264.262 245.601 1.00 0.00 C +ATOM 57 CA SER A 57 251.692 265.390 242.061 1.00 0.00 C +ATOM 58 CA SER A 58 251.412 267.200 238.720 1.00 0.00 C +ATOM 59 CA SER A 59 251.415 267.116 234.911 1.00 0.00 C +ATOM 60 CA SER A 60 249.821 269.778 232.701 1.00 0.00 C +ATOM 61 CA SER A 61 247.044 269.927 230.096 1.00 0.00 C +ATOM 62 CA ASP A 62 243.578 271.414 229.559 1.00 0.00 C +ATOM 63 CA SER A 63 243.614 274.746 227.710 1.00 0.00 C +ATOM 64 CA ASP A 64 244.904 276.070 224.379 1.00 0.00 C +TER 65 ASP A 64 +END diff --git a/Plants/Q850G7/Q850G7.dcd b/Plants/Q850G7/Q850G7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..cf81354c159fc35748bc71e9098be67c3b33b80a --- /dev/null +++ b/Plants/Q850G7/Q850G7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:b328d428000a40fce99d177fa1559a89e79c14140fb538faac78b660a9f1c025 +size 20600276 diff --git a/Plants/Q850G7/top.pdb b/Plants/Q850G7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..2f3dc60fdb38383e120b99b39e669b2388dceec7 --- /dev/null +++ b/Plants/Q850G7/top.pdb @@ -0,0 +1,169 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA THR A 1 281.354 186.697 238.114 1.00 0.00 C +ATOM 2 CA SER A 2 279.616 187.617 241.377 1.00 0.00 C +ATOM 3 CA THR A 3 276.371 188.953 242.861 1.00 0.00 C +ATOM 4 CA PRO A 4 274.536 190.977 245.517 1.00 0.00 C +ATOM 5 CA SER A 5 275.578 193.436 248.234 1.00 0.00 C +ATOM 6 CA PRO A 6 274.116 193.857 251.727 1.00 0.00 C +ATOM 7 CA VAL A 7 270.783 195.614 252.296 1.00 0.00 C +ATOM 8 CA PHE A 8 268.829 195.372 249.034 1.00 0.00 C +ATOM 9 CA GLU A 9 265.692 196.652 247.291 1.00 0.00 C +ATOM 10 CA SER A 10 262.562 198.092 248.919 1.00 0.00 C +ATOM 11 CA PRO A 11 260.183 195.129 249.190 1.00 0.00 C +ATOM 12 CA ASN A 12 258.421 191.783 249.658 1.00 0.00 C +ATOM 13 CA ASN A 13 260.764 189.374 251.453 1.00 0.00 C +ATOM 14 CA SER A 14 262.784 187.359 253.979 1.00 0.00 C +ATOM 15 CA PRO A 15 263.738 187.935 257.622 1.00 0.00 C +ATOM 16 CA SER A 16 262.309 188.555 261.099 1.00 0.00 C +ATOM 17 CA PRO A 17 261.526 191.912 262.722 1.00 0.00 C +ATOM 18 CA VAL A 18 261.794 194.570 260.004 1.00 0.00 C +ATOM 19 CA PHE A 19 263.645 197.743 261.014 1.00 0.00 C +ATOM 20 CA GLU A 20 267.003 199.471 261.516 1.00 0.00 C +ATOM 21 CA SER A 21 268.069 201.932 258.809 1.00 0.00 C +ATOM 22 CA PRO A 22 271.369 203.757 258.271 1.00 0.00 C +ATOM 23 CA ASN A 23 274.704 203.605 256.435 1.00 0.00 C +ATOM 24 CA LYS A 24 275.541 206.247 253.820 1.00 0.00 C +ATOM 25 CA THR A 25 276.863 209.627 254.977 1.00 0.00 C +ATOM 26 CA PRO A 26 278.687 210.358 258.241 1.00 0.00 C +ATOM 27 CA SER A 27 280.932 208.908 260.957 1.00 0.00 C +ATOM 28 CA PRO A 28 280.762 210.396 264.461 1.00 0.00 C +ATOM 29 CA VAL A 29 278.832 212.145 267.241 1.00 0.00 C +ATOM 30 CA PHE A 30 276.826 214.445 269.521 1.00 0.00 C +ATOM 31 CA LYS A 31 274.259 215.670 272.057 1.00 0.00 C +ATOM 32 CA SER A 32 274.032 219.465 271.805 1.00 0.00 C +ATOM 33 CA PRO A 33 273.888 223.240 271.307 1.00 0.00 C +ATOM 34 CA SER A 34 274.139 227.041 271.248 1.00 0.00 C +ATOM 35 CA ASN A 35 273.305 230.743 270.910 1.00 0.00 C +ATOM 36 CA SER A 36 271.684 234.124 271.584 1.00 0.00 C +ATOM 37 CA PRO A 37 274.256 236.592 272.928 1.00 0.00 C +ATOM 38 CA SER A 38 274.666 237.861 276.497 1.00 0.00 C +ATOM 39 CA PRO A 39 273.160 239.409 279.636 1.00 0.00 C +ATOM 40 CA THR A 40 272.928 243.173 279.098 1.00 0.00 C +ATOM 41 CA PHE A 41 274.663 245.939 281.063 1.00 0.00 C +ATOM 42 CA LYS A 42 273.007 248.870 282.847 1.00 0.00 C +ATOM 43 CA SER A 43 273.997 251.773 285.107 1.00 0.00 C +ATOM 44 CA PRO A 44 274.879 255.331 284.068 1.00 0.00 C +ATOM 45 CA ASN A 45 273.649 256.401 280.625 1.00 0.00 C +ATOM 46 CA ASN A 46 276.121 257.125 277.818 1.00 0.00 C +ATOM 47 CA SER A 47 277.142 257.759 274.202 1.00 0.00 C +ATOM 48 CA PRO A 48 277.046 257.600 270.397 1.00 0.00 C +ATOM 49 CA LEU A 49 275.691 254.934 268.036 1.00 0.00 C +ATOM 50 CA LYS A 50 274.726 255.175 264.358 1.00 0.00 C +ATOM 51 CA LYS A 51 273.482 253.106 261.411 1.00 0.00 C +ATOM 52 CA ALA A 52 269.927 251.848 260.866 1.00 0.00 C +ATOM 53 CA PRO A 53 267.598 250.156 258.369 1.00 0.00 C +ATOM 54 CA VAL A 54 267.116 251.614 254.882 1.00 0.00 C +ATOM 55 CA PHE A 55 263.636 250.936 253.487 1.00 0.00 C +ATOM 56 CA GLU A 56 261.718 247.933 252.138 1.00 0.00 C +ATOM 57 CA SER A 57 261.535 244.411 253.580 1.00 0.00 C +ATOM 58 CA PRO A 58 260.273 243.070 256.915 1.00 0.00 C +ATOM 59 CA ASP A 59 260.418 243.183 260.721 1.00 0.00 C +ATOM 60 CA LYS A 60 257.895 242.947 263.566 1.00 0.00 C +ATOM 61 CA THR A 61 254.328 243.571 264.752 1.00 0.00 C +ATOM 62 CA PRO A 62 250.637 244.278 265.380 1.00 0.00 C +ATOM 63 CA SER A 63 248.787 244.079 268.704 1.00 0.00 C +ATOM 64 CA PRO A 64 245.984 241.684 269.665 1.00 0.00 C +ATOM 65 CA VAL A 65 243.709 243.491 272.130 1.00 0.00 C +ATOM 66 CA PHE A 66 242.166 246.911 272.793 1.00 0.00 C +ATOM 67 CA LYS A 67 243.824 249.916 271.139 1.00 0.00 C +ATOM 68 CA SER A 68 243.315 251.969 267.970 1.00 0.00 C +ATOM 69 CA PRO A 69 240.330 254.295 268.409 1.00 0.00 C +ATOM 70 CA SER A 70 239.526 257.078 270.884 1.00 0.00 C +ATOM 71 CA ASN A 71 239.492 259.595 273.744 1.00 0.00 C +ATOM 72 CA SER A 72 243.153 260.480 274.319 1.00 0.00 C +ATOM 73 CA PRO A 73 243.308 263.637 276.447 1.00 0.00 C +ATOM 74 CA SER A 74 244.175 262.526 279.987 1.00 0.00 C +ATOM 75 CA PRO A 75 241.341 260.387 281.369 1.00 0.00 C +ATOM 76 CA THR A 76 237.934 261.655 280.230 1.00 0.00 C +ATOM 77 CA PHE A 77 237.147 264.432 277.743 1.00 0.00 C +ATOM 78 CA LYS A 78 237.586 266.125 274.359 1.00 0.00 C +ATOM 79 CA SER A 79 237.859 269.292 272.258 1.00 0.00 C +ATOM 80 CA PRO A 80 237.136 272.214 269.922 1.00 0.00 C +ATOM 81 CA ASN A 81 237.964 270.931 266.432 1.00 0.00 C +ATOM 82 CA ASN A 82 241.281 269.057 266.516 1.00 0.00 C +ATOM 83 CA SER A 83 244.244 266.831 265.634 1.00 0.00 C +ATOM 84 CA PRO A 84 246.052 263.488 265.902 1.00 0.00 C +ATOM 85 CA LEU A 85 246.943 261.470 269.009 1.00 0.00 C +ATOM 86 CA ASN A 86 250.597 260.757 269.817 1.00 0.00 C +ATOM 87 CA LYS A 87 252.529 260.336 266.560 1.00 0.00 C +ATOM 88 CA ALA A 88 252.284 259.949 262.777 1.00 0.00 C +ATOM 89 CA PRO A 89 254.862 257.342 261.742 1.00 0.00 C +ATOM 90 CA ILE A 90 257.082 255.293 259.420 1.00 0.00 C +ATOM 91 CA PHE A 91 260.426 254.088 258.047 1.00 0.00 C +ATOM 92 CA GLU A 92 263.057 256.843 258.119 1.00 0.00 C +ATOM 93 CA SER A 93 262.923 259.369 255.270 1.00 0.00 C +ATOM 94 CA PRO A 94 266.271 259.172 253.464 1.00 0.00 C +ATOM 95 CA ASN A 95 266.313 259.768 249.701 1.00 0.00 C +ATOM 96 CA ASN A 96 265.477 256.617 247.730 1.00 0.00 C +ATOM 97 CA THR A 97 262.783 254.066 246.864 1.00 0.00 C +ATOM 98 CA PRO A 98 259.582 255.261 245.177 1.00 0.00 C +ATOM 99 CA SER A 99 256.615 255.840 242.859 1.00 0.00 C +ATOM 100 CA PRO A 100 254.622 256.031 239.617 1.00 0.00 C +ATOM 101 CA VAL A 101 253.120 252.728 238.453 1.00 0.00 C +ATOM 102 CA PHE A 102 251.595 249.712 236.694 1.00 0.00 C +ATOM 103 CA GLU A 103 250.381 246.467 235.109 1.00 0.00 C +ATOM 104 CA SER A 104 251.641 243.333 233.346 1.00 0.00 C +ATOM 105 CA PRO A 105 251.726 240.394 230.923 1.00 0.00 C +ATOM 106 CA ASN A 106 248.736 238.033 230.972 1.00 0.00 C +ATOM 107 CA LYS A 107 245.000 237.969 230.225 1.00 0.00 C +ATOM 108 CA THR A 108 241.637 239.410 231.287 1.00 0.00 C +ATOM 109 CA PRO A 109 240.958 240.738 234.793 1.00 0.00 C +ATOM 110 CA SER A 110 242.822 243.734 236.229 1.00 0.00 C +ATOM 111 CA PRO A 111 242.716 244.667 239.921 1.00 0.00 C +ATOM 112 CA VAL A 112 241.013 247.606 241.647 1.00 0.00 C +ATOM 113 CA PHE A 113 237.946 247.953 243.880 1.00 0.00 C +ATOM 114 CA LYS A 114 234.905 249.922 245.061 1.00 0.00 C +ATOM 115 CA SER A 115 231.433 249.630 246.601 1.00 0.00 C +ATOM 116 CA PRO A 116 230.043 252.660 248.446 1.00 0.00 C +ATOM 117 CA SER A 117 231.711 255.804 247.086 1.00 0.00 C +ATOM 118 CA ASN A 118 235.382 256.675 247.619 1.00 0.00 C +ATOM 119 CA SER A 119 237.998 259.405 248.090 1.00 0.00 C +ATOM 120 CA PRO A 120 240.658 260.213 245.485 1.00 0.00 C +ATOM 121 CA SER A 121 242.540 261.109 242.296 1.00 0.00 C +ATOM 122 CA PRO A 122 245.954 259.454 242.640 1.00 0.00 C +ATOM 123 CA ALA A 123 248.725 259.178 240.040 1.00 0.00 C +ATOM 124 CA PHE A 124 249.840 260.751 236.753 1.00 0.00 C +ATOM 125 CA LYS A 125 247.476 262.535 234.356 1.00 0.00 C +ATOM 126 CA SER A 126 245.180 265.571 234.203 1.00 0.00 C +ATOM 127 CA PRO A 127 241.632 266.933 234.471 1.00 0.00 C +ATOM 128 CA ASN A 128 239.952 269.966 232.892 1.00 0.00 C +ATOM 129 CA ASN A 129 236.426 271.390 232.645 1.00 0.00 C +ATOM 130 CA SER A 130 233.576 273.568 233.930 1.00 0.00 C +ATOM 131 CA PRO A 131 231.974 276.517 232.126 1.00 0.00 C +ATOM 132 CA LEU A 132 232.710 279.250 229.577 1.00 0.00 C +ATOM 133 CA ASN A 133 234.083 282.331 227.804 1.00 0.00 C +ATOM 134 CA LYS A 134 231.235 284.416 226.370 1.00 0.00 C +ATOM 135 CA ALA A 135 227.864 282.943 225.380 1.00 0.00 C +ATOM 136 CA PRO A 136 225.625 281.164 227.898 1.00 0.00 C +ATOM 137 CA VAL A 137 225.974 282.227 231.540 1.00 0.00 C +ATOM 138 CA PHE A 138 223.724 280.523 234.099 1.00 0.00 C +ATOM 139 CA GLU A 139 221.663 279.360 237.085 1.00 0.00 C +ATOM 140 CA SER A 140 218.693 277.416 235.698 1.00 0.00 C +ATOM 141 CA PRO A 141 215.880 279.907 235.067 1.00 0.00 C +ATOM 142 CA ASN A 142 214.580 283.314 233.963 1.00 0.00 C +ATOM 143 CA LYS A 143 217.330 285.901 233.457 1.00 0.00 C +ATOM 144 CA THR A 144 220.988 286.677 234.189 1.00 0.00 C +ATOM 145 CA PRO A 145 222.217 289.957 235.687 1.00 0.00 C +ATOM 146 CA SER A 146 220.503 293.327 235.213 1.00 0.00 C +ATOM 147 CA PRO A 147 218.502 296.544 235.616 1.00 0.00 C +ATOM 148 CA VAL A 148 215.886 297.986 233.251 1.00 0.00 C +ATOM 149 CA PHE A 149 212.971 297.991 230.797 1.00 0.00 C +ATOM 150 CA GLU A 150 212.943 300.861 228.291 1.00 0.00 C +ATOM 151 CA SER A 151 214.544 301.154 224.846 1.00 0.00 C +ATOM 152 CA PRO A 152 217.438 299.276 223.230 1.00 0.00 C +ATOM 153 CA ASN A 153 218.382 297.113 220.239 1.00 0.00 C +ATOM 154 CA ASN A 154 218.188 295.532 216.777 1.00 0.00 C +ATOM 155 CA SER A 155 221.070 294.131 214.717 1.00 0.00 C +ATOM 156 CA PRO A 156 223.545 292.577 212.272 1.00 0.00 C +ATOM 157 CA PHE A 157 222.594 293.375 208.670 1.00 0.00 C +ATOM 158 CA LYS A 158 223.018 290.210 206.591 1.00 0.00 C +ATOM 159 CA ALA A 159 224.993 287.046 205.816 1.00 0.00 C +ATOM 160 CA PRO A 160 223.077 284.962 203.266 1.00 0.00 C +ATOM 161 CA TYR A 161 221.791 281.402 202.834 1.00 0.00 C +ATOM 162 CA GLY A 162 222.715 280.309 199.303 1.00 0.00 C +ATOM 163 CA THR A 163 224.898 283.075 197.853 1.00 0.00 C +ATOM 164 CA PRO A 164 228.117 284.979 197.126 1.00 0.00 C +ATOM 165 CA ASN A 165 228.887 288.660 196.519 1.00 0.00 C +TER 166 ASN A 165 +END diff --git a/Plants/Q850S0/Q850S0.dcd b/Plants/Q850S0/Q850S0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..5842116e9b76e470cd67834da4e7a2b1057df126 --- /dev/null +++ b/Plants/Q850S0/Q850S0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2172a8a355dee0d0f0c0c7f0102de45ceb5a784f9ad332bc641b8acf57ff336b +size 15200276 diff --git a/Plants/Q850S0/top.pdb b/Plants/Q850S0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..0d2acac90f6501df6e33495c65fe65f857b5fd19 --- /dev/null +++ b/Plants/Q850S0/top.pdb @@ -0,0 +1,124 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 239.255 310.073 269.041 1.00 0.00 C +ATOM 2 CA ASP A 2 236.043 311.872 268.060 1.00 0.00 C +ATOM 3 CA ASP A 3 232.437 310.855 267.368 1.00 0.00 C +ATOM 4 CA ASP A 4 230.381 309.669 264.388 1.00 0.00 C +ATOM 5 CA ASP A 5 232.844 309.696 261.482 1.00 0.00 C +ATOM 6 CA ASP A 6 234.526 310.813 258.251 1.00 0.00 C +ATOM 7 CA VAL A 7 232.964 313.159 255.688 1.00 0.00 C +ATOM 8 CA SER A 8 235.864 314.369 253.532 1.00 0.00 C +ATOM 9 CA GLY A 9 238.630 311.803 253.009 1.00 0.00 C +ATOM 10 CA ASP A 10 240.332 308.506 253.877 1.00 0.00 C +ATOM 11 CA VAL A 11 241.380 307.819 257.475 1.00 0.00 C +ATOM 12 CA THR A 12 241.118 305.255 260.281 1.00 0.00 C +ATOM 13 CA THR A 13 242.721 302.992 262.893 1.00 0.00 C +ATOM 14 CA GLY A 14 245.891 301.368 261.539 1.00 0.00 C +ATOM 15 CA GLY A 15 245.750 301.699 257.746 1.00 0.00 C +ATOM 16 CA GLY A 16 245.368 298.934 255.153 1.00 0.00 C +ATOM 17 CA SER A 17 243.362 298.976 251.914 1.00 0.00 C +ATOM 18 CA SER A 18 242.854 297.185 248.590 1.00 0.00 C +ATOM 19 CA VAL A 19 245.877 295.102 247.570 1.00 0.00 C +ATOM 20 CA GLN A 20 246.638 292.256 249.985 1.00 0.00 C +ATOM 21 CA LEU A 21 246.067 288.920 251.734 1.00 0.00 C +ATOM 22 CA ALA A 22 247.327 285.366 251.190 1.00 0.00 C +ATOM 23 CA GLY A 23 246.049 282.392 249.181 1.00 0.00 C +ATOM 24 CA GLU A 24 244.920 280.727 245.945 1.00 0.00 C +ATOM 25 CA ARG A 25 242.935 277.480 246.131 1.00 0.00 C +ATOM 26 CA ARG A 26 239.987 275.101 245.723 1.00 0.00 C +ATOM 27 CA ARG A 27 237.714 275.058 248.780 1.00 0.00 C +ATOM 28 CA ASP A 28 237.321 277.979 251.195 1.00 0.00 C +ATOM 29 CA GLY A 29 236.817 280.458 254.043 1.00 0.00 C +ATOM 30 CA THR A 30 234.071 282.781 252.787 1.00 0.00 C +ATOM 31 CA ASN A 31 230.861 281.576 254.449 1.00 0.00 C +ATOM 32 CA GLY A 32 228.930 278.621 253.016 1.00 0.00 C +ATOM 33 CA GLY A 33 225.346 279.171 254.186 1.00 0.00 C +ATOM 34 CA HIS A 34 222.162 280.795 252.865 1.00 0.00 C +ATOM 35 CA GLN A 35 219.093 282.177 254.650 1.00 0.00 C +ATOM 36 CA HIS A 36 217.647 285.332 253.078 1.00 0.00 C +ATOM 37 CA VAL A 37 219.613 288.452 252.120 1.00 0.00 C +ATOM 38 CA GLU A 38 221.999 287.615 249.271 1.00 0.00 C +ATOM 39 CA GLY A 39 220.997 285.142 246.551 1.00 0.00 C +ATOM 40 CA ASP A 40 222.328 283.013 243.685 1.00 0.00 C +ATOM 41 CA ALA A 41 222.400 279.280 244.443 1.00 0.00 C +ATOM 42 CA ALA A 42 225.243 277.162 245.838 1.00 0.00 C +ATOM 43 CA ASN A 43 227.386 274.441 247.426 1.00 0.00 C +ATOM 44 CA SER A 44 230.793 273.491 248.842 1.00 0.00 C +ATOM 45 CA PRO A 45 232.366 270.254 247.590 1.00 0.00 C +ATOM 46 CA VAL A 46 232.730 268.836 244.073 1.00 0.00 C +ATOM 47 CA THR A 47 234.338 265.784 242.456 1.00 0.00 C +ATOM 48 CA LYS A 48 234.147 264.501 238.873 1.00 0.00 C +ATOM 49 CA THR A 49 233.007 263.061 235.535 1.00 0.00 C +ATOM 50 CA THR A 50 230.944 259.859 235.453 1.00 0.00 C +ATOM 51 CA ALA A 51 228.649 260.152 232.425 1.00 0.00 C +ATOM 52 CA GLU A 52 225.619 258.279 231.074 1.00 0.00 C +ATOM 53 CA ASP A 53 226.471 254.607 230.518 1.00 0.00 C +ATOM 54 CA PRO A 54 227.045 251.288 232.299 1.00 0.00 C +ATOM 55 CA ARG A 55 224.289 248.730 232.910 1.00 0.00 C +ATOM 56 CA THR A 56 225.129 246.784 236.076 1.00 0.00 C +ATOM 57 CA ALA A 57 227.507 249.007 238.056 1.00 0.00 C +ATOM 58 CA THR A 58 231.085 247.701 237.972 1.00 0.00 C +ATOM 59 CA THR A 59 232.957 245.852 235.217 1.00 0.00 C +ATOM 60 CA SER A 60 235.433 246.834 232.492 1.00 0.00 C +ATOM 61 CA ARG A 61 239.125 247.197 233.359 1.00 0.00 C +ATOM 62 CA LYS A 62 242.614 248.727 233.395 1.00 0.00 C +ATOM 63 CA SER A 63 245.651 251.027 233.331 1.00 0.00 C +ATOM 64 CA GLY A 64 247.102 253.176 236.123 1.00 0.00 C +ATOM 65 CA GLY A 65 250.636 253.232 237.547 1.00 0.00 C +ATOM 66 CA ASP A 66 251.768 250.201 239.559 1.00 0.00 C +ATOM 67 CA ASP A 67 251.399 247.707 242.416 1.00 0.00 C +ATOM 68 CA ARG A 68 254.393 246.028 244.070 1.00 0.00 C +ATOM 69 CA LEU A 69 256.793 244.374 246.523 1.00 0.00 C +ATOM 70 CA ASP A 70 260.152 242.754 247.305 1.00 0.00 C +ATOM 71 CA ASP A 71 260.196 239.133 248.488 1.00 0.00 C +ATOM 72 CA ASP A 72 261.576 235.597 248.152 1.00 0.00 C +ATOM 73 CA GLY A 73 261.877 232.080 246.720 1.00 0.00 C +ATOM 74 CA GLY A 74 265.172 232.068 244.807 1.00 0.00 C +ATOM 75 CA VAL A 75 268.951 231.681 245.096 1.00 0.00 C +ATOM 76 CA SER A 76 271.293 228.812 245.993 1.00 0.00 C +ATOM 77 CA ALA A 77 274.142 227.669 248.249 1.00 0.00 C +ATOM 78 CA VAL A 78 273.598 224.918 250.828 1.00 0.00 C +ATOM 79 CA ASP A 79 273.621 221.256 251.878 1.00 0.00 C +ATOM 80 CA SER A 80 274.081 219.078 254.970 1.00 0.00 C +ATOM 81 CA ASP A 81 275.959 219.355 258.273 1.00 0.00 C +ATOM 82 CA GLY A 82 274.292 221.687 260.783 1.00 0.00 C +ATOM 83 CA GLU A 83 271.809 224.533 261.283 1.00 0.00 C +ATOM 84 CA GLY A 84 270.451 224.870 264.827 1.00 0.00 C +ATOM 85 CA ALA A 85 273.132 224.251 267.462 1.00 0.00 C +ATOM 86 CA ASP A 86 271.614 221.745 269.897 1.00 0.00 C +ATOM 87 CA ASP A 87 268.292 220.122 268.980 1.00 0.00 C +ATOM 88 CA ASP A 88 268.206 216.373 268.306 1.00 0.00 C +ATOM 89 CA GLY A 89 268.912 212.630 268.388 1.00 0.00 C +ATOM 90 CA ASP A 90 268.724 210.768 265.069 1.00 0.00 C +ATOM 91 CA ALA A 91 268.093 212.503 261.737 1.00 0.00 C +ATOM 92 CA THR A 92 270.388 213.837 259.004 1.00 0.00 C +ATOM 93 CA ALA A 93 273.289 212.866 256.733 1.00 0.00 C +ATOM 94 CA THR A 94 274.121 209.260 257.637 1.00 0.00 C +ATOM 95 CA THR A 95 276.776 208.646 260.300 1.00 0.00 C +ATOM 96 CA MET A 96 279.701 209.345 262.640 1.00 0.00 C +ATOM 97 CA ALA A 97 283.029 208.751 264.397 1.00 0.00 C +ATOM 98 CA THR A 98 286.540 208.136 263.050 1.00 0.00 C +ATOM 99 CA SER A 99 288.356 204.796 263.297 1.00 0.00 C +ATOM 100 CA PRO A 100 285.963 201.898 262.670 1.00 0.00 C +ATOM 101 CA SER A 101 283.931 201.410 259.484 1.00 0.00 C +ATOM 102 CA ASN A 102 280.803 200.219 257.664 1.00 0.00 C +ATOM 103 CA GLY A 103 278.940 197.041 256.691 1.00 0.00 C +ATOM 104 CA ASP A 104 278.827 193.890 254.553 1.00 0.00 C +ATOM 105 CA ASP A 105 276.508 190.895 254.966 1.00 0.00 C +ATOM 106 CA TRP A 106 274.153 189.628 252.252 1.00 0.00 C +ATOM 107 CA SER A 107 270.628 188.907 250.999 1.00 0.00 C +ATOM 108 CA ASP A 108 268.862 192.280 250.848 1.00 0.00 C +ATOM 109 CA GLY A 109 267.597 193.885 247.633 1.00 0.00 C +ATOM 110 CA GLY A 110 265.762 194.658 244.384 1.00 0.00 C +ATOM 111 CA THR A 111 264.889 197.418 241.907 1.00 0.00 C +ATOM 112 CA ARG A 112 263.397 196.946 238.433 1.00 0.00 C +ATOM 113 CA LEU A 113 260.663 199.242 237.104 1.00 0.00 C +ATOM 114 CA GLU A 114 258.667 202.468 237.461 1.00 0.00 C +ATOM 115 CA ARG A 115 255.658 204.805 237.450 1.00 0.00 C +ATOM 116 CA ARG A 116 253.535 207.891 238.144 1.00 0.00 C +ATOM 117 CA ARG A 117 250.899 210.629 238.416 1.00 0.00 C +ATOM 118 CA ARG A 118 247.397 209.160 238.725 1.00 0.00 C +ATOM 119 CA ARG A 119 246.672 205.429 238.995 1.00 0.00 C +ATOM 120 CA ARG A 120 246.466 203.654 242.360 1.00 0.00 C +TER 121 ARG A 120 +END diff --git a/Plants/Q850T4/Q850T4.dcd b/Plants/Q850T4/Q850T4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..c92914df55f05854c676f51ace358c646cf66318 --- /dev/null +++ b/Plants/Q850T4/Q850T4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:914c291b5f22d2185012ed195889a7f63babf7511d7b28c04ee62f961b20e26d +size 14960276 diff --git a/Plants/Q850T4/top.pdb b/Plants/Q850T4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..23e025e73d5b115ce565ecdc30f4a11b0a814151 --- /dev/null +++ b/Plants/Q850T4/top.pdb @@ -0,0 +1,122 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 203.240 215.982 286.564 1.00 0.00 C +ATOM 2 CA THR A 2 205.255 213.252 284.831 1.00 0.00 C +ATOM 3 CA SER A 3 207.246 211.517 282.084 1.00 0.00 C +ATOM 4 CA SER A 4 209.392 214.249 280.520 1.00 0.00 C +ATOM 5 CA PRO A 5 211.971 215.634 278.081 1.00 0.00 C +ATOM 6 CA ALA A 6 214.878 217.328 279.869 1.00 0.00 C +ATOM 7 CA THR A 7 217.495 219.995 280.614 1.00 0.00 C +ATOM 8 CA ALA A 8 220.141 222.430 279.355 1.00 0.00 C +ATOM 9 CA ARG A 9 219.915 225.659 281.365 1.00 0.00 C +ATOM 10 CA PRO A 10 222.646 226.940 283.693 1.00 0.00 C +ATOM 11 CA ARG A 11 226.100 225.732 284.752 1.00 0.00 C +ATOM 12 CA VAL A 12 227.224 222.114 284.346 1.00 0.00 C +ATOM 13 CA LEU A 13 228.863 221.647 280.939 1.00 0.00 C +ATOM 14 CA ALA A 14 232.653 221.954 281.172 1.00 0.00 C +ATOM 15 CA GLY A 15 234.567 220.487 278.222 1.00 0.00 C +ATOM 16 CA GLU A 16 236.827 218.216 276.160 1.00 0.00 C +ATOM 17 CA ARG A 17 240.137 218.278 274.275 1.00 0.00 C +ATOM 18 CA ARG A 18 243.618 219.786 273.922 1.00 0.00 C +ATOM 19 CA HIS A 19 244.885 223.273 273.056 1.00 0.00 C +ATOM 20 CA ASP A 20 247.628 225.213 271.259 1.00 0.00 C +ATOM 21 CA SER A 21 247.310 228.940 271.983 1.00 0.00 C +ATOM 22 CA ALA A 22 249.349 231.875 270.663 1.00 0.00 C +ATOM 23 CA ASN A 23 253.055 232.692 271.000 1.00 0.00 C +ATOM 24 CA GLY A 24 254.625 235.445 268.885 1.00 0.00 C +ATOM 25 CA GLY A 25 252.994 238.857 268.423 1.00 0.00 C +ATOM 26 CA HIS A 26 250.680 239.727 265.524 1.00 0.00 C +ATOM 27 CA GLN A 27 247.046 239.111 264.556 1.00 0.00 C +ATOM 28 CA HIS A 28 245.547 235.608 264.519 1.00 0.00 C +ATOM 29 CA VAL A 29 248.396 233.205 263.729 1.00 0.00 C +ATOM 30 CA GLU A 30 247.400 231.183 260.657 1.00 0.00 C +ATOM 31 CA GLY A 31 246.381 228.012 258.808 1.00 0.00 C +ATOM 32 CA ASP A 32 243.959 225.956 256.704 1.00 0.00 C +ATOM 33 CA ALA A 33 243.373 223.293 254.044 1.00 0.00 C +ATOM 34 CA ALA A 34 244.911 222.934 250.577 1.00 0.00 C +ATOM 35 CA ASN A 35 248.558 221.833 250.648 1.00 0.00 C +ATOM 36 CA SER A 36 251.817 220.079 251.554 1.00 0.00 C +ATOM 37 CA PRO A 37 254.265 220.462 248.659 1.00 0.00 C +ATOM 38 CA VAL A 38 253.002 218.964 245.391 1.00 0.00 C +ATOM 39 CA THR A 39 250.161 221.017 243.899 1.00 0.00 C +ATOM 40 CA LYS A 40 250.686 221.240 240.132 1.00 0.00 C +ATOM 41 CA THR A 41 248.708 221.111 236.878 1.00 0.00 C +ATOM 42 CA THR A 42 247.880 223.288 233.863 1.00 0.00 C +ATOM 43 CA ALA A 43 247.282 227.013 233.329 1.00 0.00 C +ATOM 44 CA GLU A 44 247.314 230.375 231.538 1.00 0.00 C +ATOM 45 CA ASP A 45 250.083 230.692 228.940 1.00 0.00 C +ATOM 46 CA GLN A 46 252.586 228.403 227.206 1.00 0.00 C +ATOM 47 CA ARG A 47 255.998 229.736 228.253 1.00 0.00 C +ATOM 48 CA THR A 48 259.431 229.015 226.767 1.00 0.00 C +ATOM 49 CA ALA A 49 261.968 230.947 228.852 1.00 0.00 C +ATOM 50 CA THR A 50 262.496 229.905 232.479 1.00 0.00 C +ATOM 51 CA ALA A 51 260.437 227.208 234.212 1.00 0.00 C +ATOM 52 CA SER A 52 257.137 225.329 233.907 1.00 0.00 C +ATOM 53 CA ARG A 53 253.966 227.441 233.942 1.00 0.00 C +ATOM 54 CA LYS A 54 253.459 230.273 236.439 1.00 0.00 C +ATOM 55 CA SER A 55 253.366 234.048 236.944 1.00 0.00 C +ATOM 56 CA GLY A 56 253.923 235.947 233.688 1.00 0.00 C +ATOM 57 CA GLY A 57 254.967 237.668 230.453 1.00 0.00 C +ATOM 58 CA ASP A 58 257.151 239.565 227.973 1.00 0.00 C +ATOM 59 CA ASP A 59 258.210 243.203 227.577 1.00 0.00 C +ATOM 60 CA ARG A 60 260.539 246.218 227.620 1.00 0.00 C +ATOM 61 CA LEU A 61 261.816 249.622 228.759 1.00 0.00 C +ATOM 62 CA ASP A 62 262.893 251.966 231.563 1.00 0.00 C +ATOM 63 CA ASP A 63 265.660 254.277 230.331 1.00 0.00 C +ATOM 64 CA ASP A 64 265.925 257.909 231.451 1.00 0.00 C +ATOM 65 CA GLY A 65 267.922 261.148 231.641 1.00 0.00 C +ATOM 66 CA GLY A 66 271.355 260.652 233.217 1.00 0.00 C +ATOM 67 CA VAL A 67 274.049 263.277 233.822 1.00 0.00 C +ATOM 68 CA PRO A 68 275.221 266.009 236.205 1.00 0.00 C +ATOM 69 CA ALA A 69 274.737 269.736 235.582 1.00 0.00 C +ATOM 70 CA VAL A 70 273.610 273.082 237.015 1.00 0.00 C +ATOM 71 CA ASP A 71 270.552 273.766 239.182 1.00 0.00 C +ATOM 72 CA SER A 72 268.752 277.041 239.926 1.00 0.00 C +ATOM 73 CA ASP A 73 267.568 279.944 242.091 1.00 0.00 C +ATOM 74 CA GLY A 74 266.492 282.225 244.946 1.00 0.00 C +ATOM 75 CA GLY A 75 266.633 286.033 244.980 1.00 0.00 C +ATOM 76 CA GLY A 76 266.533 287.103 248.636 1.00 0.00 C +ATOM 77 CA ALA A 77 265.605 289.052 251.775 1.00 0.00 C +ATOM 78 CA ASP A 78 261.986 290.016 252.473 1.00 0.00 C +ATOM 79 CA GLU A 79 262.237 293.422 254.162 1.00 0.00 C +ATOM 80 CA ASP A 80 259.780 294.019 257.012 1.00 0.00 C +ATOM 81 CA GLY A 81 256.580 292.150 256.129 1.00 0.00 C +ATOM 82 CA ASP A 82 253.749 291.336 258.545 1.00 0.00 C +ATOM 83 CA ALA A 83 253.194 288.351 260.847 1.00 0.00 C +ATOM 84 CA THR A 84 254.791 284.927 260.352 1.00 0.00 C +ATOM 85 CA ALA A 85 255.741 281.247 260.617 1.00 0.00 C +ATOM 86 CA THR A 86 253.686 278.387 259.163 1.00 0.00 C +ATOM 87 CA THR A 87 250.131 277.180 259.810 1.00 0.00 C +ATOM 88 CA THR A 88 249.008 274.221 261.933 1.00 0.00 C +ATOM 89 CA ALA A 89 250.749 270.853 261.557 1.00 0.00 C +ATOM 90 CA ALA A 90 250.960 267.624 259.546 1.00 0.00 C +ATOM 91 CA PHE A 91 250.126 268.656 255.975 1.00 0.00 C +ATOM 92 CA PRO A 92 247.383 267.663 253.524 1.00 0.00 C +ATOM 93 CA SER A 93 245.306 267.067 250.386 1.00 0.00 C +ATOM 94 CA ASP A 94 244.393 268.725 247.080 1.00 0.00 C +ATOM 95 CA ASP A 95 241.649 271.359 246.855 1.00 0.00 C +ATOM 96 CA ASP A 96 240.685 273.944 244.228 1.00 0.00 C +ATOM 97 CA ASP A 97 241.194 277.687 243.727 1.00 0.00 C +ATOM 98 CA TRP A 98 238.713 280.466 244.527 1.00 0.00 C +ATOM 99 CA SER A 99 238.816 283.691 242.501 1.00 0.00 C +ATOM 100 CA ASP A 100 240.428 285.027 239.318 1.00 0.00 C +ATOM 101 CA GLY A 101 243.748 286.811 239.875 1.00 0.00 C +ATOM 102 CA ASP A 102 247.337 287.730 240.762 1.00 0.00 C +ATOM 103 CA ALA A 103 249.999 285.184 239.786 1.00 0.00 C +ATOM 104 CA ARG A 104 251.757 286.309 236.599 1.00 0.00 C +ATOM 105 CA LEU A 105 254.779 284.576 235.057 1.00 0.00 C +ATOM 106 CA GLU A 106 257.403 281.821 234.847 1.00 0.00 C +ATOM 107 CA ARG A 107 259.530 278.682 235.217 1.00 0.00 C +ATOM 108 CA ARG A 108 262.362 276.910 237.049 1.00 0.00 C +ATOM 109 CA ARG A 109 264.361 273.781 236.193 1.00 0.00 C +ATOM 110 CA ARG A 110 263.213 270.931 233.940 1.00 0.00 C +ATOM 111 CA ARG A 111 261.445 267.773 232.751 1.00 0.00 C +ATOM 112 CA ARG A 112 261.766 264.177 231.533 1.00 0.00 C +ATOM 113 CA ARG A 113 261.342 261.398 228.961 1.00 0.00 C +ATOM 114 CA GLU A 114 259.510 258.088 229.418 1.00 0.00 C +ATOM 115 CA ALA A 115 257.690 255.436 231.459 1.00 0.00 C +ATOM 116 CA THR A 116 254.460 256.810 232.941 1.00 0.00 C +ATOM 117 CA ARG A 117 253.059 256.672 236.481 1.00 0.00 C +ATOM 118 CA CYS A 118 254.536 258.550 239.449 1.00 0.00 C +TER 119 CYS A 118 +END diff --git a/Plants/Q851A8/Q851A8.dcd b/Plants/Q851A8/Q851A8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..8723fe14b6741d2fdb59aff3cc46d73e9801dd91 --- /dev/null +++ b/Plants/Q851A8/Q851A8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:7db96bf10e1921f01ee32b9fae34df3faafd8ce4d47c97760f3228d464b06f8b +size 6200276 diff --git a/Plants/Q851A8/top.pdb b/Plants/Q851A8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..8c59ebb52a38db537037c98187171e8b82f0b41e --- /dev/null +++ b/Plants/Q851A8/top.pdb @@ -0,0 +1,49 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 215.445 202.602 250.115 1.00 0.00 C +ATOM 2 CA GLY A 2 214.122 206.136 250.636 1.00 0.00 C +ATOM 3 CA GLY A 3 215.132 208.440 247.775 1.00 0.00 C +ATOM 4 CA GLY A 4 217.095 210.812 245.530 1.00 0.00 C +ATOM 5 CA GLU A 5 217.314 214.041 247.541 1.00 0.00 C +ATOM 6 CA GLY A 6 220.360 214.506 249.782 1.00 0.00 C +ATOM 7 CA LYS A 7 222.625 217.495 249.110 1.00 0.00 C +ATOM 8 CA LEU A 8 221.687 221.133 248.476 1.00 0.00 C +ATOM 9 CA ALA A 9 221.251 224.765 247.411 1.00 0.00 C +ATOM 10 CA MET A 10 222.635 227.885 245.717 1.00 0.00 C +ATOM 11 CA THR A 11 225.977 229.647 245.223 1.00 0.00 C +ATOM 12 CA MET A 12 228.813 232.180 244.980 1.00 0.00 C +ATOM 13 CA THR A 13 232.402 233.375 244.522 1.00 0.00 C +ATOM 14 CA PRO A 14 235.716 233.038 246.371 1.00 0.00 C +ATOM 15 CA VAL A 15 236.302 234.838 249.678 1.00 0.00 C +ATOM 16 CA ASN A 16 235.751 237.449 252.397 1.00 0.00 C +ATOM 17 CA ASP A 17 238.167 240.244 253.328 1.00 0.00 C +ATOM 18 CA ASP A 18 239.299 242.710 250.653 1.00 0.00 C +ATOM 19 CA GLU A 19 242.476 244.801 250.416 1.00 0.00 C +ATOM 20 CA TYR A 20 242.109 248.575 250.789 1.00 0.00 C +ATOM 21 CA ALA A 21 242.910 250.234 247.454 1.00 0.00 C +ATOM 22 CA GLN A 22 246.565 250.935 246.637 1.00 0.00 C +ATOM 23 CA PRO A 23 248.015 250.550 243.135 1.00 0.00 C +ATOM 24 CA TRP A 24 251.422 252.164 242.582 1.00 0.00 C +ATOM 25 CA ARG A 25 254.104 254.700 241.639 1.00 0.00 C +ATOM 26 CA ARG A 26 257.345 256.693 241.443 1.00 0.00 C +ATOM 27 CA LYS A 27 259.925 257.361 244.166 1.00 0.00 C +ATOM 28 CA ASN A 28 262.644 259.098 246.193 1.00 0.00 C +ATOM 29 CA GLN A 29 262.215 258.776 249.965 1.00 0.00 C +ATOM 30 CA SER A 30 263.782 260.737 252.832 1.00 0.00 C +ATOM 31 CA ALA A 31 265.205 264.230 252.293 1.00 0.00 C +ATOM 32 CA SER A 32 269.013 264.299 252.389 1.00 0.00 C +ATOM 33 CA ASP A 33 270.135 267.831 251.505 1.00 0.00 C +ATOM 34 CA LYS A 34 269.642 269.981 254.611 1.00 0.00 C +ATOM 35 CA ALA A 35 271.445 272.491 256.840 1.00 0.00 C +ATOM 36 CA ALA A 36 275.012 272.597 255.505 1.00 0.00 C +ATOM 37 CA ASN A 37 275.930 275.809 253.673 1.00 0.00 C +ATOM 38 CA ASN A 38 278.484 278.536 252.927 1.00 0.00 C +ATOM 39 CA GLU A 39 282.259 278.340 253.405 1.00 0.00 C +ATOM 40 CA ASP A 40 283.951 281.573 254.500 1.00 0.00 C +ATOM 41 CA ASP A 41 281.271 284.223 255.062 1.00 0.00 C +ATOM 42 CA ASP A 42 280.422 287.693 256.385 1.00 0.00 C +ATOM 43 CA VAL A 43 282.055 291.097 255.866 1.00 0.00 C +ATOM 44 CA HIS A 44 285.334 291.694 257.711 1.00 0.00 C +ATOM 45 CA GLN A 45 286.236 293.685 260.831 1.00 0.00 C +TER 46 GLN A 45 +END diff --git a/Plants/Q851I7/Q851I7.dcd b/Plants/Q851I7/Q851I7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..2c927ce50d035c0754ddcedd33c7dd8ae5b483eb --- /dev/null +++ b/Plants/Q851I7/Q851I7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:161227c94e5062aabd7f9f3414539a21ec7dc0d3aabdea1701b784ca78de9be1 +size 8600276 diff --git a/Plants/Q851I7/top.pdb b/Plants/Q851I7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..b8caa0dc71a0a290e78ef1c6f578ff452e2b7dbc --- /dev/null +++ b/Plants/Q851I7/top.pdb @@ -0,0 +1,69 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 252.001 244.150 281.783 1.00 0.00 C +ATOM 2 CA GLY A 2 251.285 245.772 278.411 1.00 0.00 C +ATOM 3 CA LYS A 3 251.672 246.006 274.628 1.00 0.00 C +ATOM 4 CA GLN A 4 254.021 243.549 272.906 1.00 0.00 C +ATOM 5 CA ARG A 5 254.794 240.506 275.064 1.00 0.00 C +ATOM 6 CA LEU A 6 257.635 239.136 277.202 1.00 0.00 C +ATOM 7 CA ALA A 7 260.973 239.802 275.489 1.00 0.00 C +ATOM 8 CA SER A 8 262.091 238.415 272.122 1.00 0.00 C +ATOM 9 CA SER A 9 261.775 236.086 269.123 1.00 0.00 C +ATOM 10 CA LEU A 10 261.376 236.967 265.438 1.00 0.00 C +ATOM 11 CA ARG A 11 264.556 238.737 264.308 1.00 0.00 C +ATOM 12 CA ASP A 12 268.340 238.313 264.441 1.00 0.00 C +ATOM 13 CA SER A 13 270.977 238.461 267.187 1.00 0.00 C +ATOM 14 CA ARG A 14 273.140 241.528 266.533 1.00 0.00 C +ATOM 15 CA GLU A 15 275.022 243.609 263.955 1.00 0.00 C +ATOM 16 CA ALA A 16 272.805 244.201 260.914 1.00 0.00 C +ATOM 17 CA GLY A 17 273.885 246.994 258.559 1.00 0.00 C +ATOM 18 CA GLU A 18 273.037 249.729 256.045 1.00 0.00 C +ATOM 19 CA LEU A 19 273.816 251.293 252.660 1.00 0.00 C +ATOM 20 CA VAL A 20 273.692 254.971 251.675 1.00 0.00 C +ATOM 21 CA ARG A 21 272.247 257.153 254.444 1.00 0.00 C +ATOM 22 CA GLY A 22 268.481 257.163 253.869 1.00 0.00 C +ATOM 23 CA GLY A 23 266.043 258.609 251.324 1.00 0.00 C +ATOM 24 CA ALA A 24 264.858 257.681 247.824 1.00 0.00 C +ATOM 25 CA PRO A 25 266.111 254.221 246.835 1.00 0.00 C +ATOM 26 CA SER A 26 263.521 251.760 245.510 1.00 0.00 C +ATOM 27 CA SER A 27 264.173 250.196 242.098 1.00 0.00 C +ATOM 28 CA GLY A 28 261.685 249.529 239.291 1.00 0.00 C +ATOM 29 CA LYS A 29 262.526 248.377 235.758 1.00 0.00 C +ATOM 30 CA ASP A 30 262.119 250.707 232.771 1.00 0.00 C +ATOM 31 CA ASN A 31 258.829 252.618 232.975 1.00 0.00 C +ATOM 32 CA LYS A 32 256.176 254.043 230.642 1.00 0.00 C +ATOM 33 CA GLU A 33 252.635 253.118 229.583 1.00 0.00 C +ATOM 34 CA GLY A 34 250.305 254.939 227.180 1.00 0.00 C +ATOM 35 CA ALA A 35 247.300 252.940 225.961 1.00 0.00 C +ATOM 36 CA GLN A 36 244.102 253.997 227.743 1.00 0.00 C +ATOM 37 CA GLN A 37 240.424 253.373 226.967 1.00 0.00 C +ATOM 38 CA ARG A 38 238.951 256.043 224.682 1.00 0.00 C +ATOM 39 CA CYS A 39 236.948 255.530 221.483 1.00 0.00 C +ATOM 40 CA GLN A 40 235.390 252.075 221.091 1.00 0.00 C +ATOM 41 CA PRO A 41 232.563 251.356 223.541 1.00 0.00 C +ATOM 42 CA VAL A 42 230.836 249.516 226.396 1.00 0.00 C +ATOM 43 CA VAL A 43 231.343 246.932 229.148 1.00 0.00 C +ATOM 44 CA THR A 44 234.673 245.285 228.300 1.00 0.00 C +ATOM 45 CA PRO A 45 237.450 245.539 230.896 1.00 0.00 C +ATOM 46 CA ASN A 46 239.574 243.574 233.375 1.00 0.00 C +ATOM 47 CA THR A 47 240.240 244.502 237.010 1.00 0.00 C +ATOM 48 CA HIS A 48 237.108 243.748 239.045 1.00 0.00 C +ATOM 49 CA TRP A 49 234.752 244.804 241.846 1.00 0.00 C +ATOM 50 CA HIS A 50 234.127 248.487 242.597 1.00 0.00 C +ATOM 51 CA LEU A 51 236.894 249.617 244.959 1.00 0.00 C +ATOM 52 CA CYS A 52 239.771 251.102 246.967 1.00 0.00 C +ATOM 53 CA ASP A 53 240.304 253.607 249.788 1.00 0.00 C +ATOM 54 CA GLY A 54 239.710 256.925 251.565 1.00 0.00 C +ATOM 55 CA THR A 55 238.653 260.283 250.108 1.00 0.00 C +ATOM 56 CA SER A 56 234.861 260.420 250.447 1.00 0.00 C +ATOM 57 CA VAL A 57 234.195 262.068 253.818 1.00 0.00 C +ATOM 58 CA SER A 58 236.131 261.333 257.016 1.00 0.00 C +ATOM 59 CA PRO A 59 234.612 258.309 258.767 1.00 0.00 C +ATOM 60 CA ARG A 60 232.122 255.864 260.295 1.00 0.00 C +ATOM 61 CA SER A 61 229.624 253.852 262.352 1.00 0.00 C +ATOM 62 CA GLY A 62 225.886 253.899 263.088 1.00 0.00 C +ATOM 63 CA LEU A 63 223.692 256.472 264.844 1.00 0.00 C +ATOM 64 CA LEU A 64 224.631 259.266 267.257 1.00 0.00 C +ATOM 65 CA HIS A 65 226.531 260.941 270.103 1.00 0.00 C +TER 66 HIS A 65 +END diff --git a/Plants/Q851N1/Q851N1.dcd b/Plants/Q851N1/Q851N1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..76f83356af6a48971c8c7b12b91f566690085a90 --- /dev/null +++ b/Plants/Q851N1/Q851N1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:b310d2b4d83cc4f3568333f9ba6cbbb2a8ef5699c0e98c394a1968388147c9d6 +size 44940276 diff --git a/Plants/Q851N1/top.pdb b/Plants/Q851N1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..2e2d7ea9d5819f3a589ca859ae71195ec5133159 --- /dev/null +++ b/Plants/Q851N1/top.pdb @@ -0,0 +1,247 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 234.148 291.110 248.253 1.00 0.00 C +ATOM 2 CA GLU A 2 236.698 292.874 246.039 1.00 0.00 C +ATOM 3 CA TRP A 3 235.738 296.393 244.938 1.00 0.00 C +ATOM 4 CA ARG A 4 232.123 296.844 246.054 1.00 0.00 C +ATOM 5 CA VAL A 5 230.757 300.308 246.860 1.00 0.00 C +ATOM 6 CA GLY A 6 231.795 301.263 250.399 1.00 0.00 C +ATOM 7 CA GLY A 7 231.866 305.072 250.436 1.00 0.00 C +ATOM 8 CA ARG A 8 229.856 308.121 251.521 1.00 0.00 C +ATOM 9 CA TRP A 9 231.790 310.980 253.132 1.00 0.00 C +ATOM 10 CA ALA A 10 230.534 312.068 256.561 1.00 0.00 C +ATOM 11 CA GLU A 11 228.555 315.299 256.956 1.00 0.00 C +ATOM 12 CA GLY A 12 224.829 316.001 257.328 1.00 0.00 C +ATOM 13 CA GLY A 13 221.938 318.398 256.684 1.00 0.00 C +ATOM 14 CA GLN A 14 218.606 319.911 257.745 1.00 0.00 C +ATOM 15 CA ARG A 15 217.100 323.374 257.239 1.00 0.00 C +ATOM 16 CA SER A 16 213.526 323.942 258.429 1.00 0.00 C +ATOM 17 CA GLY A 17 211.357 326.892 257.374 1.00 0.00 C +ATOM 18 CA ALA A 18 210.575 329.664 259.868 1.00 0.00 C +ATOM 19 CA GLN A 19 207.258 331.117 258.682 1.00 0.00 C +ATOM 20 CA ALA A 20 205.167 332.731 261.428 1.00 0.00 C +ATOM 21 CA ASP A 21 207.462 334.738 263.712 1.00 0.00 C +ATOM 22 CA THR A 22 210.603 335.556 265.707 1.00 0.00 C +ATOM 23 CA ARG A 23 213.291 332.876 265.378 1.00 0.00 C +ATOM 24 CA GLN A 24 216.935 332.343 264.401 1.00 0.00 C +ATOM 25 CA LYS A 25 219.027 335.391 263.482 1.00 0.00 C +ATOM 26 CA GLY A 26 221.772 334.262 261.093 1.00 0.00 C +ATOM 27 CA ARG A 27 220.667 331.094 259.289 1.00 0.00 C +ATOM 28 CA ALA A 28 222.061 327.667 260.199 1.00 0.00 C +ATOM 29 CA VAL A 29 224.440 326.476 257.472 1.00 0.00 C +ATOM 30 CA ALA A 30 223.091 327.305 254.007 1.00 0.00 C +ATOM 31 CA ALA A 31 222.805 330.363 251.753 1.00 0.00 C +ATOM 32 CA GLY A 32 226.059 332.117 250.827 1.00 0.00 C +ATOM 33 CA ALA A 33 226.114 335.816 249.917 1.00 0.00 C +ATOM 34 CA ARG A 34 229.136 337.302 248.136 1.00 0.00 C +ATOM 35 CA GLY A 35 230.278 340.608 249.649 1.00 0.00 C +ATOM 36 CA ARG A 36 233.120 340.485 252.183 1.00 0.00 C +ATOM 37 CA SER A 37 236.036 342.287 250.521 1.00 0.00 C +ATOM 38 CA LYS A 38 238.862 343.789 252.589 1.00 0.00 C +ATOM 39 CA ARG A 39 242.225 345.546 252.932 1.00 0.00 C +ATOM 40 CA THR A 40 244.980 343.144 251.858 1.00 0.00 C +ATOM 41 CA THR A 41 247.971 341.024 250.817 1.00 0.00 C +ATOM 42 CA SER A 42 248.984 337.356 251.002 1.00 0.00 C +ATOM 43 CA SER A 43 247.827 333.949 252.254 1.00 0.00 C +ATOM 44 CA THR A 44 246.677 330.738 253.951 1.00 0.00 C +ATOM 45 CA ALA A 45 247.008 328.338 256.892 1.00 0.00 C +ATOM 46 CA ALA A 46 245.119 326.765 259.802 1.00 0.00 C +ATOM 47 CA SER A 47 243.050 323.589 259.414 1.00 0.00 C +ATOM 48 CA ILE A 48 239.959 321.393 259.039 1.00 0.00 C +ATOM 49 CA VAL A 49 237.915 320.490 262.125 1.00 0.00 C +ATOM 50 CA GLY A 50 234.984 318.314 263.214 1.00 0.00 C +ATOM 51 CA ARG A 51 235.136 314.891 261.546 1.00 0.00 C +ATOM 52 CA ARG A 52 236.591 311.711 260.036 1.00 0.00 C +ATOM 53 CA ARG A 53 239.862 309.757 260.063 1.00 0.00 C +ATOM 54 CA GLY A 54 239.523 306.617 262.195 1.00 0.00 C +ATOM 55 CA GLU A 55 241.309 304.108 264.437 1.00 0.00 C +ATOM 56 CA ALA A 56 242.890 300.674 263.966 1.00 0.00 C +ATOM 57 CA GLU A 57 244.308 297.370 265.227 1.00 0.00 C +ATOM 58 CA ARG A 58 247.892 297.254 263.939 1.00 0.00 C +ATOM 59 CA ARG A 59 249.336 294.269 262.062 1.00 0.00 C +ATOM 60 CA ARG A 60 251.402 291.544 263.742 1.00 0.00 C +ATOM 61 CA GLY A 61 255.098 291.732 262.837 1.00 0.00 C +ATOM 62 CA SER A 62 257.168 294.240 260.852 1.00 0.00 C +ATOM 63 CA GLU A 63 256.875 296.930 258.169 1.00 0.00 C +ATOM 64 CA ALA A 64 255.708 295.272 254.943 1.00 0.00 C +ATOM 65 CA ALA A 65 257.103 291.864 253.965 1.00 0.00 C +ATOM 66 CA ALA A 66 256.940 288.078 254.353 1.00 0.00 C +ATOM 67 CA GLY A 67 257.260 284.544 255.740 1.00 0.00 C +ATOM 68 CA ARG A 68 259.237 281.580 254.390 1.00 0.00 C +ATOM 69 CA GLU A 69 256.901 279.526 252.190 1.00 0.00 C +ATOM 70 CA GLY A 70 254.071 277.544 253.796 1.00 0.00 C +ATOM 71 CA ARG A 71 252.335 274.807 255.798 1.00 0.00 C +ATOM 72 CA TRP A 72 253.510 274.151 259.363 1.00 0.00 C +ATOM 73 CA ASN A 73 253.909 276.492 262.342 1.00 0.00 C +ATOM 74 CA GLY A 74 256.118 278.278 264.882 1.00 0.00 C +ATOM 75 CA ALA A 75 258.447 281.176 265.713 1.00 0.00 C +ATOM 76 CA ARG A 76 261.991 279.840 265.302 1.00 0.00 C +ATOM 77 CA ALA A 77 261.944 276.174 266.339 1.00 0.00 C +ATOM 78 CA ALA A 78 263.525 272.868 267.383 1.00 0.00 C +ATOM 79 CA GLU A 79 265.570 269.697 267.909 1.00 0.00 C +ATOM 80 CA GLN A 80 268.684 268.609 266.002 1.00 0.00 C +ATOM 81 CA PRO A 81 272.256 269.929 265.901 1.00 0.00 C +ATOM 82 CA GLY A 82 274.875 271.812 267.930 1.00 0.00 C +ATOM 83 CA GLY A 83 277.661 274.161 266.819 1.00 0.00 C +ATOM 84 CA VAL A 84 277.170 277.934 267.030 1.00 0.00 C +ATOM 85 CA GLY A 85 277.588 281.083 264.928 1.00 0.00 C +ATOM 86 CA ARG A 86 279.037 283.911 267.031 1.00 0.00 C +ATOM 87 CA ARG A 87 281.527 282.229 269.373 1.00 0.00 C +ATOM 88 CA VAL A 88 283.013 279.201 267.601 1.00 0.00 C +ATOM 89 CA LEU A 89 282.771 276.898 264.576 1.00 0.00 C +ATOM 90 CA GLU A 90 283.360 273.167 265.078 1.00 0.00 C +ATOM 91 CA LEU A 91 284.069 269.630 263.854 1.00 0.00 C +ATOM 92 CA ALA A 92 280.834 267.631 263.615 1.00 0.00 C +ATOM 93 CA ASP A 93 280.927 265.483 260.470 1.00 0.00 C +ATOM 94 CA GLY A 94 283.124 262.536 259.464 1.00 0.00 C +ATOM 95 CA ARG A 95 281.813 259.361 261.112 1.00 0.00 C +ATOM 96 CA ARG A 96 282.961 255.793 261.792 1.00 0.00 C +ATOM 97 CA HIS A 97 282.336 253.529 258.792 1.00 0.00 C +ATOM 98 CA LYS A 98 281.570 250.616 256.459 1.00 0.00 C +ATOM 99 CA THR A 99 278.635 248.382 255.504 1.00 0.00 C +ATOM 100 CA ALA A 100 275.367 246.646 254.597 1.00 0.00 C +ATOM 101 CA ALA A 101 273.646 248.763 251.938 1.00 0.00 C +ATOM 102 CA THR A 102 273.676 252.503 252.663 1.00 0.00 C +ATOM 103 CA THR A 103 275.547 254.991 250.467 1.00 0.00 C +ATOM 104 CA MET A 104 279.243 255.052 249.545 1.00 0.00 C +ATOM 105 CA ALA A 105 281.447 257.159 247.260 1.00 0.00 C +ATOM 106 CA LYS A 106 285.047 255.912 247.219 1.00 0.00 C +ATOM 107 CA GLY A 107 288.835 255.720 246.856 1.00 0.00 C +ATOM 108 CA ASP A 108 291.965 255.317 248.991 1.00 0.00 C +ATOM 109 CA GLY A 109 293.812 252.197 247.821 1.00 0.00 C +ATOM 110 CA ASN A 110 295.233 251.765 244.313 1.00 0.00 C +ATOM 111 CA PRO A 111 295.562 252.905 240.692 1.00 0.00 C +ATOM 112 CA THR A 112 295.338 252.343 236.931 1.00 0.00 C +ATOM 113 CA LYS A 113 292.806 251.796 234.136 1.00 0.00 C +ATOM 114 CA ASP A 114 292.183 248.855 231.796 1.00 0.00 C +ATOM 115 CA VAL A 115 295.483 246.952 231.720 1.00 0.00 C +ATOM 116 CA GLY A 116 294.970 243.177 231.666 1.00 0.00 C +ATOM 117 CA VAL A 117 297.075 240.490 229.974 1.00 0.00 C +ATOM 118 CA VAL A 118 298.439 237.632 232.092 1.00 0.00 C +ATOM 119 CA GLY A 119 298.030 233.846 232.233 1.00 0.00 C +ATOM 120 CA GLY A 120 295.999 230.850 231.045 1.00 0.00 C +ATOM 121 CA GLY A 121 294.646 228.247 228.613 1.00 0.00 C +ATOM 122 CA GLY A 122 293.423 228.085 225.009 1.00 0.00 C +ATOM 123 CA GLY A 123 296.186 226.321 223.067 1.00 0.00 C +ATOM 124 CA ASP A 124 295.900 225.717 219.316 1.00 0.00 C +ATOM 125 CA PRO A 125 292.836 224.274 217.571 1.00 0.00 C +ATOM 126 CA ASP A 126 290.021 222.154 219.020 1.00 0.00 C +ATOM 127 CA GLY A 127 286.214 222.303 219.010 1.00 0.00 C +ATOM 128 CA LYS A 128 283.576 219.640 218.327 1.00 0.00 C +ATOM 129 CA GLN A 129 279.987 220.233 219.460 1.00 0.00 C +ATOM 130 CA GLY A 130 277.115 221.319 221.715 1.00 0.00 C +ATOM 131 CA ASP A 131 274.677 223.138 224.009 1.00 0.00 C +ATOM 132 CA GLY A 132 273.125 225.962 226.043 1.00 0.00 C +ATOM 133 CA ALA A 133 269.328 225.724 225.845 1.00 0.00 C +ATOM 134 CA ALA A 134 268.221 227.610 222.725 1.00 0.00 C +ATOM 135 CA GLY A 135 265.474 230.180 222.124 1.00 0.00 C +ATOM 136 CA GLY A 136 266.114 233.059 224.536 1.00 0.00 C +ATOM 137 CA ALA A 137 266.464 236.772 223.756 1.00 0.00 C +ATOM 138 CA VAL A 138 263.802 239.094 222.330 1.00 0.00 C +ATOM 139 CA GLU A 139 260.635 238.141 220.438 1.00 0.00 C +ATOM 140 CA VAL A 140 258.376 236.038 222.672 1.00 0.00 C +ATOM 141 CA GLU A 141 258.218 232.648 220.939 1.00 0.00 C +ATOM 142 CA ARG A 142 258.075 229.635 223.266 1.00 0.00 C +ATOM 143 CA ASP A 143 255.797 228.677 226.167 1.00 0.00 C +ATOM 144 CA ALA A 144 256.206 230.314 229.582 1.00 0.00 C +ATOM 145 CA GLU A 145 253.876 229.855 232.562 1.00 0.00 C +ATOM 146 CA ALA A 146 255.968 227.926 235.095 1.00 0.00 C +ATOM 147 CA ALA A 147 255.665 224.360 236.404 1.00 0.00 C +ATOM 148 CA ALA A 148 258.445 221.908 237.283 1.00 0.00 C +ATOM 149 CA ALA A 149 259.160 219.913 234.117 1.00 0.00 C +ATOM 150 CA ALA A 150 258.532 219.662 230.368 1.00 0.00 C +ATOM 151 CA ALA A 151 255.173 218.292 229.205 1.00 0.00 C +ATOM 152 CA ALA A 152 253.046 215.452 227.817 1.00 0.00 C +ATOM 153 CA SER A 153 250.877 212.378 228.421 1.00 0.00 C +ATOM 154 CA ALA A 154 248.374 209.876 229.832 1.00 0.00 C +ATOM 155 CA VAL A 155 249.307 208.915 233.399 1.00 0.00 C +ATOM 156 CA GLY A 156 249.361 206.824 236.583 1.00 0.00 C +ATOM 157 CA VAL A 157 247.317 207.824 239.639 1.00 0.00 C +ATOM 158 CA ALA A 158 248.094 210.593 242.138 1.00 0.00 C +ATOM 159 CA ALA A 159 250.732 210.248 244.865 1.00 0.00 C +ATOM 160 CA ARG A 160 254.466 211.002 244.773 1.00 0.00 C +ATOM 161 CA VAL A 161 257.345 208.511 244.923 1.00 0.00 C +ATOM 162 CA ALA A 162 261.139 208.567 244.578 1.00 0.00 C +ATOM 163 CA ALA A 163 264.263 208.136 242.441 1.00 0.00 C +ATOM 164 CA ALA A 164 267.739 207.061 243.571 1.00 0.00 C +ATOM 165 CA ALA A 165 271.015 206.937 245.512 1.00 0.00 C +ATOM 166 CA PRO A 166 272.344 203.389 245.104 1.00 0.00 C +ATOM 167 CA PRO A 167 270.581 200.012 245.082 1.00 0.00 C +ATOM 168 CA SER A 168 270.020 198.315 241.718 1.00 0.00 C +ATOM 169 CA ALA A 169 270.146 199.157 238.004 1.00 0.00 C +ATOM 170 CA ARG A 170 268.140 196.560 236.068 1.00 0.00 C +ATOM 171 CA ALA A 171 266.106 194.772 233.387 1.00 0.00 C +ATOM 172 CA PRO A 172 262.631 193.266 233.798 1.00 0.00 C +ATOM 173 CA LEU A 173 259.742 194.263 231.523 1.00 0.00 C +ATOM 174 CA ARG A 174 259.499 197.323 229.266 1.00 0.00 C +ATOM 175 CA PRO A 175 256.314 199.383 229.620 1.00 0.00 C +ATOM 176 CA PRO A 176 253.432 199.679 227.145 1.00 0.00 C +ATOM 177 CA SER A 177 250.319 198.549 229.028 1.00 0.00 C +ATOM 178 CA ALA A 178 246.867 196.990 229.441 1.00 0.00 C +ATOM 179 CA ALA A 179 246.575 194.612 226.479 1.00 0.00 C +ATOM 180 CA HIS A 180 243.935 192.061 225.460 1.00 0.00 C +ATOM 181 CA ARG A 181 241.623 190.073 227.744 1.00 0.00 C +ATOM 182 CA SER A 182 240.462 188.467 230.999 1.00 0.00 C +ATOM 183 CA ARG A 183 240.919 189.724 234.567 1.00 0.00 C +ATOM 184 CA ALA A 184 241.484 191.522 237.878 1.00 0.00 C +ATOM 185 CA THR A 185 242.720 191.105 241.458 1.00 0.00 C +ATOM 186 CA PRO A 186 242.255 193.444 244.428 1.00 0.00 C +ATOM 187 CA PRO A 187 245.774 194.687 245.195 1.00 0.00 C +ATOM 188 CA PRO A 188 247.223 194.707 248.718 1.00 0.00 C +ATOM 189 CA ALA A 189 246.555 194.048 252.411 1.00 0.00 C +ATOM 190 CA ALA A 190 248.037 194.708 255.858 1.00 0.00 C +ATOM 191 CA ARG A 191 248.315 197.000 258.889 1.00 0.00 C +ATOM 192 CA ALA A 192 245.562 197.390 261.494 1.00 0.00 C +ATOM 193 CA PRO A 193 243.216 195.280 263.629 1.00 0.00 C +ATOM 194 CA LEU A 194 241.687 191.904 264.512 1.00 0.00 C +ATOM 195 CA ARG A 195 239.764 189.328 262.467 1.00 0.00 C +ATOM 196 CA PRO A 196 238.158 188.597 259.090 1.00 0.00 C +ATOM 197 CA PRO A 197 240.882 187.610 256.615 1.00 0.00 C +ATOM 198 CA SER A 198 241.657 189.539 253.422 1.00 0.00 C +ATOM 199 CA ALA A 199 241.272 189.180 249.649 1.00 0.00 C +ATOM 200 CA ARG A 200 241.597 185.454 248.922 1.00 0.00 C +ATOM 201 CA ALA A 201 240.270 182.952 251.471 1.00 0.00 C +ATOM 202 CA PRO A 202 241.071 179.340 250.562 1.00 0.00 C +ATOM 203 CA LEU A 203 237.848 177.333 250.874 1.00 0.00 C +ATOM 204 CA ARG A 204 237.438 175.010 253.866 1.00 0.00 C +ATOM 205 CA ARG A 205 236.944 171.269 253.341 1.00 0.00 C +ATOM 206 CA PRO A 206 239.359 168.818 254.975 1.00 0.00 C +ATOM 207 CA LEU A 207 241.652 168.274 257.969 1.00 0.00 C +ATOM 208 CA PRO A 208 239.771 168.586 261.267 1.00 0.00 C +ATOM 209 CA ALA A 209 237.220 171.209 262.330 1.00 0.00 C +ATOM 210 CA ARG A 210 233.548 171.751 261.468 1.00 0.00 C +ATOM 211 CA GLY A 211 230.830 174.405 261.759 1.00 0.00 C +ATOM 212 CA PHE A 212 230.605 178.114 260.917 1.00 0.00 C +ATOM 213 CA SER A 213 231.230 178.701 257.205 1.00 0.00 C +ATOM 214 CA PRO A 214 233.338 181.183 255.227 1.00 0.00 C +ATOM 215 CA ARG A 215 234.721 183.555 257.868 1.00 0.00 C +ATOM 216 CA ARG A 216 232.481 186.080 259.635 1.00 0.00 C +ATOM 217 CA CYS A 217 231.395 189.048 261.763 1.00 0.00 C +ATOM 218 CA HIS A 218 232.243 192.649 260.852 1.00 0.00 C +ATOM 219 CA GLU A 219 230.777 196.153 261.145 1.00 0.00 C +ATOM 220 CA GLU A 220 229.416 198.721 263.609 1.00 0.00 C +ATOM 221 CA GLU A 221 227.761 200.448 266.574 1.00 0.00 C +ATOM 222 CA ARG A 222 225.540 201.053 269.610 1.00 0.00 C +ATOM 223 CA GLY A 223 221.734 201.061 269.776 1.00 0.00 C +ATOM 224 CA ARG A 224 219.585 204.121 269.043 1.00 0.00 C +ATOM 225 CA GLU A 225 221.760 206.840 267.496 1.00 0.00 C +ATOM 226 CA VAL A 226 220.336 208.291 264.273 1.00 0.00 C +ATOM 227 CA ARG A 227 218.954 211.839 264.151 1.00 0.00 C +ATOM 228 CA GLY A 228 215.610 212.574 265.823 1.00 0.00 C +ATOM 229 CA GLU A 229 215.128 216.151 267.042 1.00 0.00 C +ATOM 230 CA GLU A 230 213.206 218.961 268.755 1.00 0.00 C +ATOM 231 CA GLU A 231 211.219 221.450 266.665 1.00 0.00 C +ATOM 232 CA GLU A 232 209.059 221.819 263.548 1.00 0.00 C +ATOM 233 CA ALA A 233 207.311 224.472 261.445 1.00 0.00 C +ATOM 234 CA ASP A 234 205.962 227.993 261.994 1.00 0.00 C +ATOM 235 CA ALA A 235 206.581 231.702 261.385 1.00 0.00 C +ATOM 236 CA TRP A 236 206.771 235.018 259.518 1.00 0.00 C +ATOM 237 CA GLY A 237 207.427 238.764 259.745 1.00 0.00 C +ATOM 238 CA PRO A 238 206.978 242.516 259.256 1.00 0.00 C +ATOM 239 CA ARG A 239 207.051 246.193 260.248 1.00 0.00 C +ATOM 240 CA GLY A 240 210.375 247.993 260.728 1.00 0.00 C +ATOM 241 CA VAL A 241 213.904 248.430 262.095 1.00 0.00 C +ATOM 242 CA PRO A 242 213.833 248.548 265.902 1.00 0.00 C +ATOM 243 CA ARG A 243 213.091 245.753 268.383 1.00 0.00 C +TER 244 ARG A 243 +END diff --git a/Plants/Q852F2/Q852F2.dcd b/Plants/Q852F2/Q852F2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..4d17e6ade83942d2dfd7e549ce588ebfda2884b4 --- /dev/null +++ b/Plants/Q852F2/Q852F2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:654fe6c1a4d077c0b1f91c220fb8f5da99aa073b57411c00f3b02414d2db9786 +size 12200276 diff --git a/Plants/Q852F2/top.pdb b/Plants/Q852F2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..e212f48b5515b8aafd2847ba338d639691d162f1 --- /dev/null +++ b/Plants/Q852F2/top.pdb @@ -0,0 +1,99 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 262.257 223.176 233.572 1.00 0.00 C +ATOM 2 CA ALA A 2 263.593 226.311 235.275 1.00 0.00 C +ATOM 3 CA ARG A 3 264.493 229.702 236.760 1.00 0.00 C +ATOM 4 CA GLY A 4 267.398 230.183 239.179 1.00 0.00 C +ATOM 5 CA SER A 5 267.404 227.466 241.850 1.00 0.00 C +ATOM 6 CA ALA A 6 268.894 226.456 245.207 1.00 0.00 C +ATOM 7 CA ALA A 7 267.156 224.851 248.194 1.00 0.00 C +ATOM 8 CA ARG A 8 266.595 222.227 250.899 1.00 0.00 C +ATOM 9 CA THR A 9 263.290 220.565 249.986 1.00 0.00 C +ATOM 10 CA GLN A 10 263.477 218.950 246.540 1.00 0.00 C +ATOM 11 CA ARG A 11 265.011 217.137 243.561 1.00 0.00 C +ATOM 12 CA ARG A 12 263.938 215.726 240.188 1.00 0.00 C +ATOM 13 CA ARG A 13 265.768 215.344 236.868 1.00 0.00 C +ATOM 14 CA GLU A 14 264.736 213.712 233.584 1.00 0.00 C +ATOM 15 CA ALA A 15 261.776 212.762 231.382 1.00 0.00 C +ATOM 16 CA ALA A 16 258.824 215.095 231.982 1.00 0.00 C +ATOM 17 CA THR A 17 258.280 215.535 235.727 1.00 0.00 C +ATOM 18 CA SER A 18 255.022 217.210 236.775 1.00 0.00 C +ATOM 19 CA GLY A 19 254.904 217.617 240.561 1.00 0.00 C +ATOM 20 CA ASP A 20 253.285 214.668 242.348 1.00 0.00 C +ATOM 21 CA ARG A 21 254.007 211.299 240.721 1.00 0.00 C +ATOM 22 CA SER A 22 252.866 209.240 237.725 1.00 0.00 C +ATOM 23 CA ALA A 23 250.144 206.882 238.967 1.00 0.00 C +ATOM 24 CA ALA A 24 246.718 208.334 238.147 1.00 0.00 C +ATOM 25 CA GLU A 25 243.398 207.557 236.446 1.00 0.00 C +ATOM 26 CA GLY A 26 240.176 208.275 238.347 1.00 0.00 C +ATOM 27 CA GLY A 27 238.412 209.921 241.296 1.00 0.00 C +ATOM 28 CA GLY A 28 238.192 213.662 240.609 1.00 0.00 C +ATOM 29 CA VAL A 29 236.535 216.426 238.577 1.00 0.00 C +ATOM 30 CA ALA A 30 236.031 220.202 238.611 1.00 0.00 C +ATOM 31 CA ALA A 31 236.235 223.948 239.277 1.00 0.00 C +ATOM 32 CA THR A 32 239.516 225.579 238.233 1.00 0.00 C +ATOM 33 CA ARG A 33 241.779 228.611 238.680 1.00 0.00 C +ATOM 34 CA ALA A 34 245.498 228.776 239.494 1.00 0.00 C +ATOM 35 CA ALA A 35 248.382 227.909 237.160 1.00 0.00 C +ATOM 36 CA ILE A 36 251.267 230.372 237.516 1.00 0.00 C +ATOM 37 CA ALA A 37 253.298 231.853 240.379 1.00 0.00 C +ATOM 38 CA ALA A 38 256.521 229.903 240.948 1.00 0.00 C +ATOM 39 CA SER A 39 259.873 231.397 241.971 1.00 0.00 C +ATOM 40 CA LYS A 40 259.827 235.077 240.985 1.00 0.00 C +ATOM 41 CA ARG A 41 261.938 238.221 240.567 1.00 0.00 C +ATOM 42 CA LEU A 42 263.555 240.324 237.833 1.00 0.00 C +ATOM 43 CA GLY A 43 264.294 243.513 235.882 1.00 0.00 C +ATOM 44 CA GLY A 44 262.016 246.289 237.156 1.00 0.00 C +ATOM 45 CA GLY A 45 258.630 247.364 238.533 1.00 0.00 C +ATOM 46 CA ALA A 46 255.918 249.480 240.170 1.00 0.00 C +ATOM 47 CA ARG A 47 254.902 251.923 242.912 1.00 0.00 C +ATOM 48 CA PRO A 48 254.094 252.967 246.486 1.00 0.00 C +ATOM 49 CA LYS A 49 253.572 251.306 249.875 1.00 0.00 C +ATOM 50 CA ALA A 50 253.744 250.959 253.665 1.00 0.00 C +ATOM 51 CA PRO A 51 253.665 252.677 257.065 1.00 0.00 C +ATOM 52 CA ALA A 52 255.580 254.475 259.825 1.00 0.00 C +ATOM 53 CA THR A 53 256.593 258.096 260.437 1.00 0.00 C +ATOM 54 CA ALA A 54 255.517 261.554 261.620 1.00 0.00 C +ATOM 55 CA LYS A 55 252.817 263.777 260.107 1.00 0.00 C +ATOM 56 CA LEU A 56 252.717 267.586 260.096 1.00 0.00 C +ATOM 57 CA THR A 57 254.826 270.207 258.308 1.00 0.00 C +ATOM 58 CA GLY A 58 257.142 272.690 260.037 1.00 0.00 C +ATOM 59 CA ALA A 59 259.261 275.773 260.757 1.00 0.00 C +ATOM 60 CA ARG A 60 262.906 276.147 261.802 1.00 0.00 C +ATOM 61 CA HIS A 61 265.704 275.233 264.220 1.00 0.00 C +ATOM 62 CA ARG A 62 265.119 277.022 267.533 1.00 0.00 C +ATOM 63 CA ARG A 63 265.154 278.895 270.850 1.00 0.00 C +ATOM 64 CA GLY A 64 265.547 282.492 272.045 1.00 0.00 C +ATOM 65 CA SER A 65 264.941 286.247 272.264 1.00 0.00 C +ATOM 66 CA GLY A 66 265.060 287.784 275.748 1.00 0.00 C +ATOM 67 CA GLY A 67 262.281 290.357 276.166 1.00 0.00 C +ATOM 68 CA GLY A 68 259.501 291.893 278.270 1.00 0.00 C +ATOM 69 CA LEU A 69 258.360 295.158 279.869 1.00 0.00 C +ATOM 70 CA LEU A 70 256.196 294.222 282.861 1.00 0.00 C +ATOM 71 CA ARG A 71 253.502 291.631 282.122 1.00 0.00 C +ATOM 72 CA ARG A 72 250.726 289.159 281.286 1.00 0.00 C +ATOM 73 CA ARG A 73 251.022 287.733 277.765 1.00 0.00 C +ATOM 74 CA GLY A 74 248.355 285.621 276.049 1.00 0.00 C +ATOM 75 CA GLY A 75 245.519 284.928 273.601 1.00 0.00 C +ATOM 76 CA ARG A 76 243.455 281.744 273.948 1.00 0.00 C +ATOM 77 CA ASP A 77 242.258 279.839 270.874 1.00 0.00 C +ATOM 78 CA GLY A 78 242.619 280.365 267.118 1.00 0.00 C +ATOM 79 CA PRO A 79 241.082 281.580 263.850 1.00 0.00 C +ATOM 80 CA HIS A 80 239.422 279.402 261.202 1.00 0.00 C +ATOM 81 CA ASP A 81 237.089 279.722 258.206 1.00 0.00 C +ATOM 82 CA GLY A 82 233.967 277.959 256.918 1.00 0.00 C +ATOM 83 CA GLU A 83 234.141 274.413 255.533 1.00 0.00 C +ATOM 84 CA ARG A 84 230.971 272.820 254.144 1.00 0.00 C +ATOM 85 CA ASP A 85 229.559 272.661 250.608 1.00 0.00 C +ATOM 86 CA ASP A 86 226.353 271.225 249.134 1.00 0.00 C +ATOM 87 CA VAL A 87 224.278 270.350 246.061 1.00 0.00 C +ATOM 88 CA ASP A 88 222.099 269.609 243.024 1.00 0.00 C +ATOM 89 CA GLY A 89 218.668 271.141 242.397 1.00 0.00 C +ATOM 90 CA ALA A 90 216.960 272.361 239.217 1.00 0.00 C +ATOM 91 CA ALA A 91 214.034 270.766 237.371 1.00 0.00 C +ATOM 92 CA ARG A 92 211.071 273.161 237.298 1.00 0.00 C +ATOM 93 CA HIS A 93 211.724 276.867 237.891 1.00 0.00 C +ATOM 94 CA GLY A 94 212.637 278.844 234.765 1.00 0.00 C +ATOM 95 CA GLY A 95 212.162 281.555 232.130 1.00 0.00 C +TER 96 GLY A 95 +END diff --git a/Plants/Q852G3/Q852G3.dcd b/Plants/Q852G3/Q852G3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..0df3fa218ba012fc62505670bbb49fb5b52cab04 --- /dev/null +++ b/Plants/Q852G3/Q852G3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:554cf3ac4726416181baf9b7b631d84256912b70d7c89496b5b0a972326a65cb +size 12920276 diff --git a/Plants/Q852G3/top.pdb b/Plants/Q852G3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..21ddbd596370da22253e8f8bacee1bd9dc939b2b --- /dev/null +++ b/Plants/Q852G3/top.pdb @@ -0,0 +1,105 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 276.603 266.814 252.431 1.00 0.00 C +ATOM 2 CA ALA A 2 279.617 264.961 253.844 1.00 0.00 C +ATOM 3 CA ARG A 3 282.505 262.661 254.786 1.00 0.00 C +ATOM 4 CA ARG A 4 285.362 260.953 256.640 1.00 0.00 C +ATOM 5 CA ARG A 5 287.186 257.614 256.446 1.00 0.00 C +ATOM 6 CA ARG A 6 286.098 253.980 256.803 1.00 0.00 C +ATOM 7 CA ARG A 7 282.916 252.234 255.645 1.00 0.00 C +ATOM 8 CA THR A 8 279.778 251.856 257.773 1.00 0.00 C +ATOM 9 CA THR A 9 276.837 254.032 258.838 1.00 0.00 C +ATOM 10 CA ALA A 10 274.208 255.344 256.414 1.00 0.00 C +ATOM 11 CA GLY A 11 271.839 255.589 253.439 1.00 0.00 C +ATOM 12 CA GLY A 12 271.348 252.130 251.919 1.00 0.00 C +ATOM 13 CA ASP A 13 271.093 250.371 248.549 1.00 0.00 C +ATOM 14 CA ARG A 14 268.587 251.489 245.906 1.00 0.00 C +ATOM 15 CA ARG A 15 268.595 251.289 242.101 1.00 0.00 C +ATOM 16 CA ARG A 16 271.399 248.884 241.171 1.00 0.00 C +ATOM 17 CA GLY A 17 271.781 248.251 237.434 1.00 0.00 C +ATOM 18 CA GLU A 18 272.827 247.450 233.859 1.00 0.00 C +ATOM 19 CA THR A 19 271.949 246.214 230.363 1.00 0.00 C +ATOM 20 CA ALA A 20 270.413 245.814 226.900 1.00 0.00 C +ATOM 21 CA ALA A 21 271.867 242.703 225.248 1.00 0.00 C +ATOM 22 CA ALA A 22 271.351 240.604 222.111 1.00 0.00 C +ATOM 23 CA GLY A 23 269.333 237.546 221.066 1.00 0.00 C +ATOM 24 CA ALA A 24 266.135 237.646 218.997 1.00 0.00 C +ATOM 25 CA LYS A 25 263.915 240.498 217.789 1.00 0.00 C +ATOM 26 CA ALA A 26 262.375 243.113 215.486 1.00 0.00 C +ATOM 27 CA ALA A 27 261.162 245.851 213.131 1.00 0.00 C +ATOM 28 CA ALA A 28 258.411 244.366 210.953 1.00 0.00 C +ATOM 29 CA ALA A 29 257.063 247.153 208.733 1.00 0.00 C +ATOM 30 CA ALA A 30 254.280 248.662 206.613 1.00 0.00 C +ATOM 31 CA GLU A 31 251.495 246.064 206.703 1.00 0.00 C +ATOM 32 CA ASP A 32 248.646 243.595 207.253 1.00 0.00 C +ATOM 33 CA ASP A 33 246.218 243.363 210.180 1.00 0.00 C +ATOM 34 CA GLY A 34 244.602 246.238 212.088 1.00 0.00 C +ATOM 35 CA ALA A 35 245.324 249.730 210.746 1.00 0.00 C +ATOM 36 CA ARG A 36 247.369 251.755 213.242 1.00 0.00 C +ATOM 37 CA ALA A 37 245.916 253.590 216.248 1.00 0.00 C +ATOM 38 CA GLU A 38 242.449 254.655 217.416 1.00 0.00 C +ATOM 39 CA GLY A 39 239.301 254.772 219.559 1.00 0.00 C +ATOM 40 CA GLY A 40 235.601 254.063 220.130 1.00 0.00 C +ATOM 41 CA GLY A 41 234.710 254.120 223.834 1.00 0.00 C +ATOM 42 CA ALA A 42 237.503 253.539 226.359 1.00 0.00 C +ATOM 43 CA HIS A 43 237.093 255.262 229.733 1.00 0.00 C +ATOM 44 CA GLY A 44 234.635 253.553 232.090 1.00 0.00 C +ATOM 45 CA GLY A 45 235.805 250.181 233.422 1.00 0.00 C +ATOM 46 CA ARG A 46 233.540 248.297 235.838 1.00 0.00 C +ATOM 47 CA GLY A 47 230.533 248.341 238.178 1.00 0.00 C +ATOM 48 CA LYS A 48 227.982 248.448 241.006 1.00 0.00 C +ATOM 49 CA GLU A 49 226.740 246.594 244.094 1.00 0.00 C +ATOM 50 CA GLY A 50 224.316 243.883 245.229 1.00 0.00 C +ATOM 51 CA GLY A 51 224.676 240.096 245.009 1.00 0.00 C +ATOM 52 CA LYS A 52 226.528 236.788 244.631 1.00 0.00 C +ATOM 53 CA GLY A 53 228.248 234.644 247.269 1.00 0.00 C +ATOM 54 CA ILE A 54 231.025 236.469 249.133 1.00 0.00 C +ATOM 55 CA PRO A 55 232.200 236.500 252.757 1.00 0.00 C +ATOM 56 CA HIS A 56 230.086 235.391 255.727 1.00 0.00 C +ATOM 57 CA ARG A 57 228.382 238.415 257.298 1.00 0.00 C +ATOM 58 CA GLY A 58 229.825 241.500 259.006 1.00 0.00 C +ATOM 59 CA ASP A 59 227.880 242.641 262.077 1.00 0.00 C +ATOM 60 CA GLY A 60 226.340 243.146 265.525 1.00 0.00 C +ATOM 61 CA GLY A 61 224.564 246.508 265.776 1.00 0.00 C +ATOM 62 CA ASP A 62 223.478 248.513 262.724 1.00 0.00 C +ATOM 63 CA ARG A 63 222.997 252.163 261.746 1.00 0.00 C +ATOM 64 CA ARG A 64 220.130 254.672 261.844 1.00 0.00 C +ATOM 65 CA GLY A 65 219.504 257.300 264.530 1.00 0.00 C +ATOM 66 CA LYS A 66 221.786 259.960 266.023 1.00 0.00 C +ATOM 67 CA ARG A 67 225.197 259.570 264.372 1.00 0.00 C +ATOM 68 CA ARG A 68 228.579 257.829 264.590 1.00 0.00 C +ATOM 69 CA ALA A 69 227.807 254.104 264.793 1.00 0.00 C +ATOM 70 CA ALA A 70 229.068 250.543 265.287 1.00 0.00 C +ATOM 71 CA MET A 71 231.999 248.255 266.118 1.00 0.00 C +ATOM 72 CA THR A 72 231.599 245.926 269.106 1.00 0.00 C +ATOM 73 CA GLY A 73 231.574 247.255 272.677 1.00 0.00 C +ATOM 74 CA ASP A 74 232.539 250.392 274.612 1.00 0.00 C +ATOM 75 CA ALA A 75 233.029 254.149 275.013 1.00 0.00 C +ATOM 76 CA GLU A 76 235.695 256.246 273.279 1.00 0.00 C +ATOM 77 CA ALA A 77 234.861 258.423 270.265 1.00 0.00 C +ATOM 78 CA ARG A 78 234.980 259.630 266.654 1.00 0.00 C +ATOM 79 CA THR A 79 235.952 258.476 263.155 1.00 0.00 C +ATOM 80 CA GLY A 80 238.398 255.778 262.033 1.00 0.00 C +ATOM 81 CA GLY A 81 241.005 256.363 259.317 1.00 0.00 C +ATOM 82 CA GLY A 82 244.335 258.200 259.546 1.00 0.00 C +ATOM 83 CA ASP A 83 247.719 259.666 260.503 1.00 0.00 C +ATOM 84 CA THR A 84 251.449 258.890 260.477 1.00 0.00 C +ATOM 85 CA LEU A 85 254.972 257.739 261.357 1.00 0.00 C +ATOM 86 CA GLY A 86 256.985 254.654 262.332 1.00 0.00 C +ATOM 87 CA GLU A 87 256.519 251.597 264.558 1.00 0.00 C +ATOM 88 CA ASP A 88 259.129 252.046 267.298 1.00 0.00 C +ATOM 89 CA GLY A 89 261.958 250.631 269.422 1.00 0.00 C +ATOM 90 CA GLU A 90 264.555 252.884 271.063 1.00 0.00 C +ATOM 91 CA ALA A 91 262.998 256.035 272.535 1.00 0.00 C +ATOM 92 CA LEU A 92 262.487 255.450 276.265 1.00 0.00 C +ATOM 93 CA GLY A 93 265.018 253.873 278.636 1.00 0.00 C +ATOM 94 CA GLU A 94 264.577 252.750 282.250 1.00 0.00 C +ATOM 95 CA GLU A 95 263.143 250.446 284.925 1.00 0.00 C +ATOM 96 CA THR A 96 264.362 250.767 288.520 1.00 0.00 C +ATOM 97 CA THR A 97 267.012 248.252 289.601 1.00 0.00 C +ATOM 98 CA THR A 98 268.253 244.985 291.119 1.00 0.00 C +ATOM 99 CA THR A 99 267.113 241.754 289.453 1.00 0.00 C +ATOM 100 CA ALA A 100 265.795 239.684 286.538 1.00 0.00 C +ATOM 101 CA ALA A 101 265.084 235.941 286.516 1.00 0.00 C +TER 102 ALA A 101 +END diff --git a/Plants/Q85WX6/Q85WX6.dcd b/Plants/Q85WX6/Q85WX6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..219e0e2fd07260c195a0e6cd561a2b71b82235c5 --- /dev/null +++ b/Plants/Q85WX6/Q85WX6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:980b2193e783f46ce704338124f580e9c0b2cb726fb33430a3f618320464939f +size 6080276 diff --git a/Plants/Q85WX6/top.pdb b/Plants/Q85WX6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..933feda008a93c645f2466b44a83bdb2d926b97b --- /dev/null +++ b/Plants/Q85WX6/top.pdb @@ -0,0 +1,48 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 237.598 241.996 259.814 1.00 0.00 C +ATOM 2 CA SER A 2 236.288 239.971 256.865 1.00 0.00 C +ATOM 3 CA PRO A 3 232.678 240.962 256.154 1.00 0.00 C +ATOM 4 CA SER A 4 230.027 243.681 255.856 1.00 0.00 C +ATOM 5 CA GLY A 5 230.769 246.268 258.553 1.00 0.00 C +ATOM 6 CA ARG A 6 233.720 248.656 258.870 1.00 0.00 C +ATOM 7 CA GLY A 7 233.548 252.387 259.625 1.00 0.00 C +ATOM 8 CA LYS A 8 236.997 253.852 258.937 1.00 0.00 C +ATOM 9 CA ILE A 9 238.959 255.163 255.946 1.00 0.00 C +ATOM 10 CA ARG A 10 239.335 253.725 252.438 1.00 0.00 C +ATOM 11 CA GLU A 11 240.615 252.144 249.216 1.00 0.00 C +ATOM 12 CA LYS A 12 238.010 252.067 246.438 1.00 0.00 C +ATOM 13 CA ASN A 13 238.332 253.322 242.855 1.00 0.00 C +ATOM 14 CA ARG A 14 238.859 257.007 242.041 1.00 0.00 C +ATOM 15 CA ILE A 15 240.192 260.379 240.871 1.00 0.00 C +ATOM 16 CA SER A 16 243.791 261.540 240.405 1.00 0.00 C +ATOM 17 CA ARG A 17 246.800 259.304 241.084 1.00 0.00 C +ATOM 18 CA CYS A 18 248.096 257.200 243.984 1.00 0.00 C +ATOM 19 CA PRO A 19 249.046 253.547 243.464 1.00 0.00 C +ATOM 20 CA ALA A 20 251.313 250.491 243.643 1.00 0.00 C +ATOM 21 CA THR A 21 253.462 247.379 243.177 1.00 0.00 C +ATOM 22 CA ASN A 22 255.147 246.942 239.788 1.00 0.00 C +ATOM 23 CA PRO A 23 257.718 244.306 238.807 1.00 0.00 C +ATOM 24 CA SER A 24 256.213 240.855 239.391 1.00 0.00 C +ATOM 25 CA LEU A 25 255.990 239.121 242.776 1.00 0.00 C +ATOM 26 CA SER A 26 258.496 239.918 245.532 1.00 0.00 C +ATOM 27 CA PHE A 27 262.084 240.364 244.330 1.00 0.00 C +ATOM 28 CA HIS A 28 264.326 241.835 241.623 1.00 0.00 C +ATOM 29 CA SER A 29 266.999 244.371 240.654 1.00 0.00 C +ATOM 30 CA ARG A 30 267.930 247.484 242.645 1.00 0.00 C +ATOM 31 CA PHE A 31 268.131 250.349 245.148 1.00 0.00 C +ATOM 32 CA LYS A 32 266.604 252.573 247.839 1.00 0.00 C +ATOM 33 CA LEU A 33 263.176 252.028 249.409 1.00 0.00 C +ATOM 34 CA ASP A 34 260.707 249.251 250.254 1.00 0.00 C +ATOM 35 CA GLY A 35 258.057 249.494 252.980 1.00 0.00 C +ATOM 36 CA ASN A 36 254.465 249.872 251.766 1.00 0.00 C +ATOM 37 CA ASN A 37 251.725 252.493 252.140 1.00 0.00 C +ATOM 38 CA THR A 38 250.196 253.593 255.452 1.00 0.00 C +ATOM 39 CA LEU A 39 252.151 251.972 258.291 1.00 0.00 C +ATOM 40 CA ARG A 40 255.902 251.509 258.769 1.00 0.00 C +ATOM 41 CA PRO A 41 258.745 251.020 261.258 1.00 0.00 C +ATOM 42 CA THR A 42 260.429 254.419 261.624 1.00 0.00 C +ATOM 43 CA ILE A 43 259.675 256.412 264.782 1.00 0.00 C +ATOM 44 CA HIS A 44 256.700 258.775 264.505 1.00 0.00 C +TER 45 HIS A 44 +END diff --git a/Plants/Q8GRJ9/Q8GRJ9.dcd b/Plants/Q8GRJ9/Q8GRJ9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..ed7fca89fd098689ba9ebff47ccd5ce6cb6bc795 --- /dev/null +++ b/Plants/Q8GRJ9/Q8GRJ9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:9713c71e063c2eeb978d199b098ec0a07df39f3b5087bcd34622a4797bc5e51d +size 15560276 diff --git a/Plants/Q8GRJ9/top.pdb b/Plants/Q8GRJ9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..e7315f2d81b2472623fd357db918b786e2866422 --- /dev/null +++ b/Plants/Q8GRJ9/top.pdb @@ -0,0 +1,127 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 249.166 298.004 309.202 1.00 0.00 C +ATOM 2 CA ARG A 2 247.122 298.010 312.417 1.00 0.00 C +ATOM 3 CA CYS A 3 244.870 295.121 313.466 1.00 0.00 C +ATOM 4 CA ASN A 4 245.354 292.724 316.387 1.00 0.00 C +ATOM 5 CA GLU A 5 247.614 289.827 315.377 1.00 0.00 C +ATOM 6 CA SER A 6 246.448 288.293 312.091 1.00 0.00 C +ATOM 7 CA GLN A 7 244.606 285.011 311.495 1.00 0.00 C +ATOM 8 CA ASN A 8 245.264 281.813 309.531 1.00 0.00 C +ATOM 9 CA LEU A 9 242.989 279.326 307.755 1.00 0.00 C +ATOM 10 CA LYS A 10 239.366 278.153 307.642 1.00 0.00 C +ATOM 11 CA ASN A 11 235.940 278.753 306.088 1.00 0.00 C +ATOM 12 CA TYR A 12 234.740 280.210 302.778 1.00 0.00 C +ATOM 13 CA THR A 13 236.949 282.878 301.193 1.00 0.00 C +ATOM 14 CA SER A 14 240.119 284.213 302.832 1.00 0.00 C +ATOM 15 CA SER A 15 243.090 281.883 302.322 1.00 0.00 C +ATOM 16 CA GLU A 16 243.311 280.048 298.990 1.00 0.00 C +ATOM 17 CA THR A 17 243.702 282.245 295.902 1.00 0.00 C +ATOM 18 CA GLN A 18 243.613 285.521 293.959 1.00 0.00 C +ATOM 19 CA ILE A 19 241.603 287.892 291.755 1.00 0.00 C +ATOM 20 CA ILE A 20 240.398 291.102 290.094 1.00 0.00 C +ATOM 21 CA LYS A 21 241.141 290.944 286.360 1.00 0.00 C +ATOM 22 CA LYS A 22 242.947 290.493 283.036 1.00 0.00 C +ATOM 23 CA LYS A 23 245.970 290.545 280.717 1.00 0.00 C +ATOM 24 CA GLN A 24 247.202 288.094 278.074 1.00 0.00 C +ATOM 25 CA THR A 25 248.512 284.516 278.103 1.00 0.00 C +ATOM 26 CA ASN A 26 248.499 280.804 277.245 1.00 0.00 C +ATOM 27 CA GLU A 27 249.098 277.074 277.738 1.00 0.00 C +ATOM 28 CA PRO A 28 251.948 274.815 278.877 1.00 0.00 C +ATOM 29 CA ALA A 29 254.670 274.562 276.224 1.00 0.00 C +ATOM 30 CA PRO A 30 258.432 274.513 276.828 1.00 0.00 C +ATOM 31 CA GLY A 31 259.946 273.159 273.605 1.00 0.00 C +ATOM 32 CA ARG A 32 261.459 271.586 270.482 1.00 0.00 C +ATOM 33 CA CYS A 33 264.369 272.121 268.081 1.00 0.00 C +ATOM 34 CA LEU A 34 265.595 268.625 267.193 1.00 0.00 C +ATOM 35 CA PRO A 35 263.800 267.410 264.060 1.00 0.00 C +ATOM 36 CA ALA A 36 264.000 263.610 263.860 1.00 0.00 C +ATOM 37 CA ARG A 37 266.690 260.960 263.352 1.00 0.00 C +ATOM 38 CA SER A 38 266.955 258.030 260.931 1.00 0.00 C +ATOM 39 CA ARG A 39 270.004 256.235 259.517 1.00 0.00 C +ATOM 40 CA ARG A 40 270.444 255.977 255.741 1.00 0.00 C +ATOM 41 CA ARG A 41 272.284 257.201 252.638 1.00 0.00 C +ATOM 42 CA ALA A 42 269.991 259.358 250.492 1.00 0.00 C +ATOM 43 CA THR A 43 266.461 259.313 251.924 1.00 0.00 C +ATOM 44 CA ALA A 44 264.209 258.461 248.971 1.00 0.00 C +ATOM 45 CA CYS A 45 263.528 258.804 245.238 1.00 0.00 C +ATOM 46 CA LEU A 46 266.836 259.181 243.386 1.00 0.00 C +ATOM 47 CA PRO A 47 267.540 259.411 239.648 1.00 0.00 C +ATOM 48 CA ALA A 48 269.877 260.830 236.995 1.00 0.00 C +ATOM 49 CA ARG A 49 272.672 258.686 235.542 1.00 0.00 C +ATOM 50 CA GLY A 50 272.215 254.956 234.917 1.00 0.00 C +ATOM 51 CA ARG A 51 269.793 254.412 232.027 1.00 0.00 C +ATOM 52 CA ALA A 52 271.236 253.142 228.737 1.00 0.00 C +ATOM 53 CA ALA A 53 268.953 250.402 227.397 1.00 0.00 C +ATOM 54 CA ALA A 54 267.218 248.200 224.817 1.00 0.00 C +ATOM 55 CA ALA A 55 266.041 244.967 223.179 1.00 0.00 C +ATOM 56 CA SER A 56 264.815 243.193 220.039 1.00 0.00 C +ATOM 57 CA PRO A 57 262.791 240.212 221.276 1.00 0.00 C +ATOM 58 CA PHE A 58 259.401 240.592 222.974 1.00 0.00 C +ATOM 59 CA ALA A 59 256.640 238.306 221.683 1.00 0.00 C +ATOM 60 CA ALA A 60 257.965 236.273 218.745 1.00 0.00 C +ATOM 61 CA ALA A 61 256.823 232.705 218.054 1.00 0.00 C +ATOM 62 CA PRO A 62 254.095 230.248 219.074 1.00 0.00 C +ATOM 63 CA PRO A 63 255.306 227.984 221.888 1.00 0.00 C +ATOM 64 CA PRO A 64 256.060 226.443 225.290 1.00 0.00 C +ATOM 65 CA PRO A 65 259.095 225.710 227.474 1.00 0.00 C +ATOM 66 CA ALA A 66 259.020 222.265 229.099 1.00 0.00 C +ATOM 67 CA THR A 67 261.117 219.094 229.356 1.00 0.00 C +ATOM 68 CA GLY A 68 264.720 219.012 228.119 1.00 0.00 C +ATOM 69 CA ARG A 69 267.198 219.194 231.008 1.00 0.00 C +ATOM 70 CA LEU A 70 267.128 221.129 234.289 1.00 0.00 C +ATOM 71 CA MET A 71 263.893 221.125 236.300 1.00 0.00 C +ATOM 72 CA GLU A 72 262.822 223.884 238.700 1.00 0.00 C +ATOM 73 CA ASP A 73 259.505 223.327 240.490 1.00 0.00 C +ATOM 74 CA GLY A 74 257.664 224.435 243.636 1.00 0.00 C +ATOM 75 CA VAL A 75 259.627 224.375 246.901 1.00 0.00 C +ATOM 76 CA GLU A 76 260.517 222.772 250.241 1.00 0.00 C +ATOM 77 CA GLY A 77 262.264 219.386 250.226 1.00 0.00 C +ATOM 78 CA ARG A 78 260.957 215.845 250.743 1.00 0.00 C +ATOM 79 CA LYS A 79 258.735 212.760 250.499 1.00 0.00 C +ATOM 80 CA ARG A 80 256.514 210.683 252.795 1.00 0.00 C +ATOM 81 CA LYS A 81 256.753 207.130 251.439 1.00 0.00 C +ATOM 82 CA GLU A 82 256.907 206.281 247.729 1.00 0.00 C +ATOM 83 CA ARG A 83 254.057 205.097 245.493 1.00 0.00 C +ATOM 84 CA GLY A 84 250.987 206.961 246.765 1.00 0.00 C +ATOM 85 CA GLY A 85 247.821 208.429 245.235 1.00 0.00 C +ATOM 86 CA GLU A 86 244.758 210.101 243.706 1.00 0.00 C +ATOM 87 CA GLU A 87 246.068 212.104 240.742 1.00 0.00 C +ATOM 88 CA GLU A 88 247.777 215.510 240.727 1.00 0.00 C +ATOM 89 CA GLY A 89 249.170 218.747 239.279 1.00 0.00 C +ATOM 90 CA GLU A 90 247.050 221.033 237.091 1.00 0.00 C +ATOM 91 CA GLU A 91 244.638 223.865 236.266 1.00 0.00 C +ATOM 92 CA GLY A 92 242.414 226.919 235.770 1.00 0.00 C +ATOM 93 CA ARG A 93 239.146 228.075 237.350 1.00 0.00 C +ATOM 94 CA LYS A 94 239.038 229.986 240.645 1.00 0.00 C +ATOM 95 CA ARG A 95 241.625 232.189 242.368 1.00 0.00 C +ATOM 96 CA GLY A 96 241.933 235.873 243.291 1.00 0.00 C +ATOM 97 CA GLU A 97 242.549 238.552 240.653 1.00 0.00 C +ATOM 98 CA GLY A 98 243.129 239.822 237.108 1.00 0.00 C +ATOM 99 CA ARG A 99 242.797 242.260 234.199 1.00 0.00 C +ATOM 100 CA ARG A 100 244.607 242.871 230.903 1.00 0.00 C +ATOM 101 CA LYS A 101 248.163 242.220 229.701 1.00 0.00 C +ATOM 102 CA ARG A 102 249.446 238.826 230.864 1.00 0.00 C +ATOM 103 CA ILE A 103 249.458 236.130 228.172 1.00 0.00 C +ATOM 104 CA GLY A 104 246.923 234.171 226.111 1.00 0.00 C +ATOM 105 CA SER A 105 243.599 235.857 226.904 1.00 0.00 C +ATOM 106 CA GLU A 106 239.847 235.715 226.258 1.00 0.00 C +ATOM 107 CA LYS A 107 237.522 238.236 224.598 1.00 0.00 C +ATOM 108 CA ARG A 108 234.505 239.215 226.707 1.00 0.00 C +ATOM 109 CA LYS A 109 230.800 238.365 226.442 1.00 0.00 C +ATOM 110 CA ARG A 110 229.836 239.208 222.853 1.00 0.00 C +ATOM 111 CA GLY A 111 226.392 240.836 222.831 1.00 0.00 C +ATOM 112 CA ASP A 112 227.048 244.584 222.630 1.00 0.00 C +ATOM 113 CA VAL A 113 224.611 247.325 221.597 1.00 0.00 C +ATOM 114 CA PRO A 114 224.125 248.018 217.882 1.00 0.00 C +ATOM 115 CA ILE A 115 222.698 249.927 214.910 1.00 0.00 C +ATOM 116 CA LEU A 116 222.465 251.513 211.454 1.00 0.00 C +ATOM 117 CA SER A 117 223.229 250.721 207.806 1.00 0.00 C +ATOM 118 CA LYS A 118 220.469 251.960 205.490 1.00 0.00 C +ATOM 119 CA TYR A 119 220.434 254.642 202.785 1.00 0.00 C +ATOM 120 CA LEU A 120 219.980 256.065 199.280 1.00 0.00 C +ATOM 121 CA PHE A 121 218.559 253.544 196.802 1.00 0.00 C +ATOM 122 CA ARG A 122 217.131 250.077 196.128 1.00 0.00 C +ATOM 123 CA THR A 123 218.063 247.664 198.926 1.00 0.00 C +TER 124 THR A 123 +END diff --git a/Plants/Q8GRL1/Q8GRL1.dcd b/Plants/Q8GRL1/Q8GRL1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..d7c15983461047bac60c1b2a2b7e326803eb0c2f --- /dev/null +++ b/Plants/Q8GRL1/Q8GRL1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e3e9155aea60cf1ebe3b64428e3a112dacb5dc223dcd2547f86b33a0778545cd +size 21680276 diff --git a/Plants/Q8GRL1/top.pdb b/Plants/Q8GRL1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..006666f7bcd174c12d8e9fd17dffc0a2e6214180 --- /dev/null +++ b/Plants/Q8GRL1/top.pdb @@ -0,0 +1,178 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 201.790 278.267 273.283 1.00 0.00 C +ATOM 2 CA VAL A 2 203.057 275.396 275.444 1.00 0.00 C +ATOM 3 CA THR A 3 203.592 273.585 278.753 1.00 0.00 C +ATOM 4 CA SER A 4 204.055 270.513 280.959 1.00 0.00 C +ATOM 5 CA GLY A 5 206.905 268.394 282.338 1.00 0.00 C +ATOM 6 CA SER A 6 206.713 264.789 283.556 1.00 0.00 C +ATOM 7 CA GLU A 7 207.490 261.354 282.102 1.00 0.00 C +ATOM 8 CA LEU A 8 210.272 261.865 279.549 1.00 0.00 C +ATOM 9 CA PRO A 9 210.525 260.099 276.183 1.00 0.00 C +ATOM 10 CA PHE A 10 212.436 258.595 273.250 1.00 0.00 C +ATOM 11 CA VAL A 11 215.640 260.004 271.743 1.00 0.00 C +ATOM 12 CA ALA A 12 217.604 261.063 268.655 1.00 0.00 C +ATOM 13 CA ARG A 13 217.243 263.333 265.617 1.00 0.00 C +ATOM 14 CA PRO A 14 216.084 266.591 264.017 1.00 0.00 C +ATOM 15 CA PRO A 15 213.580 266.134 261.182 1.00 0.00 C +ATOM 16 CA SER A 16 214.885 263.226 259.095 1.00 0.00 C +ATOM 17 CA ALA A 17 217.287 260.849 257.335 1.00 0.00 C +ATOM 18 CA ALA A 18 220.107 262.920 255.827 1.00 0.00 C +ATOM 19 CA SER A 19 223.903 262.889 255.503 1.00 0.00 C +ATOM 20 CA LEU A 20 226.560 260.315 254.593 1.00 0.00 C +ATOM 21 CA LEU A 21 229.218 259.268 252.072 1.00 0.00 C +ATOM 22 CA ALA A 22 229.207 261.253 248.821 1.00 0.00 C +ATOM 23 CA GLY A 23 227.892 263.238 245.846 1.00 0.00 C +ATOM 24 CA PRO A 24 224.147 263.518 246.484 1.00 0.00 C +ATOM 25 CA PRO A 25 220.388 263.776 245.913 1.00 0.00 C +ATOM 26 CA ARG A 26 218.294 262.989 242.829 1.00 0.00 C +ATOM 27 CA VAL A 27 218.319 260.664 239.811 1.00 0.00 C +ATOM 28 CA ALA A 28 218.137 257.011 240.877 1.00 0.00 C +ATOM 29 CA SER A 29 217.354 253.442 241.955 1.00 0.00 C +ATOM 30 CA PRO A 30 214.388 252.929 244.291 1.00 0.00 C +ATOM 31 CA SER A 31 211.044 251.346 245.203 1.00 0.00 C +ATOM 32 CA GLN A 32 207.360 250.964 244.310 1.00 0.00 C +ATOM 33 CA ALA A 33 203.975 250.851 242.565 1.00 0.00 C +ATOM 34 CA THR A 34 201.945 249.426 239.672 1.00 0.00 C +ATOM 35 CA GLU A 35 200.948 248.171 236.216 1.00 0.00 C +ATOM 36 CA ARG A 36 198.626 246.412 233.760 1.00 0.00 C +ATOM 37 CA ARG A 37 195.938 244.045 235.060 1.00 0.00 C +ATOM 38 CA LEU A 38 192.743 242.894 236.787 1.00 0.00 C +ATOM 39 CA PRO A 39 190.534 240.004 235.652 1.00 0.00 C +ATOM 40 CA PRO A 40 188.570 238.398 232.810 1.00 0.00 C +ATOM 41 CA ARG A 41 184.855 239.120 233.250 1.00 0.00 C +ATOM 42 CA GLN A 42 183.471 238.706 236.776 1.00 0.00 C +ATOM 43 CA ALA A 43 184.789 240.115 240.061 1.00 0.00 C +ATOM 44 CA ALA A 44 185.506 239.014 243.637 1.00 0.00 C +ATOM 45 CA ALA A 45 183.249 240.172 246.480 1.00 0.00 C +ATOM 46 CA ARG A 46 182.095 237.880 249.297 1.00 0.00 C +ATOM 47 CA ARG A 47 181.821 237.415 253.068 1.00 0.00 C +ATOM 48 CA LEU A 48 182.575 236.833 256.757 1.00 0.00 C +ATOM 49 CA SER A 49 185.652 234.640 257.241 1.00 0.00 C +ATOM 50 CA SER A 50 187.744 233.565 254.243 1.00 0.00 C +ATOM 51 CA PRO A 51 187.603 229.764 254.014 1.00 0.00 C +ATOM 52 CA GLY A 52 190.250 227.335 255.282 1.00 0.00 C +ATOM 53 CA ARG A 53 193.712 226.317 256.504 1.00 0.00 C +ATOM 54 CA LEU A 54 195.301 228.055 259.499 1.00 0.00 C +ATOM 55 CA ALA A 55 196.304 231.687 260.063 1.00 0.00 C +ATOM 56 CA PRO A 56 198.996 232.973 262.432 1.00 0.00 C +ATOM 57 CA PRO A 57 201.186 235.338 260.400 1.00 0.00 C +ATOM 58 CA LEU A 58 202.195 234.618 256.797 1.00 0.00 C +ATOM 59 CA LEU A 59 203.782 233.558 253.500 1.00 0.00 C +ATOM 60 CA ALA A 60 203.924 229.821 252.769 1.00 0.00 C +ATOM 61 CA GLY A 61 205.812 226.881 254.288 1.00 0.00 C +ATOM 62 CA PRO A 62 208.161 224.278 252.798 1.00 0.00 C +ATOM 63 CA PRO A 63 206.730 223.521 249.349 1.00 0.00 C +ATOM 64 CA SER A 64 206.654 226.752 247.331 1.00 0.00 C +ATOM 65 CA ALA A 65 205.127 228.421 244.265 1.00 0.00 C +ATOM 66 CA ALA A 66 206.328 230.939 241.670 1.00 0.00 C +ATOM 67 CA SER A 67 208.497 231.942 238.703 1.00 0.00 C +ATOM 68 CA PRO A 68 211.377 229.484 238.279 1.00 0.00 C +ATOM 69 CA CYS A 69 212.331 227.266 235.332 1.00 0.00 C +ATOM 70 CA GLN A 70 215.492 225.163 235.018 1.00 0.00 C +ATOM 71 CA ALA A 71 218.422 226.065 237.280 1.00 0.00 C +ATOM 72 CA ALA A 72 216.838 227.567 240.403 1.00 0.00 C +ATOM 73 CA ALA A 73 219.594 229.577 242.099 1.00 0.00 C +ATOM 74 CA ARG A 74 223.347 229.654 241.449 1.00 0.00 C +ATOM 75 CA ARG A 75 224.956 233.094 241.143 1.00 0.00 C +ATOM 76 CA LEU A 76 227.683 233.740 243.724 1.00 0.00 C +ATOM 77 CA PRO A 77 231.032 235.402 242.992 1.00 0.00 C +ATOM 78 CA PRO A 78 232.397 238.923 242.484 1.00 0.00 C +ATOM 79 CA PRO A 79 232.573 242.534 241.282 1.00 0.00 C +ATOM 80 CA ARG A 80 234.987 245.066 242.791 1.00 0.00 C +ATOM 81 CA ALA A 81 238.776 245.024 242.398 1.00 0.00 C +ATOM 82 CA ALA A 82 242.373 245.299 243.623 1.00 0.00 C +ATOM 83 CA LYS A 83 245.347 244.888 241.278 1.00 0.00 C +ATOM 84 CA HIS A 84 244.815 246.108 237.708 1.00 0.00 C +ATOM 85 CA ARG A 85 241.342 247.670 237.627 1.00 0.00 C +ATOM 86 CA LEU A 86 239.350 250.558 236.139 1.00 0.00 C +ATOM 87 CA PRO A 87 238.688 254.022 237.580 1.00 0.00 C +ATOM 88 CA PRO A 88 237.764 255.284 241.054 1.00 0.00 C +ATOM 89 CA ARG A 89 235.009 257.750 241.974 1.00 0.00 C +ATOM 90 CA ARG A 90 233.470 258.845 245.282 1.00 0.00 C +ATOM 91 CA ALA A 91 233.107 256.316 248.109 1.00 0.00 C +ATOM 92 CA THR A 92 234.394 252.730 248.093 1.00 0.00 C +ATOM 93 CA ASP A 93 233.106 250.762 251.090 1.00 0.00 C +ATOM 94 CA ARG A 94 235.930 249.554 253.345 1.00 0.00 C +ATOM 95 CA ARG A 95 239.734 249.462 253.524 1.00 0.00 C +ATOM 96 CA LEU A 96 243.181 250.949 252.869 1.00 0.00 C +ATOM 97 CA PRO A 97 245.383 254.044 252.587 1.00 0.00 C +ATOM 98 CA PRO A 98 246.207 257.752 252.278 1.00 0.00 C +ATOM 99 CA ARG A 99 244.515 260.991 253.356 1.00 0.00 C +ATOM 100 CA PRO A 100 241.053 262.512 252.894 1.00 0.00 C +ATOM 101 CA ALA A 101 238.568 259.651 253.283 1.00 0.00 C +ATOM 102 CA ALA A 102 239.143 256.965 250.642 1.00 0.00 C +ATOM 103 CA GLY A 103 241.219 256.720 247.458 1.00 0.00 C +ATOM 104 CA PRO A 104 243.283 255.829 244.381 1.00 0.00 C +ATOM 105 CA PRO A 105 246.254 253.508 243.833 1.00 0.00 C +ATOM 106 CA THR A 106 248.495 253.174 246.896 1.00 0.00 C +ATOM 107 CA ALA A 107 251.598 255.341 247.338 1.00 0.00 C +ATOM 108 CA ALA A 108 253.326 258.502 246.100 1.00 0.00 C +ATOM 109 CA SER A 109 252.072 260.856 243.379 1.00 0.00 C +ATOM 110 CA LEU A 110 254.505 262.701 241.100 1.00 0.00 C +ATOM 111 CA LEU A 111 254.789 266.143 239.491 1.00 0.00 C +ATOM 112 CA ALA A 112 257.664 268.583 238.946 1.00 0.00 C +ATOM 113 CA ARG A 113 261.444 269.057 238.902 1.00 0.00 C +ATOM 114 CA PRO A 114 262.962 265.923 240.448 1.00 0.00 C +ATOM 115 CA PRO A 115 266.247 266.268 242.348 1.00 0.00 C +ATOM 116 CA GLY A 116 269.148 268.622 243.092 1.00 0.00 C +ATOM 117 CA ARG A 117 271.812 270.922 244.552 1.00 0.00 C +ATOM 118 CA ARG A 118 274.307 273.583 243.451 1.00 0.00 C +ATOM 119 CA ALA A 119 275.505 277.031 244.542 1.00 0.00 C +ATOM 120 CA LEU A 120 278.472 278.000 246.727 1.00 0.00 C +ATOM 121 CA PRO A 121 281.351 276.123 248.372 1.00 0.00 C +ATOM 122 CA PRO A 122 280.910 273.160 250.727 1.00 0.00 C +ATOM 123 CA SER A 123 282.050 270.084 248.790 1.00 0.00 C +ATOM 124 CA SER A 124 285.326 268.427 247.770 1.00 0.00 C +ATOM 125 CA PRO A 125 284.652 264.878 246.561 1.00 0.00 C +ATOM 126 CA GLY A 126 287.265 262.443 247.887 1.00 0.00 C +ATOM 127 CA ARG A 127 290.849 262.283 246.602 1.00 0.00 C +ATOM 128 CA ARG A 128 290.642 261.785 242.830 1.00 0.00 C +ATOM 129 CA ALA A 129 287.611 260.328 241.040 1.00 0.00 C +ATOM 130 CA SER A 130 285.577 257.111 241.216 1.00 0.00 C +ATOM 131 CA PRO A 131 285.578 254.327 243.818 1.00 0.00 C +ATOM 132 CA LEU A 132 287.847 251.458 242.751 1.00 0.00 C +ATOM 133 CA LEU A 133 288.986 249.546 239.659 1.00 0.00 C +ATOM 134 CA ALA A 134 292.287 248.950 237.851 1.00 0.00 C +ATOM 135 CA TRP A 135 295.301 251.023 236.788 1.00 0.00 C +ATOM 136 CA PRO A 136 297.402 249.312 234.109 1.00 0.00 C +ATOM 137 CA PRO A 137 298.625 249.395 230.502 1.00 0.00 C +ATOM 138 CA ARG A 138 297.760 249.786 226.812 1.00 0.00 C +ATOM 139 CA ALA A 139 300.406 248.435 224.427 1.00 0.00 C +ATOM 140 CA ALA A 140 303.999 249.587 224.950 1.00 0.00 C +ATOM 141 CA SER A 141 305.863 250.717 228.076 1.00 0.00 C +ATOM 142 CA LEU A 142 308.742 248.694 229.537 1.00 0.00 C +ATOM 143 CA LEU A 143 312.239 248.908 231.033 1.00 0.00 C +ATOM 144 CA ALA A 144 315.880 248.645 232.125 1.00 0.00 C +ATOM 145 CA ARG A 145 319.324 247.204 232.883 1.00 0.00 C +ATOM 146 CA PRO A 146 321.113 245.914 235.990 1.00 0.00 C +ATOM 147 CA PRO A 147 323.454 247.790 238.339 1.00 0.00 C +ATOM 148 CA ARG A 148 325.930 249.630 240.575 1.00 0.00 C +ATOM 149 CA ALA A 149 326.364 253.412 240.710 1.00 0.00 C +ATOM 150 CA ALA A 150 325.427 255.934 243.408 1.00 0.00 C +ATOM 151 CA ILE A 151 325.428 259.056 245.592 1.00 0.00 C +ATOM 152 CA PRO A 152 326.412 259.758 249.206 1.00 0.00 C +ATOM 153 CA HIS A 153 326.651 258.793 252.884 1.00 0.00 C +ATOM 154 CA PRO A 154 326.304 258.222 256.634 1.00 0.00 C +ATOM 155 CA ASP A 155 327.576 258.353 260.224 1.00 0.00 C +ATOM 156 CA THR A 156 330.488 257.696 262.591 1.00 0.00 C +ATOM 157 CA ALA A 157 330.769 253.921 263.027 1.00 0.00 C +ATOM 158 CA ARG A 158 332.155 252.150 266.103 1.00 0.00 C +ATOM 159 CA HIS A 159 334.581 249.328 265.287 1.00 0.00 C +ATOM 160 CA LEU A 160 332.979 246.246 263.722 1.00 0.00 C +ATOM 161 CA GLY A 161 332.881 243.407 261.183 1.00 0.00 C +ATOM 162 CA ASP A 162 331.254 240.290 259.716 1.00 0.00 C +ATOM 163 CA GLY A 163 330.281 236.783 260.845 1.00 0.00 C +ATOM 164 CA ARG A 164 332.532 234.431 262.825 1.00 0.00 C +ATOM 165 CA SER A 165 334.257 232.245 265.425 1.00 0.00 C +ATOM 166 CA GLU A 166 336.071 231.779 268.742 1.00 0.00 C +ATOM 167 CA ARG A 167 336.455 232.183 272.511 1.00 0.00 C +ATOM 168 CA GLU A 168 335.567 235.744 273.535 1.00 0.00 C +ATOM 169 CA GLU A 169 333.366 236.402 276.574 1.00 0.00 C +ATOM 170 CA GLU A 170 331.018 237.626 279.313 1.00 0.00 C +ATOM 171 CA GLU A 171 332.462 237.462 282.835 1.00 0.00 C +ATOM 172 CA GLU A 172 334.239 234.911 285.038 1.00 0.00 C +ATOM 173 CA GLY A 173 332.055 234.141 288.063 1.00 0.00 C +ATOM 174 CA LEU A 174 329.000 231.912 287.604 1.00 0.00 C +TER 175 LEU A 174 +END diff --git a/Plants/Q8GRT1/Q8GRT1.dcd b/Plants/Q8GRT1/Q8GRT1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..a401c9370a9357c6e3b07aa4bd4b5cb296a2a741 --- /dev/null +++ b/Plants/Q8GRT1/Q8GRT1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:a5b7c180833a5aff036c83ba70ed51c1eab4eb6cfbb3054ac66d957ca0654cff +size 38820276 diff --git a/Plants/Q8GRT1/top.pdb b/Plants/Q8GRT1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..514e1468393fe1d47a14477f09390878b195fcc4 --- /dev/null +++ b/Plants/Q8GRT1/top.pdb @@ -0,0 +1,213 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 271.617 203.538 256.122 1.00 0.00 C +ATOM 2 CA HIS A 2 268.317 205.095 255.025 1.00 0.00 C +ATOM 3 CA GLY A 3 265.571 203.704 257.271 1.00 0.00 C +ATOM 4 CA GLY A 4 265.706 205.207 260.769 1.00 0.00 C +ATOM 5 CA ALA A 5 266.363 206.714 264.206 1.00 0.00 C +ATOM 6 CA ARG A 6 266.989 207.651 267.846 1.00 0.00 C +ATOM 7 CA CYS A 7 267.960 209.834 270.813 1.00 0.00 C +ATOM 8 CA GLU A 8 270.982 211.122 272.743 1.00 0.00 C +ATOM 9 CA THR A 9 271.010 211.685 276.511 1.00 0.00 C +ATOM 10 CA ARG A 10 269.113 214.565 278.132 1.00 0.00 C +ATOM 11 CA ARG A 11 267.704 214.259 281.659 1.00 0.00 C +ATOM 12 CA GLY A 12 265.701 213.044 284.663 1.00 0.00 C +ATOM 13 CA LYS A 13 264.396 214.664 287.855 1.00 0.00 C +ATOM 14 CA ARG A 14 261.995 216.625 290.071 1.00 0.00 C +ATOM 15 CA ARG A 15 258.889 216.537 292.276 1.00 0.00 C +ATOM 16 CA ARG A 16 255.629 214.932 291.130 1.00 0.00 C +ATOM 17 CA ARG A 17 251.924 214.423 291.859 1.00 0.00 C +ATOM 18 CA PRO A 18 250.469 216.917 294.344 1.00 0.00 C +ATOM 19 CA GLY A 19 246.847 218.067 294.072 1.00 0.00 C +ATOM 20 CA ARG A 20 245.344 220.868 291.972 1.00 0.00 C +ATOM 21 CA VAL A 21 248.321 223.063 291.060 1.00 0.00 C +ATOM 22 CA GLY A 22 251.567 225.058 291.000 1.00 0.00 C +ATOM 23 CA GLU A 23 255.020 226.648 290.751 1.00 0.00 C +ATOM 24 CA ALA A 24 257.751 223.995 290.891 1.00 0.00 C +ATOM 25 CA ALA A 25 259.412 223.039 287.597 1.00 0.00 C +ATOM 26 CA ALA A 26 258.419 223.073 283.919 1.00 0.00 C +ATOM 27 CA SER A 27 259.487 222.422 280.320 1.00 0.00 C +ATOM 28 CA GLY A 28 263.251 223.001 280.219 1.00 0.00 C +ATOM 29 CA ARG A 29 266.852 223.955 279.419 1.00 0.00 C +ATOM 30 CA ALA A 30 268.765 222.638 276.399 1.00 0.00 C +ATOM 31 CA GLY A 31 266.731 219.790 274.894 1.00 0.00 C +ATOM 32 CA ALA A 32 265.611 220.745 271.379 1.00 0.00 C +ATOM 33 CA ALA A 33 265.715 218.196 268.549 1.00 0.00 C +ATOM 34 CA ALA A 34 265.480 216.410 265.192 1.00 0.00 C +ATOM 35 CA ALA A 35 266.254 215.638 261.542 1.00 0.00 C +ATOM 36 CA ALA A 36 269.696 215.651 259.907 1.00 0.00 C +ATOM 37 CA ALA A 37 270.171 219.164 258.512 1.00 0.00 C +ATOM 38 CA THR A 38 267.948 221.836 256.952 1.00 0.00 C +ATOM 39 CA ALA A 39 265.303 223.918 258.737 1.00 0.00 C +ATOM 40 CA ALA A 40 267.080 225.242 261.836 1.00 0.00 C +ATOM 41 CA SER A 41 267.212 226.692 265.357 1.00 0.00 C +ATOM 42 CA ARG A 42 269.155 228.464 268.114 1.00 0.00 C +ATOM 43 CA VAL A 43 272.241 229.905 266.405 1.00 0.00 C +ATOM 44 CA ALA A 44 275.052 232.287 265.437 1.00 0.00 C +ATOM 45 CA TRP A 45 276.867 235.633 265.609 1.00 0.00 C +ATOM 46 CA GLY A 46 278.896 238.778 264.898 1.00 0.00 C +ATOM 47 CA SER A 47 280.170 242.321 265.484 1.00 0.00 C +ATOM 48 CA GLY A 48 278.421 245.703 265.371 1.00 0.00 C +ATOM 49 CA GLY A 49 276.806 246.451 262.002 1.00 0.00 C +ATOM 50 CA VAL A 50 276.649 249.565 259.812 1.00 0.00 C +ATOM 51 CA ARG A 51 276.895 250.875 256.243 1.00 0.00 C +ATOM 52 CA GLU A 52 278.908 249.878 253.165 1.00 0.00 C +ATOM 53 CA GLY A 53 279.889 251.673 249.950 1.00 0.00 C +ATOM 54 CA TRP A 54 277.862 250.889 246.821 1.00 0.00 C +ATOM 55 CA GLY A 55 274.648 252.398 245.441 1.00 0.00 C +ATOM 56 CA GLY A 56 271.751 251.387 247.700 1.00 0.00 C +ATOM 57 CA GLY A 57 270.263 252.368 251.068 1.00 0.00 C +ATOM 58 CA GLY A 58 268.767 249.852 253.506 1.00 0.00 C +ATOM 59 CA GLY A 59 267.958 246.270 252.491 1.00 0.00 C +ATOM 60 CA ASP A 60 265.998 243.159 253.489 1.00 0.00 C +ATOM 61 CA GLY A 61 263.281 242.450 256.065 1.00 0.00 C +ATOM 62 CA GLY A 62 262.857 244.363 259.333 1.00 0.00 C +ATOM 63 CA VAL A 63 260.714 247.398 260.175 1.00 0.00 C +ATOM 64 CA GLN A 64 261.261 250.933 258.862 1.00 0.00 C +ATOM 65 CA GLY A 65 264.640 252.551 259.553 1.00 0.00 C +ATOM 66 CA GLY A 66 265.603 256.166 258.831 1.00 0.00 C +ATOM 67 CA LEU A 67 267.731 259.074 260.070 1.00 0.00 C +ATOM 68 CA GLY A 68 269.321 259.928 263.425 1.00 0.00 C +ATOM 69 CA LYS A 69 272.550 261.617 264.536 1.00 0.00 C +ATOM 70 CA GLN A 70 276.069 260.528 263.563 1.00 0.00 C +ATOM 71 CA PRO A 71 279.289 258.549 264.040 1.00 0.00 C +ATOM 72 CA GLN A 72 282.287 258.696 261.694 1.00 0.00 C +ATOM 73 CA ARG A 73 281.230 260.291 258.399 1.00 0.00 C +ATOM 74 CA ARG A 74 278.361 262.720 257.782 1.00 0.00 C +ATOM 75 CA ARG A 75 279.576 266.223 258.658 1.00 0.00 C +ATOM 76 CA ARG A 76 280.277 269.724 259.987 1.00 0.00 C +ATOM 77 CA PHE A 77 278.630 272.495 257.955 1.00 0.00 C +ATOM 78 CA PRO A 78 278.478 272.364 254.150 1.00 0.00 C +ATOM 79 CA GLY A 79 275.988 274.300 252.013 1.00 0.00 C +ATOM 80 CA TRP A 80 272.518 275.814 251.583 1.00 0.00 C +ATOM 81 CA VAL A 81 269.214 276.764 249.941 1.00 0.00 C +ATOM 82 CA GLY A 82 265.912 274.865 250.028 1.00 0.00 C +ATOM 83 CA GLU A 83 262.758 273.476 251.651 1.00 0.00 C +ATOM 84 CA ALA A 84 260.622 270.681 250.188 1.00 0.00 C +ATOM 85 CA GLY A 85 260.966 269.484 246.587 1.00 0.00 C +ATOM 86 CA ALA A 86 259.640 272.299 244.387 1.00 0.00 C +ATOM 87 CA ALA A 87 256.908 273.914 242.280 1.00 0.00 C +ATOM 88 CA ALA A 88 254.261 273.404 239.587 1.00 0.00 C +ATOM 89 CA ALA A 89 255.723 272.811 236.119 1.00 0.00 C +ATOM 90 CA SER A 90 257.656 273.423 232.893 1.00 0.00 C +ATOM 91 CA ARG A 91 261.360 272.680 232.394 1.00 0.00 C +ATOM 92 CA VAL A 92 262.767 269.571 234.089 1.00 0.00 C +ATOM 93 CA GLY A 93 266.116 267.798 234.484 1.00 0.00 C +ATOM 94 CA GLY A 94 267.552 267.835 238.013 1.00 0.00 C +ATOM 95 CA GLU A 95 268.786 269.879 240.982 1.00 0.00 C +ATOM 96 CA VAL A 96 268.523 269.270 244.734 1.00 0.00 C +ATOM 97 CA ALA A 97 268.891 269.418 248.523 1.00 0.00 C +ATOM 98 CA ALA A 98 268.525 267.256 251.639 1.00 0.00 C +ATOM 99 CA MET A 99 271.490 267.592 254.007 1.00 0.00 C +ATOM 100 CA THR A 100 271.043 265.220 256.954 1.00 0.00 C +ATOM 101 CA THR A 101 267.540 264.935 258.425 1.00 0.00 C +ATOM 102 CA PRO A 102 264.279 266.878 258.105 1.00 0.00 C +ATOM 103 CA SER A 103 263.474 269.217 261.003 1.00 0.00 C +ATOM 104 CA ARG A 104 261.264 272.243 260.312 1.00 0.00 C +ATOM 105 CA SER A 105 260.331 275.701 259.012 1.00 0.00 C +ATOM 106 CA ASN A 106 259.799 277.945 255.980 1.00 0.00 C +ATOM 107 CA GLY A 107 258.920 281.265 254.329 1.00 0.00 C +ATOM 108 CA GLY A 108 258.061 283.097 251.101 1.00 0.00 C +ATOM 109 CA SER A 109 256.888 281.057 248.105 1.00 0.00 C +ATOM 110 CA GLY A 110 254.486 278.126 248.501 1.00 0.00 C +ATOM 111 CA GLY A 111 250.981 279.200 247.462 1.00 0.00 C +ATOM 112 CA GLY A 112 247.411 278.743 246.213 1.00 0.00 C +ATOM 113 CA ALA A 113 245.554 275.860 247.874 1.00 0.00 C +ATOM 114 CA LEU A 114 241.931 274.822 247.313 1.00 0.00 C +ATOM 115 CA GLN A 115 238.871 277.047 247.767 1.00 0.00 C +ATOM 116 CA GLY A 116 235.530 276.172 246.158 1.00 0.00 C +ATOM 117 CA ARG A 117 233.048 273.632 247.538 1.00 0.00 C +ATOM 118 CA GLN A 118 229.255 273.821 247.845 1.00 0.00 C +ATOM 119 CA GLY A 119 226.860 276.784 247.831 1.00 0.00 C +ATOM 120 CA ASN A 120 227.989 280.392 248.304 1.00 0.00 C +ATOM 121 CA ARG A 121 228.313 282.319 251.575 1.00 0.00 C +ATOM 122 CA ARG A 122 231.830 281.644 252.875 1.00 0.00 C +ATOM 123 CA ARG A 123 233.836 278.609 251.743 1.00 0.00 C +ATOM 124 CA ARG A 124 236.925 277.395 253.613 1.00 0.00 C +ATOM 125 CA VAL A 125 238.142 276.824 257.178 1.00 0.00 C +ATOM 126 CA GLN A 126 241.263 275.331 258.774 1.00 0.00 C +ATOM 127 CA ARG A 127 244.066 274.420 256.359 1.00 0.00 C +ATOM 128 CA GLU A 128 243.497 271.906 253.553 1.00 0.00 C +ATOM 129 CA ARG A 129 246.077 269.105 253.684 1.00 0.00 C +ATOM 130 CA GLN A 130 247.143 266.697 256.437 1.00 0.00 C +ATOM 131 CA ARG A 131 246.987 263.797 258.903 1.00 0.00 C +ATOM 132 CA ALA A 132 247.133 261.743 262.109 1.00 0.00 C +ATOM 133 CA ARG A 133 250.726 261.737 263.377 1.00 0.00 C +ATOM 134 CA GLN A 134 252.990 261.025 260.396 1.00 0.00 C +ATOM 135 CA GLY A 135 256.481 262.210 259.434 1.00 0.00 C +ATOM 136 CA THR A 136 256.492 263.211 255.758 1.00 0.00 C +ATOM 137 CA GLY A 137 254.911 262.739 252.324 1.00 0.00 C +ATOM 138 CA ALA A 138 255.677 260.064 249.722 1.00 0.00 C +ATOM 139 CA ARG A 139 254.624 261.581 246.389 1.00 0.00 C +ATOM 140 CA ALA A 140 251.036 261.329 245.132 1.00 0.00 C +ATOM 141 CA TRP A 141 249.272 263.896 242.937 1.00 0.00 C +ATOM 142 CA ALA A 142 248.968 267.018 240.774 1.00 0.00 C +ATOM 143 CA GLY A 143 252.345 267.654 239.130 1.00 0.00 C +ATOM 144 CA ARG A 144 253.624 266.355 235.784 1.00 0.00 C +ATOM 145 CA LEU A 145 251.898 263.886 233.451 1.00 0.00 C +ATOM 146 CA ALA A 146 250.396 261.076 235.540 1.00 0.00 C +ATOM 147 CA SER A 147 246.672 261.480 236.236 1.00 0.00 C +ATOM 148 CA LEU A 148 245.312 264.314 234.082 1.00 0.00 C +ATOM 149 CA ARG A 149 241.716 265.224 234.954 1.00 0.00 C +ATOM 150 CA ARG A 150 239.763 265.039 238.220 1.00 0.00 C +ATOM 151 CA ARG A 151 241.773 266.156 241.258 1.00 0.00 C +ATOM 152 CA HIS A 152 242.572 267.667 244.663 1.00 0.00 C +ATOM 153 CA LEU A 153 244.455 266.499 247.763 1.00 0.00 C +ATOM 154 CA ILE A 154 244.425 262.813 248.724 1.00 0.00 C +ATOM 155 CA PRO A 155 245.368 260.181 251.313 1.00 0.00 C +ATOM 156 CA ARG A 156 245.268 256.382 251.040 1.00 0.00 C +ATOM 157 CA CYS A 157 244.351 254.154 248.089 1.00 0.00 C +ATOM 158 CA SER A 158 242.894 256.422 245.397 1.00 0.00 C +ATOM 159 CA PRO A 159 242.238 259.819 243.800 1.00 0.00 C +ATOM 160 CA PRO A 160 240.632 259.186 240.404 1.00 0.00 C +ATOM 161 CA PRO A 161 236.867 259.139 240.988 1.00 0.00 C +ATOM 162 CA PRO A 162 235.239 257.551 237.931 1.00 0.00 C +ATOM 163 CA PRO A 163 234.265 258.016 234.277 1.00 0.00 C +ATOM 164 CA PRO A 164 232.031 255.641 232.306 1.00 0.00 C +ATOM 165 CA PRO A 165 229.188 255.208 229.807 1.00 0.00 C +ATOM 166 CA ARG A 166 227.030 258.241 228.994 1.00 0.00 C +ATOM 167 CA LEU A 167 223.880 256.911 227.314 1.00 0.00 C +ATOM 168 CA ALA A 168 220.151 257.524 226.826 1.00 0.00 C +ATOM 169 CA SER A 169 218.144 257.146 223.609 1.00 0.00 C +ATOM 170 CA ALA A 170 214.718 255.705 222.770 1.00 0.00 C +ATOM 171 CA ALA A 171 211.157 255.417 224.094 1.00 0.00 C +ATOM 172 CA LEU A 172 207.578 255.827 225.335 1.00 0.00 C +ATOM 173 CA ALA A 173 205.265 256.432 228.301 1.00 0.00 C +ATOM 174 CA SER A 174 203.905 257.151 231.786 1.00 0.00 C +ATOM 175 CA SER A 175 202.884 255.847 235.218 1.00 0.00 C +ATOM 176 CA ALA A 176 201.381 258.457 237.552 1.00 0.00 C +ATOM 177 CA ALA A 177 200.073 257.352 240.955 1.00 0.00 C +ATOM 178 CA PRO A 178 196.457 256.208 240.589 1.00 0.00 C +ATOM 179 CA ARG A 179 195.788 252.844 238.930 1.00 0.00 C +ATOM 180 CA ARG A 180 199.092 251.014 238.433 1.00 0.00 C +ATOM 181 CA LEU A 181 199.702 250.432 234.718 1.00 0.00 C +ATOM 182 CA ILE A 182 200.352 251.631 231.160 1.00 0.00 C +ATOM 183 CA PRO A 183 202.008 248.716 229.350 1.00 0.00 C +ATOM 184 CA CYS A 184 202.423 248.639 225.563 1.00 0.00 C +ATOM 185 CA ARG A 185 204.782 250.744 223.437 1.00 0.00 C +ATOM 186 CA ARG A 186 207.257 250.098 220.613 1.00 0.00 C +ATOM 187 CA LEU A 187 210.954 249.716 219.774 1.00 0.00 C +ATOM 188 CA PRO A 188 213.327 246.784 219.239 1.00 0.00 C +ATOM 189 CA PRO A 189 213.665 243.394 220.945 1.00 0.00 C +ATOM 190 CA PRO A 190 210.164 241.891 221.000 1.00 0.00 C +ATOM 191 CA PRO A 191 209.952 239.094 218.422 1.00 0.00 C +ATOM 192 CA PRO A 192 212.527 237.955 215.855 1.00 0.00 C +ATOM 193 CA HIS A 193 213.600 237.175 212.284 1.00 0.00 C +ATOM 194 CA PRO A 194 217.227 236.567 211.288 1.00 0.00 C +ATOM 195 CA PRO A 195 218.582 233.115 212.161 1.00 0.00 C +ATOM 196 CA PRO A 196 219.518 230.608 214.873 1.00 0.00 C +ATOM 197 CA PRO A 197 219.129 227.046 216.166 1.00 0.00 C +ATOM 198 CA PRO A 198 221.312 224.925 218.459 1.00 0.00 C +ATOM 199 CA PRO A 199 224.767 224.304 216.979 1.00 0.00 C +ATOM 200 CA LEU A 200 228.242 223.141 215.935 1.00 0.00 C +ATOM 201 CA THR A 201 231.483 223.175 217.937 1.00 0.00 C +ATOM 202 CA GLY A 202 232.967 221.665 221.105 1.00 0.00 C +ATOM 203 CA PRO A 203 236.268 223.380 221.929 1.00 0.00 C +ATOM 204 CA ALA A 204 237.608 226.934 221.637 1.00 0.00 C +ATOM 205 CA CYS A 205 241.293 227.861 221.359 1.00 0.00 C +ATOM 206 CA ARG A 206 244.299 226.134 219.777 1.00 0.00 C +ATOM 207 CA CYS A 207 245.003 222.563 218.651 1.00 0.00 C +ATOM 208 CA ASP A 208 246.968 219.938 216.712 1.00 0.00 C +ATOM 209 CA SER A 209 249.823 217.596 217.652 1.00 0.00 C +TER 210 SER A 209 +END diff --git a/Plants/Q8GSC7/Q8GSC7.dcd b/Plants/Q8GSC7/Q8GSC7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..265b449bc5a8fdff913a87ec0875de0acc1eb05a --- /dev/null +++ b/Plants/Q8GSC7/Q8GSC7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:d74c8b6f428465dbe6c019bfd421ac81771ab6fd6b50830adc7b8918ea355c6c +size 14720276 diff --git a/Plants/Q8GSC7/top.pdb b/Plants/Q8GSC7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..40c8978acea5c1bc9d8ed9629029b8457276e76d --- /dev/null +++ b/Plants/Q8GSC7/top.pdb @@ -0,0 +1,120 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 274.376 242.856 254.943 1.00 0.00 C +ATOM 2 CA PRO A 2 273.214 239.377 253.914 1.00 0.00 C +ATOM 3 CA SER A 3 269.691 237.946 254.158 1.00 0.00 C +ATOM 4 CA ARG A 4 266.842 235.448 253.766 1.00 0.00 C +ATOM 5 CA ARG A 5 265.795 232.553 256.012 1.00 0.00 C +ATOM 6 CA ARG A 6 262.297 231.047 255.912 1.00 0.00 C +ATOM 7 CA HIS A 7 261.409 230.764 252.218 1.00 0.00 C +ATOM 8 CA ALA A 8 258.919 233.515 251.355 1.00 0.00 C +ATOM 9 CA ASP A 9 256.097 234.886 253.518 1.00 0.00 C +ATOM 10 CA PRO A 10 253.972 233.886 256.517 1.00 0.00 C +ATOM 11 CA GLY A 11 255.271 230.482 257.632 1.00 0.00 C +ATOM 12 CA GLU A 12 254.534 226.772 257.174 1.00 0.00 C +ATOM 13 CA GLU A 13 255.435 224.926 260.384 1.00 0.00 C +ATOM 14 CA GLY A 14 258.531 222.896 261.283 1.00 0.00 C +ATOM 15 CA PRO A 15 260.503 223.232 264.525 1.00 0.00 C +ATOM 16 CA ASP A 16 261.034 221.935 268.068 1.00 0.00 C +ATOM 17 CA PRO A 17 258.958 222.241 271.248 1.00 0.00 C +ATOM 18 CA ALA A 18 256.608 219.828 273.028 1.00 0.00 C +ATOM 19 CA ILE A 19 253.185 218.521 271.981 1.00 0.00 C +ATOM 20 CA GLY A 20 251.872 215.940 269.505 1.00 0.00 C +ATOM 21 CA ALA A 21 251.330 212.728 271.481 1.00 0.00 C +ATOM 22 CA PRO A 22 250.235 209.136 272.124 1.00 0.00 C +ATOM 23 CA ASP A 23 247.242 206.778 272.193 1.00 0.00 C +ATOM 24 CA PRO A 24 246.395 203.085 272.593 1.00 0.00 C +ATOM 25 CA PRO A 25 246.222 199.348 271.874 1.00 0.00 C +ATOM 26 CA PRO A 26 245.355 198.437 268.277 1.00 0.00 C +ATOM 27 CA PRO A 27 244.835 198.830 264.523 1.00 0.00 C +ATOM 28 CA LEU A 28 242.595 201.293 262.670 1.00 0.00 C +ATOM 29 CA HIS A 29 242.027 203.167 259.402 1.00 0.00 C +ATOM 30 CA LEU A 30 243.679 206.600 259.346 1.00 0.00 C +ATOM 31 CA ALA A 31 242.122 208.410 256.377 1.00 0.00 C +ATOM 32 CA ALA A 32 244.781 210.658 254.830 1.00 0.00 C +ATOM 33 CA VAL A 33 248.509 210.320 254.122 1.00 0.00 C +ATOM 34 CA ALA A 34 251.669 209.950 252.025 1.00 0.00 C +ATOM 35 CA ALA A 35 253.284 210.316 248.594 1.00 0.00 C +ATOM 36 CA MET A 36 255.956 213.031 248.623 1.00 0.00 C +ATOM 37 CA ASP A 37 255.422 215.157 251.739 1.00 0.00 C +ATOM 38 CA HIS A 38 256.223 218.879 251.587 1.00 0.00 C +ATOM 39 CA ALA A 39 254.981 222.438 252.142 1.00 0.00 C +ATOM 40 CA GLY A 40 255.701 225.879 250.673 1.00 0.00 C +ATOM 41 CA ARG A 41 253.339 228.772 249.924 1.00 0.00 C +ATOM 42 CA GLU A 42 252.074 230.967 247.078 1.00 0.00 C +ATOM 43 CA LEU A 43 249.522 233.776 246.745 1.00 0.00 C +ATOM 44 CA ARG A 44 250.641 236.994 248.451 1.00 0.00 C +ATOM 45 CA ARG A 45 248.531 238.328 251.330 1.00 0.00 C +ATOM 46 CA LEU A 46 246.799 241.275 253.013 1.00 0.00 C +ATOM 47 CA ARG A 47 247.722 242.665 256.438 1.00 0.00 C +ATOM 48 CA PRO A 48 245.804 244.762 258.976 1.00 0.00 C +ATOM 49 CA SER A 49 244.293 246.656 261.916 1.00 0.00 C +ATOM 50 CA ARG A 50 243.402 249.753 263.948 1.00 0.00 C +ATOM 51 CA ARG A 51 243.379 253.558 264.148 1.00 0.00 C +ATOM 52 CA GLY A 52 245.416 255.891 266.366 1.00 0.00 C +ATOM 53 CA GLY A 53 243.614 259.083 267.405 1.00 0.00 C +ATOM 54 CA ARG A 54 245.419 262.194 268.661 1.00 0.00 C +ATOM 55 CA ARG A 55 246.113 265.937 268.822 1.00 0.00 C +ATOM 56 CA TYR A 56 243.300 267.819 270.573 1.00 0.00 C +ATOM 57 CA GLU A 57 242.582 265.917 273.795 1.00 0.00 C +ATOM 58 CA GLU A 58 239.568 263.654 273.237 1.00 0.00 C +ATOM 59 CA LYS A 59 237.073 261.252 271.648 1.00 0.00 C +ATOM 60 CA LYS A 60 233.694 262.031 270.070 1.00 0.00 C +ATOM 61 CA ALA A 61 230.282 261.608 268.430 1.00 0.00 C +ATOM 62 CA SER A 62 226.850 261.892 266.799 1.00 0.00 C +ATOM 63 CA PRO A 63 225.428 265.003 265.122 1.00 0.00 C +ATOM 64 CA PRO A 64 225.847 266.945 261.871 1.00 0.00 C +ATOM 65 CA PRO A 65 228.596 265.098 259.988 1.00 0.00 C +ATOM 66 CA SER A 66 231.306 267.013 258.115 1.00 0.00 C +ATOM 67 CA LEU A 67 231.164 266.720 254.319 1.00 0.00 C +ATOM 68 CA PRO A 68 229.819 269.128 251.691 1.00 0.00 C +ATOM 69 CA ALA A 69 228.588 272.532 250.501 1.00 0.00 C +ATOM 70 CA ALA A 70 229.235 275.263 253.078 1.00 0.00 C +ATOM 71 CA GLY A 71 233.005 275.813 253.024 1.00 0.00 C +ATOM 72 CA PHE A 72 236.605 275.811 251.778 1.00 0.00 C +ATOM 73 CA ALA A 73 238.336 274.957 248.493 1.00 0.00 C +ATOM 74 CA ALA A 74 238.642 274.057 244.803 1.00 0.00 C +ATOM 75 CA GLY A 75 238.974 276.445 241.853 1.00 0.00 C +ATOM 76 CA GLY A 76 238.330 279.396 239.531 1.00 0.00 C +ATOM 77 CA LEU A 77 239.259 283.062 240.000 1.00 0.00 C +ATOM 78 CA GLN A 78 240.284 284.059 243.531 1.00 0.00 C +ATOM 79 CA ARG A 79 238.899 281.642 246.131 1.00 0.00 C +ATOM 80 CA ARG A 80 239.572 280.833 249.793 1.00 0.00 C +ATOM 81 CA ARG A 81 242.732 281.207 251.888 1.00 0.00 C +ATOM 82 CA GLY A 82 245.892 279.719 250.365 1.00 0.00 C +ATOM 83 CA GLY A 83 248.335 277.022 249.239 1.00 0.00 C +ATOM 84 CA GLY A 84 249.303 275.734 245.786 1.00 0.00 C +ATOM 85 CA ARG A 85 249.118 272.404 243.944 1.00 0.00 C +ATOM 86 CA GLU A 86 246.216 271.353 241.710 1.00 0.00 C +ATOM 87 CA GLY A 87 244.448 270.790 238.383 1.00 0.00 C +ATOM 88 CA GLU A 88 241.098 271.242 236.623 1.00 0.00 C +ATOM 89 CA LYS A 89 238.555 271.926 233.870 1.00 0.00 C +ATOM 90 CA ALA A 90 240.398 272.353 230.563 1.00 0.00 C +ATOM 91 CA GLN A 91 239.530 269.521 228.167 1.00 0.00 C +ATOM 92 CA ALA A 92 240.182 266.781 225.601 1.00 0.00 C +ATOM 93 CA ALA A 93 241.655 263.331 224.932 1.00 0.00 C +ATOM 94 CA ARG A 94 244.404 263.262 222.296 1.00 0.00 C +ATOM 95 CA VAL A 95 247.872 264.785 221.886 1.00 0.00 C +ATOM 96 CA PHE A 96 250.953 263.632 219.964 1.00 0.00 C +ATOM 97 CA ARG A 97 254.755 263.881 219.988 1.00 0.00 C +ATOM 98 CA PRO A 98 257.907 261.974 219.017 1.00 0.00 C +ATOM 99 CA ARG A 99 261.415 261.374 217.656 1.00 0.00 C +ATOM 100 CA ALA A 100 264.704 263.257 217.264 1.00 0.00 C +ATOM 101 CA ALA A 101 266.980 263.433 220.315 1.00 0.00 C +ATOM 102 CA ARG A 102 270.674 264.366 220.320 1.00 0.00 C +ATOM 103 CA ARG A 103 273.480 266.746 221.307 1.00 0.00 C +ATOM 104 CA GLU A 104 275.277 269.445 223.309 1.00 0.00 C +ATOM 105 CA SER A 105 275.333 270.372 227.004 1.00 0.00 C +ATOM 106 CA ASP A 106 273.586 268.884 230.045 1.00 0.00 C +ATOM 107 CA ALA A 107 270.583 269.813 232.197 1.00 0.00 C +ATOM 108 CA GLY A 108 271.384 271.034 235.716 1.00 0.00 C +ATOM 109 CA GLY A 109 269.234 272.945 238.215 1.00 0.00 C +ATOM 110 CA GLY A 110 266.973 275.535 239.858 1.00 0.00 C +ATOM 111 CA LEU A 111 264.614 278.318 238.761 1.00 0.00 C +ATOM 112 CA LYS A 112 261.296 278.626 236.913 1.00 0.00 C +ATOM 113 CA LYS A 113 262.200 279.850 233.420 1.00 0.00 C +ATOM 114 CA HIS A 114 260.704 282.675 231.348 1.00 0.00 C +ATOM 115 CA MET A 115 263.034 285.124 229.590 1.00 0.00 C +ATOM 116 CA ASN A 116 266.760 285.231 228.805 1.00 0.00 C +TER 117 ASN A 116 +END diff --git a/Plants/Q8GSH5/Q8GSH5.dcd b/Plants/Q8GSH5/Q8GSH5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..5487434feeb9a0c5c42aac30062078c735ab4fd4 --- /dev/null +++ b/Plants/Q8GSH5/Q8GSH5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e5c9c72da2cfb6d71fa057a186fa2ed1e300c503b6cdab131f02239be3162ad3 +size 15320276 diff --git a/Plants/Q8GSH5/top.pdb b/Plants/Q8GSH5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a36ec9b50e896b46ffc060b8e827d7f674350deb --- /dev/null +++ b/Plants/Q8GSH5/top.pdb @@ -0,0 +1,125 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 254.261 250.253 218.303 1.00 0.00 C +ATOM 2 CA PRO A 2 257.199 252.255 219.673 1.00 0.00 C +ATOM 3 CA ALA A 3 259.250 253.901 222.430 1.00 0.00 C +ATOM 4 CA ARG A 4 259.485 251.219 225.126 1.00 0.00 C +ATOM 5 CA ALA A 5 259.090 247.855 223.383 1.00 0.00 C +ATOM 6 CA THR A 6 260.579 244.428 222.637 1.00 0.00 C +ATOM 7 CA ALA A 7 260.559 241.418 224.973 1.00 0.00 C +ATOM 8 CA ALA A 8 258.361 241.328 228.083 1.00 0.00 C +ATOM 9 CA ALA A 9 259.660 239.040 230.839 1.00 0.00 C +ATOM 10 CA ASP A 10 260.440 238.721 234.554 1.00 0.00 C +ATOM 11 CA PRO A 11 259.932 241.320 237.293 1.00 0.00 C +ATOM 12 CA ALA A 12 262.243 242.009 240.242 1.00 0.00 C +ATOM 13 CA GLU A 13 264.134 240.359 243.109 1.00 0.00 C +ATOM 14 CA PRO A 14 266.431 237.561 241.922 1.00 0.00 C +ATOM 15 CA PHE A 15 268.468 239.013 239.047 1.00 0.00 C +ATOM 16 CA LEU A 16 269.672 242.552 238.311 1.00 0.00 C +ATOM 17 CA VAL A 17 271.427 244.172 235.343 1.00 0.00 C +ATOM 18 CA ARG A 18 269.410 244.640 232.145 1.00 0.00 C +ATOM 19 CA SER A 19 266.728 245.276 229.515 1.00 0.00 C +ATOM 20 CA ALA A 20 263.763 246.789 231.369 1.00 0.00 C +ATOM 21 CA SER A 21 262.952 248.181 234.822 1.00 0.00 C +ATOM 22 CA SER A 22 264.617 247.736 238.220 1.00 0.00 C +ATOM 23 CA PRO A 23 264.936 249.498 241.582 1.00 0.00 C +ATOM 24 CA SER A 24 262.499 249.779 244.498 1.00 0.00 C +ATOM 25 CA SER A 25 258.998 250.980 243.598 1.00 0.00 C +ATOM 26 CA SER A 26 256.198 253.409 242.713 1.00 0.00 C +ATOM 27 CA LEU A 27 255.271 253.634 239.025 1.00 0.00 C +ATOM 28 CA THR A 28 255.654 252.932 235.300 1.00 0.00 C +ATOM 29 CA GLN A 29 255.809 252.099 231.585 1.00 0.00 C +ATOM 30 CA PRO A 30 253.474 253.308 228.827 1.00 0.00 C +ATOM 31 CA ARG A 31 253.708 256.373 226.575 1.00 0.00 C +ATOM 32 CA PRO A 32 250.601 257.705 224.819 1.00 0.00 C +ATOM 33 CA GLN A 33 249.268 260.443 227.109 1.00 0.00 C +ATOM 34 CA PRO A 34 246.751 259.841 229.905 1.00 0.00 C +ATOM 35 CA ALA A 35 247.666 259.188 233.545 1.00 0.00 C +ATOM 36 CA SER A 36 250.635 260.464 235.564 1.00 0.00 C +ATOM 37 CA LEU A 37 254.443 260.442 235.458 1.00 0.00 C +ATOM 38 CA ALA A 38 257.611 260.432 237.575 1.00 0.00 C +ATOM 39 CA GLN A 39 259.149 259.650 240.972 1.00 0.00 C +ATOM 40 CA PRO A 40 261.485 260.182 243.934 1.00 0.00 C +ATOM 41 CA LEU A 41 262.383 261.132 247.513 1.00 0.00 C +ATOM 42 CA LEU A 42 261.666 260.218 251.142 1.00 0.00 C +ATOM 43 CA PRO A 43 259.319 261.914 253.618 1.00 0.00 C +ATOM 44 CA PRO A 44 259.149 262.312 257.403 1.00 0.00 C +ATOM 45 CA GLN A 45 259.128 262.524 261.207 1.00 0.00 C +ATOM 46 CA PRO A 46 257.371 265.196 263.278 1.00 0.00 C +ATOM 47 CA PRO A 47 254.148 266.426 264.896 1.00 0.00 C +ATOM 48 CA PRO A 48 250.379 266.642 265.402 1.00 0.00 C +ATOM 49 CA LEU A 49 247.323 264.849 264.001 1.00 0.00 C +ATOM 50 CA ALA A 50 245.018 261.982 263.007 1.00 0.00 C +ATOM 51 CA GLU A 51 242.182 262.268 260.480 1.00 0.00 C +ATOM 52 CA PRO A 52 242.471 265.310 258.205 1.00 0.00 C +ATOM 53 CA PRO A 53 241.838 264.319 254.581 1.00 0.00 C +ATOM 54 CA PRO A 54 242.304 263.365 250.922 1.00 0.00 C +ATOM 55 CA GLN A 55 243.559 263.631 247.334 1.00 0.00 C +ATOM 56 CA PRO A 56 243.831 260.030 246.121 1.00 0.00 C +ATOM 57 CA PRO A 57 245.098 257.124 248.235 1.00 0.00 C +ATOM 58 CA PRO A 58 248.126 256.917 250.538 1.00 0.00 C +ATOM 59 CA LEU A 59 251.527 255.363 249.808 1.00 0.00 C +ATOM 60 CA THR A 60 252.984 253.661 252.890 1.00 0.00 C +ATOM 61 CA GLN A 61 253.493 249.918 252.397 1.00 0.00 C +ATOM 62 CA SER A 62 250.681 247.815 250.916 1.00 0.00 C +ATOM 63 CA PRO A 63 248.718 245.103 252.734 1.00 0.00 C +ATOM 64 CA PRO A 64 247.693 241.440 252.939 1.00 0.00 C +ATOM 65 CA GLN A 65 246.236 238.611 250.843 1.00 0.00 C +ATOM 66 CA LEU A 66 243.643 240.039 248.444 1.00 0.00 C +ATOM 67 CA PRO A 67 242.227 237.575 245.906 1.00 0.00 C +ATOM 68 CA PRO A 68 240.091 234.526 245.095 1.00 0.00 C +ATOM 69 CA LEU A 69 236.501 233.345 244.615 1.00 0.00 C +ATOM 70 CA ALA A 70 233.920 235.141 246.767 1.00 0.00 C +ATOM 71 CA GLN A 71 235.363 238.370 248.185 1.00 0.00 C +ATOM 72 CA PRO A 72 233.167 241.416 248.829 1.00 0.00 C +ATOM 73 CA ARG A 73 231.249 244.675 248.361 1.00 0.00 C +ATOM 74 CA SER A 74 229.468 247.670 249.900 1.00 0.00 C +ATOM 75 CA PRO A 75 231.091 250.736 248.325 1.00 0.00 C +ATOM 76 CA LEU A 76 234.770 250.319 247.429 1.00 0.00 C +ATOM 77 CA ALA A 77 237.301 252.884 246.192 1.00 0.00 C +ATOM 78 CA PRO A 78 240.756 251.369 245.657 1.00 0.00 C +ATOM 79 CA LEU A 79 243.769 250.197 243.642 1.00 0.00 C +ATOM 80 CA ALA A 80 247.044 251.958 244.474 1.00 0.00 C +ATOM 81 CA GLN A 81 249.822 249.394 244.948 1.00 0.00 C +ATOM 82 CA SER A 82 250.284 245.630 244.587 1.00 0.00 C +ATOM 83 CA PRO A 83 250.615 242.874 241.977 1.00 0.00 C +ATOM 84 CA PRO A 84 249.717 241.918 238.400 1.00 0.00 C +ATOM 85 CA LEU A 85 252.679 240.016 236.942 1.00 0.00 C +ATOM 86 CA ALA A 86 254.093 239.765 233.413 1.00 0.00 C +ATOM 87 CA ALA A 87 254.310 236.054 232.577 1.00 0.00 C +ATOM 88 CA GLU A 88 252.937 233.538 235.088 1.00 0.00 C +ATOM 89 CA PRO A 89 249.529 233.563 236.791 1.00 0.00 C +ATOM 90 CA CYS A 90 246.613 235.908 237.510 1.00 0.00 C +ATOM 91 CA PRO A 91 243.274 237.732 237.716 1.00 0.00 C +ATOM 92 CA GLN A 92 240.372 238.118 240.154 1.00 0.00 C +ATOM 93 CA ARG A 93 239.088 241.340 241.730 1.00 0.00 C +ATOM 94 CA PRO A 94 238.672 243.132 245.067 1.00 0.00 C +ATOM 95 CA PRO A 95 239.877 244.969 248.179 1.00 0.00 C +ATOM 96 CA GLN A 96 242.039 245.515 251.268 1.00 0.00 C +ATOM 97 CA PRO A 97 242.865 245.301 254.981 1.00 0.00 C +ATOM 98 CA PRO A 98 242.906 247.067 258.357 1.00 0.00 C +ATOM 99 CA PRO A 99 240.696 246.440 261.396 1.00 0.00 C +ATOM 100 CA LEU A 100 241.177 246.818 265.157 1.00 0.00 C +ATOM 101 CA ALA A 101 244.670 246.867 266.678 1.00 0.00 C +ATOM 102 CA LYS A 102 245.637 246.361 270.328 1.00 0.00 C +ATOM 103 CA PRO A 103 245.607 247.562 273.944 1.00 0.00 C +ATOM 104 CA CYS A 104 243.130 250.092 275.350 1.00 0.00 C +ATOM 105 CA SER A 105 243.019 250.065 279.158 1.00 0.00 C +ATOM 106 CA GLN A 106 241.711 253.309 280.670 1.00 0.00 C +ATOM 107 CA PRO A 107 237.970 253.219 279.950 1.00 0.00 C +ATOM 108 CA PRO A 108 234.389 252.472 281.015 1.00 0.00 C +ATOM 109 CA PRO A 109 233.078 251.561 284.474 1.00 0.00 C +ATOM 110 CA ARG A 110 232.375 250.569 288.085 1.00 0.00 C +ATOM 111 CA PRO A 111 234.048 250.905 291.491 1.00 0.00 C +ATOM 112 CA ALA A 112 237.756 251.780 291.502 1.00 0.00 C +ATOM 113 CA LEU A 113 239.820 252.634 288.415 1.00 0.00 C +ATOM 114 CA LEU A 114 243.181 250.841 288.514 1.00 0.00 C +ATOM 115 CA ALA A 115 246.927 251.420 288.134 1.00 0.00 C +ATOM 116 CA GLU A 116 248.526 254.163 290.241 1.00 0.00 C +ATOM 117 CA LYS A 117 252.140 255.284 289.795 1.00 0.00 C +ATOM 118 CA ALA A 118 254.709 257.152 287.691 1.00 0.00 C +ATOM 119 CA ARG A 119 257.003 259.742 289.287 1.00 0.00 C +ATOM 120 CA THR A 120 259.778 260.856 286.926 1.00 0.00 C +ATOM 121 CA PRO A 121 263.154 259.378 285.958 1.00 0.00 C +TER 122 PRO A 121 +END diff --git a/Plants/Q8GSJ0/Q8GSJ0.dcd b/Plants/Q8GSJ0/Q8GSJ0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..2ebbe01c2973c1ee0aad220b5a4fb9763073e863 --- /dev/null +++ b/Plants/Q8GSJ0/Q8GSJ0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:020751b1e7b75fbb9f70fdb880f71f552d59e04d1a5073ec11e91c80b91911a8 +size 8120276 diff --git a/Plants/Q8GSJ0/top.pdb b/Plants/Q8GSJ0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..9631dc99b2e16fff6e01635a304faf7d64bed36a --- /dev/null +++ b/Plants/Q8GSJ0/top.pdb @@ -0,0 +1,65 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 268.590 272.216 271.173 1.00 0.00 C +ATOM 2 CA ALA A 2 267.408 272.222 274.795 1.00 0.00 C +ATOM 3 CA ASP A 3 266.706 268.721 276.124 1.00 0.00 C +ATOM 4 CA ALA A 4 269.015 266.781 278.452 1.00 0.00 C +ATOM 5 CA VAL A 5 270.638 265.409 281.614 1.00 0.00 C +ATOM 6 CA ALA A 6 268.543 265.346 284.795 1.00 0.00 C +ATOM 7 CA ALA A 7 267.682 261.813 285.933 1.00 0.00 C +ATOM 8 CA ARG A 8 265.027 259.684 284.220 1.00 0.00 C +ATOM 9 CA ASP A 9 262.347 260.485 281.633 1.00 0.00 C +ATOM 10 CA ASP A 10 259.213 261.591 279.770 1.00 0.00 C +ATOM 11 CA THR A 11 255.569 261.767 280.869 1.00 0.00 C +ATOM 12 CA SER A 12 252.162 260.079 281.112 1.00 0.00 C +ATOM 13 CA ALA A 13 252.078 256.440 279.987 1.00 0.00 C +ATOM 14 CA PRO A 14 248.437 255.469 279.423 1.00 0.00 C +ATOM 15 CA THR A 15 247.181 256.824 276.091 1.00 0.00 C +ATOM 16 CA SER A 16 248.205 258.761 272.974 1.00 0.00 C +ATOM 17 CA ALA A 17 251.943 259.495 272.983 1.00 0.00 C +ATOM 18 CA GLU A 18 254.202 261.844 274.958 1.00 0.00 C +ATOM 19 CA GLN A 19 257.132 262.841 272.736 1.00 0.00 C +ATOM 20 CA ASP A 20 257.770 262.734 268.982 1.00 0.00 C +ATOM 21 CA LYS A 21 260.194 259.861 268.360 1.00 0.00 C +ATOM 22 CA GLU A 22 260.861 256.996 265.938 1.00 0.00 C +ATOM 23 CA ALA A 23 258.953 254.618 263.653 1.00 0.00 C +ATOM 24 CA GLU A 24 257.204 255.867 260.507 1.00 0.00 C +ATOM 25 CA LYS A 25 258.936 258.887 258.960 1.00 0.00 C +ATOM 26 CA SER A 26 259.748 258.717 255.241 1.00 0.00 C +ATOM 27 CA GLU A 27 257.149 256.437 253.638 1.00 0.00 C +ATOM 28 CA LYS A 28 256.660 254.291 250.529 1.00 0.00 C +ATOM 29 CA SER A 29 256.714 255.252 246.843 1.00 0.00 C +ATOM 30 CA PRO A 30 255.381 255.272 243.273 1.00 0.00 C +ATOM 31 CA ARG A 31 254.146 252.111 241.541 1.00 0.00 C +ATOM 32 CA SER A 32 252.076 248.937 241.139 1.00 0.00 C +ATOM 33 CA HIS A 33 254.276 246.425 239.305 1.00 0.00 C +ATOM 34 CA ALA A 34 253.475 245.505 235.695 1.00 0.00 C +ATOM 35 CA ALA A 35 251.588 243.579 233.004 1.00 0.00 C +ATOM 36 CA SER A 36 248.955 241.350 234.620 1.00 0.00 C +ATOM 37 CA ALA A 37 245.350 241.345 235.853 1.00 0.00 C +ATOM 38 CA GLY A 38 243.900 244.591 234.483 1.00 0.00 C +ATOM 39 CA GLY A 39 242.823 247.388 232.132 1.00 0.00 C +ATOM 40 CA HIS A 40 244.685 250.450 230.838 1.00 0.00 C +ATOM 41 CA ARG A 41 246.306 249.818 227.449 1.00 0.00 C +ATOM 42 CA GLY A 42 245.381 249.070 223.829 1.00 0.00 C +ATOM 43 CA ALA A 43 246.482 246.142 221.655 1.00 0.00 C +ATOM 44 CA ALA A 44 246.264 242.849 219.752 1.00 0.00 C +ATOM 45 CA LEU A 45 244.912 239.421 220.719 1.00 0.00 C +ATOM 46 CA PRO A 46 244.963 237.151 217.659 1.00 0.00 C +ATOM 47 CA PRO A 47 241.981 235.184 216.335 1.00 0.00 C +ATOM 48 CA ARG A 48 239.558 232.388 215.426 1.00 0.00 C +ATOM 49 CA LEU A 49 238.690 230.160 218.392 1.00 0.00 C +ATOM 50 CA GLY A 50 235.899 230.603 220.947 1.00 0.00 C +ATOM 51 CA GLN A 51 235.540 231.120 224.705 1.00 0.00 C +ATOM 52 CA LEU A 52 236.552 229.989 228.199 1.00 0.00 C +ATOM 53 CA GLN A 53 235.984 232.102 231.319 1.00 0.00 C +ATOM 54 CA ARG A 54 233.820 235.028 232.446 1.00 0.00 C +ATOM 55 CA LYS A 55 232.726 237.629 229.886 1.00 0.00 C +ATOM 56 CA GLY A 56 229.218 239.072 230.252 1.00 0.00 C +ATOM 57 CA GLY A 57 227.709 237.517 233.386 1.00 0.00 C +ATOM 58 CA LYS A 58 227.803 234.350 235.502 1.00 0.00 C +ATOM 59 CA GLY A 59 230.772 232.529 237.047 1.00 0.00 C +ATOM 60 CA PRO A 60 233.649 234.473 238.615 1.00 0.00 C +ATOM 61 CA ARG A 61 232.868 235.007 242.305 1.00 0.00 C +TER 62 ARG A 61 +END diff --git a/Plants/Q8GSR7/Q8GSR7.dcd b/Plants/Q8GSR7/Q8GSR7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..2f88ba03b4973bb6f352b2d3b0937c91fd66d74b --- /dev/null +++ b/Plants/Q8GSR7/Q8GSR7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:3530f0633f3d893d9f2b307032436a1fd1c96000461011d5e5c39e4a153970f6 +size 5480276 diff --git a/Plants/Q8GSR7/top.pdb b/Plants/Q8GSR7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..6f62b9ef247ed4aa04872f98b93c73008936b7ca --- /dev/null +++ b/Plants/Q8GSR7/top.pdb @@ -0,0 +1,43 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA HIS A 1 254.879 248.986 243.430 1.00 0.00 C +ATOM 2 CA HIS A 2 255.459 251.151 240.349 1.00 0.00 C +ATOM 3 CA ALA A 3 252.331 251.488 238.200 1.00 0.00 C +ATOM 4 CA GLN A 4 253.256 252.495 234.643 1.00 0.00 C +ATOM 5 CA LEU A 5 255.638 249.844 233.294 1.00 0.00 C +ATOM 6 CA ARG A 6 255.735 246.099 232.603 1.00 0.00 C +ATOM 7 CA HIS A 7 257.369 243.473 234.828 1.00 0.00 C +ATOM 8 CA ALA A 8 258.665 243.579 238.410 1.00 0.00 C +ATOM 9 CA ARG A 9 258.144 242.737 242.089 1.00 0.00 C +ATOM 10 CA GLY A 10 255.181 242.264 244.437 1.00 0.00 C +ATOM 11 CA ARG A 11 254.682 243.741 247.913 1.00 0.00 C +ATOM 12 CA GLU A 12 255.702 244.458 251.513 1.00 0.00 C +ATOM 13 CA ALA A 13 258.449 241.983 252.433 1.00 0.00 C +ATOM 14 CA VAL A 14 257.996 240.482 255.906 1.00 0.00 C +ATOM 15 CA ALA A 15 255.499 238.659 258.132 1.00 0.00 C +ATOM 16 CA PRO A 16 252.417 240.277 259.681 1.00 0.00 C +ATOM 17 CA ARG A 17 249.724 241.661 257.369 1.00 0.00 C +ATOM 18 CA ARG A 18 248.345 245.143 256.671 1.00 0.00 C +ATOM 19 CA ARG A 19 245.138 247.061 257.417 1.00 0.00 C +ATOM 20 CA ALA A 20 243.414 250.456 257.291 1.00 0.00 C +ATOM 21 CA ALA A 21 243.838 253.660 259.309 1.00 0.00 C +ATOM 22 CA GLN A 22 244.987 254.329 262.880 1.00 0.00 C +ATOM 23 CA HIS A 23 247.199 251.429 263.980 1.00 0.00 C +ATOM 24 CA LEU A 24 250.819 252.345 264.737 1.00 0.00 C +ATOM 25 CA ARG A 25 252.201 255.810 263.960 1.00 0.00 C +ATOM 26 CA ARG A 26 255.379 255.583 261.871 1.00 0.00 C +ATOM 27 CA THR A 27 255.545 257.768 258.754 1.00 0.00 C +ATOM 28 CA ARG A 28 254.527 257.068 255.150 1.00 0.00 C +ATOM 29 CA ALA A 29 254.479 254.032 252.849 1.00 0.00 C +ATOM 30 CA ALA A 30 251.243 252.022 252.837 1.00 0.00 C +ATOM 31 CA GLY A 31 248.714 249.275 252.078 1.00 0.00 C +ATOM 32 CA SER A 32 246.212 250.438 249.450 1.00 0.00 C +ATOM 33 CA ARG A 33 242.899 251.121 251.204 1.00 0.00 C +ATOM 34 CA ARG A 34 240.643 253.699 249.537 1.00 0.00 C +ATOM 35 CA HIS A 35 239.613 253.695 245.869 1.00 0.00 C +ATOM 36 CA ALA A 36 237.774 256.426 243.953 1.00 0.00 C +ATOM 37 CA ARG A 37 236.645 260.019 244.534 1.00 0.00 C +ATOM 38 CA HIS A 38 235.554 262.527 241.882 1.00 0.00 C +ATOM 39 CA PRO A 39 233.703 262.717 238.557 1.00 0.00 C +TER 40 PRO A 39 +END diff --git a/Plants/Q8GSW7/Q8GSW7.dcd b/Plants/Q8GSW7/Q8GSW7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..a0050dad367ccd0c2a02d5904ad3033970a6c860 --- /dev/null +++ b/Plants/Q8GSW7/Q8GSW7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:bbed3c8d9d816d5faf3e450b6dae3011787b5167dbac705ca47fcc8b2181aab4 +size 22040276 diff --git a/Plants/Q8GSW7/top.pdb b/Plants/Q8GSW7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a271b5fa1a9c5500069d999be33b0f7d7d634a65 --- /dev/null +++ b/Plants/Q8GSW7/top.pdb @@ -0,0 +1,181 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 258.581 289.752 278.563 1.00 0.00 C +ATOM 2 CA ASN A 2 255.863 292.055 279.913 1.00 0.00 C +ATOM 3 CA ASP A 3 254.903 295.468 281.307 1.00 0.00 C +ATOM 4 CA TYR A 4 254.006 297.451 284.434 1.00 0.00 C +ATOM 5 CA LYS A 5 250.828 298.288 286.361 1.00 0.00 C +ATOM 6 CA GLU A 6 247.451 297.261 284.926 1.00 0.00 C +ATOM 7 CA LYS A 7 244.757 296.772 287.575 1.00 0.00 C +ATOM 8 CA GLY A 8 243.822 299.832 289.643 1.00 0.00 C +ATOM 9 CA PHE A 9 245.384 299.329 293.081 1.00 0.00 C +ATOM 10 CA ILE A 10 247.776 302.224 293.726 1.00 0.00 C +ATOM 11 CA ALA A 11 250.862 302.187 291.492 1.00 0.00 C +ATOM 12 CA SER A 12 251.029 304.294 288.322 1.00 0.00 C +ATOM 13 CA ALA A 13 252.311 307.878 288.485 1.00 0.00 C +ATOM 14 CA GLY A 14 253.478 311.100 286.819 1.00 0.00 C +ATOM 15 CA ARG A 15 251.965 312.866 283.801 1.00 0.00 C +ATOM 16 CA PHE A 16 249.243 314.668 281.836 1.00 0.00 C +ATOM 17 CA THR A 17 247.035 316.735 279.519 1.00 0.00 C +ATOM 18 CA VAL A 18 245.129 314.508 277.085 1.00 0.00 C +ATOM 19 CA ASP A 19 243.344 316.954 274.773 1.00 0.00 C +ATOM 20 CA ARG A 20 245.063 318.201 271.609 1.00 0.00 C +ATOM 21 CA VAL A 21 243.376 316.762 268.511 1.00 0.00 C +ATOM 22 CA HIS A 22 243.588 313.037 267.742 1.00 0.00 C +ATOM 23 CA GLY A 23 244.200 311.090 270.959 1.00 0.00 C +ATOM 24 CA GLY A 24 247.784 311.926 271.947 1.00 0.00 C +ATOM 25 CA GLY A 25 250.990 310.101 272.900 1.00 0.00 C +ATOM 26 CA SER A 26 252.467 306.848 271.575 1.00 0.00 C +ATOM 27 CA ARG A 27 250.504 304.469 269.337 1.00 0.00 C +ATOM 28 CA LYS A 28 248.952 301.490 267.540 1.00 0.00 C +ATOM 29 CA ARG A 29 247.695 300.710 264.029 1.00 0.00 C +ATOM 30 CA THR A 30 250.026 299.866 261.136 1.00 0.00 C +ATOM 31 CA ALA A 31 249.813 297.907 257.875 1.00 0.00 C +ATOM 32 CA GLU A 32 250.436 294.664 255.975 1.00 0.00 C +ATOM 33 CA ILE A 33 251.305 291.164 257.206 1.00 0.00 C +ATOM 34 CA HIS A 34 250.275 287.858 255.617 1.00 0.00 C +ATOM 35 CA PRO A 35 251.152 284.260 256.510 1.00 0.00 C +ATOM 36 CA SER A 36 248.524 281.646 257.391 1.00 0.00 C +ATOM 37 CA LYS A 37 249.925 278.117 257.072 1.00 0.00 C +ATOM 38 CA THR A 38 253.158 276.761 255.579 1.00 0.00 C +ATOM 39 CA ASP A 39 255.009 274.859 252.845 1.00 0.00 C +ATOM 40 CA GLY A 40 255.742 271.412 251.397 1.00 0.00 C +ATOM 41 CA GLN A 41 257.046 269.326 248.488 1.00 0.00 C +ATOM 42 CA ASP A 42 258.975 266.071 248.932 1.00 0.00 C +ATOM 43 CA PRO A 43 257.912 263.391 246.440 1.00 0.00 C +ATOM 44 CA SER A 44 254.456 264.107 245.005 1.00 0.00 C +ATOM 45 CA VAL A 45 251.992 262.474 242.602 1.00 0.00 C +ATOM 46 CA HIS A 46 251.218 259.772 240.029 1.00 0.00 C +ATOM 47 CA ASP A 47 250.783 256.446 238.223 1.00 0.00 C +ATOM 48 CA ARG A 48 247.622 254.634 237.111 1.00 0.00 C +ATOM 49 CA THR A 49 244.639 256.990 236.856 1.00 0.00 C +ATOM 50 CA THR A 50 241.690 259.372 236.475 1.00 0.00 C +ATOM 51 CA ALA A 51 241.510 263.147 235.993 1.00 0.00 C +ATOM 52 CA ASP A 52 240.720 266.634 237.309 1.00 0.00 C +ATOM 53 CA GLY A 53 237.539 268.715 237.576 1.00 0.00 C +ATOM 54 CA ASN A 54 235.493 271.047 235.365 1.00 0.00 C +ATOM 55 CA ASP A 55 232.229 271.578 237.257 1.00 0.00 C +ATOM 56 CA ASP A 56 229.929 268.574 236.805 1.00 0.00 C +ATOM 57 CA VAL A 57 226.542 269.185 235.172 1.00 0.00 C +ATOM 58 CA GLY A 58 226.588 268.719 231.391 1.00 0.00 C +ATOM 59 CA ASP A 59 226.271 266.880 228.069 1.00 0.00 C +ATOM 60 CA ASP A 60 228.172 267.668 224.862 1.00 0.00 C +ATOM 61 CA VAL A 61 228.244 265.633 221.642 1.00 0.00 C +ATOM 62 CA ILE A 62 224.886 265.750 219.848 1.00 0.00 C +ATOM 63 CA THR A 63 221.608 264.457 218.397 1.00 0.00 C +ATOM 64 CA GLY A 64 217.883 263.792 218.836 1.00 0.00 C +ATOM 65 CA ASP A 65 214.715 262.410 220.440 1.00 0.00 C +ATOM 66 CA ASP A 66 214.144 259.060 222.163 1.00 0.00 C +ATOM 67 CA SER A 67 213.681 255.288 221.891 1.00 0.00 C +ATOM 68 CA ALA A 68 212.629 251.637 222.165 1.00 0.00 C +ATOM 69 CA SER A 69 210.246 251.042 219.252 1.00 0.00 C +ATOM 70 CA ARG A 70 211.308 250.256 215.679 1.00 0.00 C +ATOM 71 CA ALA A 71 212.777 249.886 212.183 1.00 0.00 C +ATOM 72 CA ARG A 72 211.797 250.803 208.617 1.00 0.00 C +ATOM 73 CA ARG A 73 214.742 251.179 206.230 1.00 0.00 C +ATOM 74 CA ARG A 74 216.943 248.218 205.277 1.00 0.00 C +ATOM 75 CA SER A 75 220.246 247.065 206.786 1.00 0.00 C +ATOM 76 CA THR A 76 223.661 245.991 205.482 1.00 0.00 C +ATOM 77 CA ALA A 77 226.534 243.912 206.874 1.00 0.00 C +ATOM 78 CA ARG A 78 227.581 241.020 209.123 1.00 0.00 C +ATOM 79 CA ARG A 79 227.532 237.976 211.413 1.00 0.00 C +ATOM 80 CA ARG A 80 230.305 237.754 214.016 1.00 0.00 C +ATOM 81 CA LYS A 81 231.578 234.167 213.837 1.00 0.00 C +ATOM 82 CA ARG A 82 231.346 230.429 214.538 1.00 0.00 C +ATOM 83 CA ARG A 83 232.443 227.374 212.544 1.00 0.00 C +ATOM 84 CA THR A 84 234.147 224.950 214.939 1.00 0.00 C +ATOM 85 CA PRO A 85 233.393 221.258 215.495 1.00 0.00 C +ATOM 86 CA THR A 86 232.441 219.418 218.693 1.00 0.00 C +ATOM 87 CA ARG A 87 234.289 217.731 221.566 1.00 0.00 C +ATOM 88 CA SER A 88 235.949 219.594 224.446 1.00 0.00 C +ATOM 89 CA GLY A 89 239.691 220.288 224.281 1.00 0.00 C +ATOM 90 CA ARG A 90 243.452 219.828 223.876 1.00 0.00 C +ATOM 91 CA HIS A 91 244.367 218.171 220.569 1.00 0.00 C +ATOM 92 CA GLY A 92 247.325 216.048 219.445 1.00 0.00 C +ATOM 93 CA GLU A 93 247.480 214.903 215.815 1.00 0.00 C +ATOM 94 CA LEU A 94 244.880 216.171 213.336 1.00 0.00 C +ATOM 95 CA THR A 95 242.490 219.116 212.969 1.00 0.00 C +ATOM 96 CA GLY A 96 243.175 221.065 209.768 1.00 0.00 C +ATOM 97 CA ASP A 97 244.094 224.584 210.904 1.00 0.00 C +ATOM 98 CA GLN A 98 241.804 227.105 212.612 1.00 0.00 C +ATOM 99 CA SER A 99 240.191 227.000 216.061 1.00 0.00 C +ATOM 100 CA GLN A 100 239.850 225.443 219.522 1.00 0.00 C +ATOM 101 CA SER A 101 238.756 227.739 222.359 1.00 0.00 C +ATOM 102 CA GLY A 102 239.709 229.129 225.776 1.00 0.00 C +ATOM 103 CA GLY A 103 238.589 232.169 227.780 1.00 0.00 C +ATOM 104 CA ASP A 104 235.178 231.195 229.169 1.00 0.00 C +ATOM 105 CA ASP A 105 232.571 231.198 231.949 1.00 0.00 C +ATOM 106 CA ARG A 106 232.991 229.456 235.311 1.00 0.00 C +ATOM 107 CA VAL A 107 233.534 225.720 235.830 1.00 0.00 C +ATOM 108 CA ASP A 108 233.779 223.571 238.966 1.00 0.00 C +ATOM 109 CA ASP A 109 232.102 224.001 242.360 1.00 0.00 C +ATOM 110 CA GLY A 110 234.862 225.146 244.723 1.00 0.00 C +ATOM 111 CA ASP A 111 234.358 224.655 248.468 1.00 0.00 C +ATOM 112 CA GLY A 112 231.537 222.913 250.345 1.00 0.00 C +ATOM 113 CA VAL A 113 229.931 220.797 253.076 1.00 0.00 C +ATOM 114 CA PRO A 114 228.765 220.184 256.651 1.00 0.00 C +ATOM 115 CA ALA A 115 229.736 216.836 258.188 1.00 0.00 C +ATOM 116 CA VAL A 116 228.669 213.392 259.418 1.00 0.00 C +ATOM 117 CA ASN A 117 228.760 210.084 261.306 1.00 0.00 C +ATOM 118 CA GLY A 118 231.534 207.725 262.426 1.00 0.00 C +ATOM 119 CA ASP A 119 233.509 205.808 259.791 1.00 0.00 C +ATOM 120 CA ASP A 120 232.836 206.235 256.065 1.00 0.00 C +ATOM 121 CA GLU A 121 231.563 209.578 254.753 1.00 0.00 C +ATOM 122 CA GLY A 122 231.987 210.883 251.199 1.00 0.00 C +ATOM 123 CA ALA A 123 233.517 214.290 250.448 1.00 0.00 C +ATOM 124 CA ASP A 124 234.856 216.477 253.266 1.00 0.00 C +ATOM 125 CA GLU A 125 237.943 218.504 254.203 1.00 0.00 C +ATOM 126 CA ASP A 126 239.034 221.404 251.985 1.00 0.00 C +ATOM 127 CA GLY A 127 239.114 225.208 252.182 1.00 0.00 C +ATOM 128 CA GLY A 128 242.152 226.635 253.984 1.00 0.00 C +ATOM 129 CA GLY A 129 241.477 226.669 257.734 1.00 0.00 C +ATOM 130 CA LEU A 130 244.764 225.517 259.278 1.00 0.00 C +ATOM 131 CA ALA A 131 246.179 225.735 262.809 1.00 0.00 C +ATOM 132 CA THR A 132 247.335 222.842 265.001 1.00 0.00 C +ATOM 133 CA THR A 133 248.851 224.279 268.187 1.00 0.00 C +ATOM 134 CA THR A 134 250.722 227.548 268.761 1.00 0.00 C +ATOM 135 CA VAL A 135 253.220 229.988 267.239 1.00 0.00 C +ATOM 136 CA THR A 136 256.721 231.116 266.243 1.00 0.00 C +ATOM 137 CA SER A 137 260.487 230.693 265.851 1.00 0.00 C +ATOM 138 CA PRO A 138 261.840 233.742 264.010 1.00 0.00 C +ATOM 139 CA SER A 139 265.373 233.949 262.601 1.00 0.00 C +ATOM 140 CA SER A 140 268.269 235.930 264.086 1.00 0.00 C +ATOM 141 CA ASP A 141 271.994 235.667 264.838 1.00 0.00 C +ATOM 142 CA ASP A 142 275.434 235.604 266.475 1.00 0.00 C +ATOM 143 CA ASP A 143 277.363 234.937 269.693 1.00 0.00 C +ATOM 144 CA ARG A 144 277.941 231.635 271.502 1.00 0.00 C +ATOM 145 CA SER A 145 278.574 228.173 270.043 1.00 0.00 C +ATOM 146 CA VAL A 146 276.884 224.809 269.455 1.00 0.00 C +ATOM 147 CA GLY A 147 275.207 221.388 269.496 1.00 0.00 C +ATOM 148 CA GLY A 148 273.808 217.914 268.799 1.00 0.00 C +ATOM 149 CA ALA A 149 275.847 214.898 269.921 1.00 0.00 C +ATOM 150 CA ARG A 150 279.414 214.231 271.081 1.00 0.00 C +ATOM 151 CA LEU A 151 281.564 216.240 268.660 1.00 0.00 C +ATOM 152 CA LYS A 152 282.364 216.154 264.936 1.00 0.00 C +ATOM 153 CA ARG A 153 284.528 219.110 263.890 1.00 0.00 C +ATOM 154 CA ARG A 154 283.823 222.660 265.082 1.00 0.00 C +ATOM 155 CA ARG A 155 283.798 226.118 263.483 1.00 0.00 C +ATOM 156 CA ARG A 156 283.310 228.845 260.868 1.00 0.00 C +ATOM 157 CA ARG A 157 283.467 232.519 259.871 1.00 0.00 C +ATOM 158 CA ARG A 158 284.977 234.964 262.372 1.00 0.00 C +ATOM 159 CA ARG A 159 284.715 238.719 262.958 1.00 0.00 C +ATOM 160 CA LYS A 160 287.806 240.833 263.663 1.00 0.00 C +ATOM 161 CA VAL A 161 291.524 241.499 263.164 1.00 0.00 C +ATOM 162 CA SER A 162 294.569 241.724 260.885 1.00 0.00 C +ATOM 163 CA ARG A 163 297.430 240.231 262.911 1.00 0.00 C +ATOM 164 CA ARG A 164 300.207 238.582 260.889 1.00 0.00 C +ATOM 165 CA GLY A 165 302.382 236.162 258.907 1.00 0.00 C +ATOM 166 CA GLY A 166 303.654 233.427 261.234 1.00 0.00 C +ATOM 167 CA ALA A 167 307.121 232.048 262.005 1.00 0.00 C +ATOM 168 CA THR A 168 306.900 229.806 265.078 1.00 0.00 C +ATOM 169 CA ASN A 169 303.381 229.555 266.518 1.00 0.00 C +ATOM 170 CA GLY A 170 300.237 231.630 267.088 1.00 0.00 C +ATOM 171 CA GLY A 171 300.398 235.435 267.191 1.00 0.00 C +ATOM 172 CA GLY A 172 298.221 236.741 270.031 1.00 0.00 C +ATOM 173 CA LEU A 173 295.332 239.199 270.392 1.00 0.00 C +ATOM 174 CA ARG A 174 291.625 239.990 270.003 1.00 0.00 C +ATOM 175 CA ARG A 175 289.794 236.653 270.167 1.00 0.00 C +ATOM 176 CA GLU A 176 287.770 233.647 271.345 1.00 0.00 C +ATOM 177 CA TRP A 177 284.604 234.037 273.428 1.00 0.00 C +TER 178 TRP A 177 +END diff --git a/Plants/Q8GUC7/Q8GUC7.dcd b/Plants/Q8GUC7/Q8GUC7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..b6cdf53ae2a782ea0d4e5796242b0c62a9b00326 --- /dev/null +++ b/Plants/Q8GUC7/Q8GUC7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:8ccdb0bf1daceacc38f8921ae55b4db20ef9c64df3eccee6a43fffbd1492191f +size 44400276 diff --git a/Plants/Q8GUC7/top.pdb b/Plants/Q8GUC7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..305dce6c0932b3e06bf781464508ae7ec6bca24c --- /dev/null +++ b/Plants/Q8GUC7/top.pdb @@ -0,0 +1,244 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA ALA A 1 271.870 304.534 260.123 1.00 0.00 C +ATOM 2 CA ASN A 2 271.652 306.853 257.108 1.00 0.00 C +ATOM 3 CA TYR A 3 271.836 304.753 253.935 1.00 0.00 C +ATOM 4 CA GLY A 4 269.893 303.120 251.093 1.00 0.00 C +ATOM 5 CA GLY A 5 268.271 299.706 250.612 1.00 0.00 C +ATOM 6 CA ASP A 6 265.477 297.621 252.148 1.00 0.00 C +ATOM 7 CA LYS A 7 266.784 294.868 254.434 1.00 0.00 C +ATOM 8 CA GLN A 8 267.788 291.305 253.528 1.00 0.00 C +ATOM 9 CA TYR A 9 271.210 289.734 254.108 1.00 0.00 C +ATOM 10 CA GLY A 10 272.450 290.642 257.594 1.00 0.00 C +ATOM 11 CA ARG A 11 275.962 290.285 259.028 1.00 0.00 C +ATOM 12 CA GLU A 12 278.369 289.289 261.808 1.00 0.00 C +ATOM 13 CA THR A 13 280.645 291.681 263.708 1.00 0.00 C +ATOM 14 CA ARG A 14 284.031 290.366 264.858 1.00 0.00 C +ATOM 15 CA HIS A 15 287.485 291.864 265.444 1.00 0.00 C +ATOM 16 CA THR A 16 288.245 293.892 262.309 1.00 0.00 C +ATOM 17 CA ASP A 17 288.621 293.051 258.612 1.00 0.00 C +ATOM 18 CA GLU A 18 286.958 293.219 255.188 1.00 0.00 C +ATOM 19 CA TYR A 19 283.873 291.582 253.666 1.00 0.00 C +ATOM 20 CA GLY A 20 280.388 290.048 253.788 1.00 0.00 C +ATOM 21 CA ASN A 21 278.553 286.714 253.600 1.00 0.00 C +ATOM 22 CA PRO A 22 277.319 283.122 253.905 1.00 0.00 C +ATOM 23 CA ILE A 23 274.489 280.677 254.632 1.00 0.00 C +ATOM 24 CA HIS A 24 270.936 281.108 255.937 1.00 0.00 C +ATOM 25 CA SER A 25 268.154 278.610 255.206 1.00 0.00 C +ATOM 26 CA THR A 26 264.690 279.206 256.676 1.00 0.00 C +ATOM 27 CA GLY A 27 263.527 276.946 259.515 1.00 0.00 C +ATOM 28 CA GLY A 28 259.827 276.119 259.892 1.00 0.00 C +ATOM 29 CA HIS A 29 256.237 275.956 258.627 1.00 0.00 C +ATOM 30 CA GLN A 30 252.493 276.024 257.922 1.00 0.00 C +ATOM 31 CA THR A 31 250.761 274.099 260.717 1.00 0.00 C +ATOM 32 CA ASP A 32 248.539 274.860 263.717 1.00 0.00 C +ATOM 33 CA GLU A 33 246.997 278.335 263.467 1.00 0.00 C +ATOM 34 CA TYR A 34 244.489 280.929 262.244 1.00 0.00 C +ATOM 35 CA GLY A 35 243.576 284.592 262.760 1.00 0.00 C +ATOM 36 CA ASN A 36 241.541 286.617 265.265 1.00 0.00 C +ATOM 37 CA PRO A 37 239.058 285.582 267.963 1.00 0.00 C +ATOM 38 CA VAL A 38 236.802 285.199 271.009 1.00 0.00 C +ATOM 39 CA ARG A 39 233.709 284.321 273.054 1.00 0.00 C +ATOM 40 CA ARG A 40 232.610 284.009 276.689 1.00 0.00 C +ATOM 41 CA THR A 41 235.354 283.839 279.326 1.00 0.00 C +ATOM 42 CA ASP A 42 237.966 285.190 281.749 1.00 0.00 C +ATOM 43 CA GLU A 43 241.713 285.078 282.429 1.00 0.00 C +ATOM 44 CA TYR A 44 243.557 285.371 279.108 1.00 0.00 C +ATOM 45 CA GLY A 45 245.285 282.499 277.297 1.00 0.00 C +ATOM 46 CA ASN A 46 245.037 278.712 276.961 1.00 0.00 C +ATOM 47 CA PRO A 47 242.392 276.017 276.456 1.00 0.00 C +ATOM 48 CA VAL A 48 239.739 273.499 277.522 1.00 0.00 C +ATOM 49 CA HIS A 49 238.755 270.113 276.078 1.00 0.00 C +ATOM 50 CA SER A 50 237.302 270.414 272.569 1.00 0.00 C +ATOM 51 CA THR A 51 239.326 271.674 269.597 1.00 0.00 C +ATOM 52 CA THR A 52 241.921 269.678 267.649 1.00 0.00 C +ATOM 53 CA GLY A 53 245.725 269.602 267.838 1.00 0.00 C +ATOM 54 CA GLY A 54 247.804 267.658 270.371 1.00 0.00 C +ATOM 55 CA THR A 55 247.923 263.964 269.448 1.00 0.00 C +ATOM 56 CA MET A 56 245.174 261.552 270.519 1.00 0.00 C +ATOM 57 CA GLY A 57 245.228 257.766 270.103 1.00 0.00 C +ATOM 58 CA ASP A 58 248.201 256.021 271.727 1.00 0.00 C +ATOM 59 CA TYR A 59 251.814 255.158 272.575 1.00 0.00 C +ATOM 60 CA GLY A 60 255.330 256.333 273.454 1.00 0.00 C +ATOM 61 CA SER A 61 256.617 259.543 275.051 1.00 0.00 C +ATOM 62 CA THR A 62 256.014 261.415 278.314 1.00 0.00 C +ATOM 63 CA GLY A 63 257.541 263.360 281.213 1.00 0.00 C +ATOM 64 CA LEU A 64 260.821 265.288 281.012 1.00 0.00 C +ATOM 65 CA GLY A 65 264.356 264.470 282.174 1.00 0.00 C +ATOM 66 CA GLN A 66 264.454 264.312 285.980 1.00 0.00 C +ATOM 67 CA GLY A 67 266.545 265.156 289.051 1.00 0.00 C +ATOM 68 CA THR A 68 264.122 266.821 291.474 1.00 0.00 C +ATOM 69 CA GLY A 69 263.833 266.231 295.227 1.00 0.00 C +ATOM 70 CA GLY A 70 261.000 267.781 297.248 1.00 0.00 C +ATOM 71 CA ILE A 71 257.635 269.568 297.271 1.00 0.00 C +ATOM 72 CA GLY A 72 254.987 271.033 299.585 1.00 0.00 C +ATOM 73 CA THR A 73 252.496 268.829 301.445 1.00 0.00 C +ATOM 74 CA GLY A 74 248.905 269.697 300.515 1.00 0.00 C +ATOM 75 CA GLY A 75 245.772 270.917 298.724 1.00 0.00 C +ATOM 76 CA TYR A 76 241.992 270.638 299.111 1.00 0.00 C +ATOM 77 CA GLY A 77 239.799 270.176 296.029 1.00 0.00 C +ATOM 78 CA THR A 78 236.036 270.412 295.482 1.00 0.00 C +ATOM 79 CA SER A 79 233.836 268.826 292.807 1.00 0.00 C +ATOM 80 CA GLY A 80 234.847 269.877 289.287 1.00 0.00 C +ATOM 81 CA HIS A 81 238.374 271.316 289.377 1.00 0.00 C +ATOM 82 CA GLN A 82 242.067 271.471 288.452 1.00 0.00 C +ATOM 83 CA GLY A 83 243.617 274.544 290.086 1.00 0.00 C +ATOM 84 CA LEU A 84 243.106 278.294 289.649 1.00 0.00 C +ATOM 85 CA GLY A 85 246.317 279.660 288.120 1.00 0.00 C +ATOM 86 CA THR A 86 248.059 281.873 285.554 1.00 0.00 C +ATOM 87 CA GLY A 87 248.242 285.424 286.920 1.00 0.00 C +ATOM 88 CA VAL A 88 249.848 285.605 290.370 1.00 0.00 C +ATOM 89 CA GLY A 89 250.327 289.216 291.488 1.00 0.00 C +ATOM 90 CA HIS A 90 253.040 291.625 290.326 1.00 0.00 C +ATOM 91 CA THR A 91 252.914 293.685 287.123 1.00 0.00 C +ATOM 92 CA THR A 92 249.301 294.503 286.233 1.00 0.00 C +ATOM 93 CA GLY A 93 247.585 293.375 283.024 1.00 0.00 C +ATOM 94 CA GLY A 94 247.886 290.031 281.223 1.00 0.00 C +ATOM 95 CA THR A 95 251.368 289.836 279.689 1.00 0.00 C +ATOM 96 CA GLY A 96 253.725 291.016 276.938 1.00 0.00 C +ATOM 97 CA THR A 97 253.346 288.418 274.177 1.00 0.00 C +ATOM 98 CA ASP A 98 255.068 285.019 274.194 1.00 0.00 C +ATOM 99 CA TYR A 99 257.363 284.072 277.085 1.00 0.00 C +ATOM 100 CA ALA A 100 259.961 281.498 276.019 1.00 0.00 C +ATOM 101 CA SER A 101 261.746 280.039 272.986 1.00 0.00 C +ATOM 102 CA GLY A 102 264.147 277.280 274.054 1.00 0.00 C +ATOM 103 CA GLY A 103 264.833 273.546 274.383 1.00 0.00 C +ATOM 104 CA ARG A 104 264.470 271.682 271.080 1.00 0.00 C +ATOM 105 CA SER A 105 263.448 268.394 269.450 1.00 0.00 C +ATOM 106 CA THR A 106 260.841 266.400 267.515 1.00 0.00 C +ATOM 107 CA GLY A 107 259.301 265.423 264.169 1.00 0.00 C +ATOM 108 CA GLN A 108 259.984 264.927 260.454 1.00 0.00 C +ATOM 109 CA THR A 109 256.931 265.600 258.277 1.00 0.00 C +ATOM 110 CA GLY A 110 253.282 266.696 258.302 1.00 0.00 C +ATOM 111 CA TYR A 111 250.966 263.694 258.678 1.00 0.00 C +ATOM 112 CA GLN A 112 247.331 264.745 259.128 1.00 0.00 C +ATOM 113 CA GLY A 113 245.375 264.346 262.373 1.00 0.00 C +ATOM 114 CA LEU A 114 241.615 264.008 261.854 1.00 0.00 C +ATOM 115 CA GLY A 115 238.005 263.497 260.751 1.00 0.00 C +ATOM 116 CA THR A 116 236.754 266.493 258.757 1.00 0.00 C +ATOM 117 CA GLU A 117 235.599 267.156 255.188 1.00 0.00 C +ATOM 118 CA SER A 118 232.700 267.123 252.716 1.00 0.00 C +ATOM 119 CA GLU A 119 233.621 265.660 249.321 1.00 0.00 C +ATOM 120 CA PHE A 120 230.434 264.515 247.575 1.00 0.00 C +ATOM 121 CA GLY A 121 226.751 265.110 248.352 1.00 0.00 C +ATOM 122 CA GLY A 122 225.335 261.616 248.899 1.00 0.00 C +ATOM 123 CA THR A 123 225.672 258.859 246.292 1.00 0.00 C +ATOM 124 CA THR A 124 228.954 257.988 244.563 1.00 0.00 C +ATOM 125 CA GLY A 125 232.299 257.383 242.842 1.00 0.00 C +ATOM 126 CA THR A 126 235.418 258.214 244.866 1.00 0.00 C +ATOM 127 CA PHE A 127 238.211 259.896 246.838 1.00 0.00 C +ATOM 128 CA GLN A 128 239.214 262.136 249.752 1.00 0.00 C +ATOM 129 CA ASN A 129 243.009 262.454 249.624 1.00 0.00 C +ATOM 130 CA GLN A 130 244.495 259.195 248.326 1.00 0.00 C +ATOM 131 CA PRO A 131 243.556 256.279 250.591 1.00 0.00 C +ATOM 132 CA SER A 132 245.215 253.617 252.754 1.00 0.00 C +ATOM 133 CA ALA A 133 244.870 250.875 255.377 1.00 0.00 C +ATOM 134 CA THR A 134 246.980 247.709 255.198 1.00 0.00 C +ATOM 135 CA PRO A 135 245.530 244.719 253.334 1.00 0.00 C +ATOM 136 CA MET A 136 246.047 240.977 252.833 1.00 0.00 C +ATOM 137 CA GLY A 137 247.788 237.643 252.224 1.00 0.00 C +ATOM 138 CA GLY A 138 250.322 237.462 249.385 1.00 0.00 C +ATOM 139 CA THR A 139 251.455 235.523 246.307 1.00 0.00 C +ATOM 140 CA GLY A 140 250.513 234.824 242.682 1.00 0.00 C +ATOM 141 CA LEU A 141 248.016 232.338 241.233 1.00 0.00 C +ATOM 142 CA GLY A 142 245.018 230.073 240.602 1.00 0.00 C +ATOM 143 CA GLY A 143 244.296 227.491 243.309 1.00 0.00 C +ATOM 144 CA GLY A 144 243.401 225.176 246.200 1.00 0.00 C +ATOM 145 CA THR A 145 241.930 222.214 248.092 1.00 0.00 C +ATOM 146 CA GLY A 146 240.061 218.912 248.435 1.00 0.00 C +ATOM 147 CA ALA A 147 240.394 216.072 250.953 1.00 0.00 C +ATOM 148 CA GLY A 148 242.863 213.669 252.579 1.00 0.00 C +ATOM 149 CA PHE A 149 242.380 209.890 252.551 1.00 0.00 C +ATOM 150 CA GLY A 150 241.674 207.445 249.715 1.00 0.00 C +ATOM 151 CA GLY A 151 244.823 207.168 247.588 1.00 0.00 C +ATOM 152 CA THR A 152 244.438 205.257 244.315 1.00 0.00 C +ATOM 153 CA GLY A 153 241.324 206.145 242.307 1.00 0.00 C +ATOM 154 CA SER A 154 237.836 206.728 240.890 1.00 0.00 C +ATOM 155 CA GLY A 155 236.421 204.421 238.209 1.00 0.00 C +ATOM 156 CA THR A 156 235.551 200.841 239.178 1.00 0.00 C +ATOM 157 CA GLY A 157 236.496 197.393 237.862 1.00 0.00 C +ATOM 158 CA THR A 158 235.104 196.481 234.434 1.00 0.00 C +ATOM 159 CA GLY A 159 235.619 194.820 231.044 1.00 0.00 C +ATOM 160 CA ILE A 160 234.801 193.282 227.655 1.00 0.00 C +ATOM 161 CA LEU A 161 234.658 190.847 224.728 1.00 0.00 C +ATOM 162 CA HIS A 162 231.672 191.020 222.369 1.00 0.00 C +ATOM 163 CA ARG A 163 232.541 193.870 219.995 1.00 0.00 C +ATOM 164 CA SER A 164 234.849 196.899 219.891 1.00 0.00 C +ATOM 165 CA GLY A 165 233.463 200.443 219.700 1.00 0.00 C +ATOM 166 CA SER A 166 232.891 201.259 216.023 1.00 0.00 C +ATOM 167 CA SER A 167 235.631 202.653 213.772 1.00 0.00 C +ATOM 168 CA SER A 168 236.237 205.867 211.819 1.00 0.00 C +ATOM 169 CA SER A 169 239.345 208.069 211.884 1.00 0.00 C +ATOM 170 CA SER A 170 241.230 209.940 214.616 1.00 0.00 C +ATOM 171 CA SER A 171 244.794 208.719 215.181 1.00 0.00 C +ATOM 172 CA SER A 172 248.410 208.238 216.283 1.00 0.00 C +ATOM 173 CA GLU A 173 251.372 207.047 218.361 1.00 0.00 C +ATOM 174 CA ASP A 174 253.757 207.404 221.311 1.00 0.00 C +ATOM 175 CA ASP A 175 254.324 211.139 221.805 1.00 0.00 C +ATOM 176 CA GLY A 176 255.859 213.814 224.041 1.00 0.00 C +ATOM 177 CA GLN A 177 255.889 217.012 221.971 1.00 0.00 C +ATOM 178 CA GLY A 178 258.194 219.890 221.012 1.00 0.00 C +ATOM 179 CA GLY A 179 257.416 221.032 217.461 1.00 0.00 C +ATOM 180 CA ARG A 180 254.331 223.264 217.601 1.00 0.00 C +ATOM 181 CA ARG A 181 250.771 222.907 218.910 1.00 0.00 C +ATOM 182 CA LYS A 182 250.968 222.741 222.711 1.00 0.00 C +ATOM 183 CA LYS A 183 251.779 222.975 226.426 1.00 0.00 C +ATOM 184 CA LYS A 184 249.394 222.315 229.323 1.00 0.00 C +ATOM 185 CA GLY A 185 247.869 223.121 232.721 1.00 0.00 C +ATOM 186 CA VAL A 186 246.716 226.733 233.093 1.00 0.00 C +ATOM 187 CA MET A 187 249.100 228.904 235.123 1.00 0.00 C +ATOM 188 CA GLN A 188 252.527 228.181 233.623 1.00 0.00 C +ATOM 189 CA LYS A 189 256.233 228.961 234.039 1.00 0.00 C +ATOM 190 CA ILE A 190 259.969 229.696 233.905 1.00 0.00 C +ATOM 191 CA LYS A 191 262.482 228.105 231.524 1.00 0.00 C +ATOM 192 CA GLU A 192 262.782 228.511 227.747 1.00 0.00 C +ATOM 193 CA LYS A 193 260.785 230.138 224.939 1.00 0.00 C +ATOM 194 CA LEU A 194 257.199 230.891 223.898 1.00 0.00 C +ATOM 195 CA PRO A 195 255.119 228.562 221.715 1.00 0.00 C +ATOM 196 CA GLY A 196 252.727 230.371 219.365 1.00 0.00 C +ATOM 197 CA GLY A 197 250.709 231.943 216.541 1.00 0.00 C +ATOM 198 CA HIS A 198 249.429 230.305 213.348 1.00 0.00 C +ATOM 199 CA SER A 199 245.703 230.020 212.607 1.00 0.00 C +ATOM 200 CA GLN A 200 243.380 230.225 215.620 1.00 0.00 C +ATOM 201 CA GLU A 201 244.395 227.406 217.973 1.00 0.00 C +ATOM 202 CA GLY A 202 241.789 225.556 220.047 1.00 0.00 C +ATOM 203 CA GLN A 203 239.372 226.783 222.724 1.00 0.00 C +ATOM 204 CA TYR A 204 238.164 230.288 221.847 1.00 0.00 C +ATOM 205 CA GLN A 205 236.277 231.732 218.869 1.00 0.00 C +ATOM 206 CA SER A 206 233.536 234.173 219.892 1.00 0.00 C +ATOM 207 CA GLN A 207 230.082 233.660 221.414 1.00 0.00 C +ATOM 208 CA THR A 208 230.448 232.498 225.024 1.00 0.00 C +ATOM 209 CA THR A 209 230.404 230.808 228.439 1.00 0.00 C +ATOM 210 CA THR A 210 231.656 227.908 230.570 1.00 0.00 C +ATOM 211 CA THR A 211 233.319 224.625 229.586 1.00 0.00 C +ATOM 212 CA THR A 212 234.462 223.854 226.034 1.00 0.00 C +ATOM 213 CA THR A 213 235.391 220.945 223.755 1.00 0.00 C +ATOM 214 CA ALA A 214 236.120 217.605 222.075 1.00 0.00 C +ATOM 215 CA GLY A 215 235.531 217.743 218.314 1.00 0.00 C +ATOM 216 CA GLY A 216 236.812 215.573 215.456 1.00 0.00 C +ATOM 217 CA ALA A 217 237.776 214.604 211.899 1.00 0.00 C +ATOM 218 CA GLY A 218 236.246 216.984 209.348 1.00 0.00 C +ATOM 219 CA TYR A 219 237.569 220.528 209.807 1.00 0.00 C +ATOM 220 CA GLY A 220 241.295 221.188 210.250 1.00 0.00 C +ATOM 221 CA GLU A 221 243.874 221.862 207.528 1.00 0.00 C +ATOM 222 CA THR A 222 243.426 225.412 206.221 1.00 0.00 C +ATOM 223 CA HIS A 223 246.543 227.602 206.180 1.00 0.00 C +ATOM 224 CA GLU A 224 249.885 225.827 206.624 1.00 0.00 C +ATOM 225 CA LYS A 225 250.346 224.414 210.133 1.00 0.00 C +ATOM 226 CA LYS A 226 251.091 220.678 210.126 1.00 0.00 C +ATOM 227 CA GLY A 227 254.410 219.797 211.775 1.00 0.00 C +ATOM 228 CA MET A 228 258.165 219.189 211.551 1.00 0.00 C +ATOM 229 CA MET A 229 260.719 216.640 210.330 1.00 0.00 C +ATOM 230 CA GLU A 230 261.980 214.098 207.787 1.00 0.00 C +ATOM 231 CA LYS A 231 262.794 210.528 208.842 1.00 0.00 C +ATOM 232 CA ILE A 232 261.819 207.552 211.011 1.00 0.00 C +ATOM 233 CA LYS A 233 263.905 207.678 214.197 1.00 0.00 C +ATOM 234 CA GLU A 234 264.448 204.278 215.829 1.00 0.00 C +ATOM 235 CA LYS A 235 266.026 200.847 216.332 1.00 0.00 C +ATOM 236 CA LEU A 236 265.149 197.340 217.536 1.00 0.00 C +ATOM 237 CA PRO A 237 266.724 196.707 220.947 1.00 0.00 C +ATOM 238 CA GLY A 238 266.768 197.449 224.684 1.00 0.00 C +ATOM 239 CA HIS A 239 264.662 195.694 227.330 1.00 0.00 C +ATOM 240 CA HIS A 240 263.883 191.993 227.793 1.00 0.00 C +TER 241 HIS A 240 +END diff --git a/Plants/Q8GUM6/Q8GUM6.dcd b/Plants/Q8GUM6/Q8GUM6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..40d8b1f4dfa81e5af1960f25e03f69edfc6a5faf --- /dev/null +++ b/Plants/Q8GUM6/Q8GUM6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:8016d37b3c87fc480323543fc3c84298083345fd1cf24c0b94b01043dd7230d1 +size 106480276 diff --git a/Plants/Q8GUM6/top.pdb b/Plants/Q8GUM6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..4f0e87809cc707ee9f964255b80894429ebe68c8 --- /dev/null +++ b/Plants/Q8GUM6/top.pdb @@ -0,0 +1,441 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 1070.000 1070.000 1070.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 537.996 733.929 561.628 1.00 0.00 C +ATOM 2 CA GLY A 2 537.081 731.777 558.620 1.00 0.00 C +ATOM 3 CA ARG A 3 537.840 732.241 554.915 1.00 0.00 C +ATOM 4 CA LYS A 4 541.443 731.154 554.321 1.00 0.00 C +ATOM 5 CA LYS A 5 543.230 728.714 556.639 1.00 0.00 C +ATOM 6 CA PRO A 6 541.657 725.562 558.091 1.00 0.00 C +ATOM 7 CA SER A 7 539.818 722.904 560.108 1.00 0.00 C +ATOM 8 CA ALA A 8 538.891 724.243 563.552 1.00 0.00 C +ATOM 9 CA ARG A 9 538.170 721.354 565.929 1.00 0.00 C +ATOM 10 CA GLY A 10 534.971 719.336 565.467 1.00 0.00 C +ATOM 11 CA GLY A 11 534.178 717.225 568.538 1.00 0.00 C +ATOM 12 CA ASP A 12 534.386 714.243 570.900 1.00 0.00 C +ATOM 13 CA ALA A 13 534.251 710.466 570.416 1.00 0.00 C +ATOM 14 CA GLU A 14 534.375 706.672 570.089 1.00 0.00 C +ATOM 15 CA GLN A 15 534.495 703.273 571.805 1.00 0.00 C +ATOM 16 CA GLN A 16 533.967 699.516 572.158 1.00 0.00 C +ATOM 17 CA PRO A 17 534.656 696.199 570.413 1.00 0.00 C +ATOM 18 CA PRO A 18 536.868 693.266 571.423 1.00 0.00 C +ATOM 19 CA ALA A 19 539.664 691.231 573.022 1.00 0.00 C +ATOM 20 CA SER A 20 542.491 688.679 573.129 1.00 0.00 C +ATOM 21 CA SER A 21 541.274 685.113 573.692 1.00 0.00 C +ATOM 22 CA LEU A 22 540.050 681.516 573.405 1.00 0.00 C +ATOM 23 CA VAL A 23 540.032 678.329 571.317 1.00 0.00 C +ATOM 24 CA GLY A 24 541.021 674.925 572.713 1.00 0.00 C +ATOM 25 CA ALA A 25 540.733 671.577 570.918 1.00 0.00 C +ATOM 26 CA THR A 26 539.331 668.871 568.632 1.00 0.00 C +ATOM 27 CA LYS A 27 541.556 665.789 568.372 1.00 0.00 C +ATOM 28 CA SER A 28 543.479 662.551 568.947 1.00 0.00 C +ATOM 29 CA LYS A 29 545.736 660.218 566.952 1.00 0.00 C +ATOM 30 CA LYS A 30 544.733 656.562 567.332 1.00 0.00 C +ATOM 31 CA LYS A 31 546.988 654.470 565.084 1.00 0.00 C +ATOM 32 CA GLY A 32 549.666 656.456 563.239 1.00 0.00 C +ATOM 33 CA ALA A 33 550.813 660.022 562.546 1.00 0.00 C +ATOM 34 CA GLN A 34 553.360 661.003 565.204 1.00 0.00 C +ATOM 35 CA ILE A 35 553.593 661.187 569.003 1.00 0.00 C +ATOM 36 CA ASP A 36 555.691 660.751 572.153 1.00 0.00 C +ATOM 37 CA ASP A 37 554.745 660.718 575.843 1.00 0.00 C +ATOM 38 CA ASP A 38 553.513 658.448 578.645 1.00 0.00 C +ATOM 39 CA GLU A 39 552.727 655.541 580.979 1.00 0.00 C +ATOM 40 CA TYR A 40 553.420 652.082 582.415 1.00 0.00 C +ATOM 41 CA SER A 41 552.179 649.009 580.536 1.00 0.00 C +ATOM 42 CA ILE A 42 550.000 645.945 581.152 1.00 0.00 C +ATOM 43 CA GLY A 43 546.293 645.066 581.208 1.00 0.00 C +ATOM 44 CA THR A 44 543.210 645.561 579.024 1.00 0.00 C +ATOM 45 CA GLU A 45 542.051 649.092 579.863 1.00 0.00 C +ATOM 46 CA LEU A 46 541.046 652.496 578.477 1.00 0.00 C +ATOM 47 CA SER A 47 539.687 655.570 576.683 1.00 0.00 C +ATOM 48 CA GLU A 48 536.647 657.799 577.236 1.00 0.00 C +ATOM 49 CA GLU A 49 535.349 661.095 578.637 1.00 0.00 C +ATOM 50 CA SER A 50 535.160 664.636 580.031 1.00 0.00 C +ATOM 51 CA LYS A 51 537.183 666.417 582.723 1.00 0.00 C +ATOM 52 CA VAL A 52 538.462 668.490 585.653 1.00 0.00 C +ATOM 53 CA GLU A 53 538.924 666.779 589.025 1.00 0.00 C +ATOM 54 CA GLU A 54 536.436 664.219 590.356 1.00 0.00 C +ATOM 55 CA GLU A 55 535.909 661.131 588.187 1.00 0.00 C +ATOM 56 CA LYS A 56 538.249 658.174 588.732 1.00 0.00 C +ATOM 57 CA VAL A 57 538.766 655.731 585.855 1.00 0.00 C +ATOM 58 CA VAL A 58 536.516 652.685 586.269 1.00 0.00 C +ATOM 59 CA VAL A 59 533.144 651.487 587.579 1.00 0.00 C +ATOM 60 CA ILE A 60 530.051 650.586 589.613 1.00 0.00 C +ATOM 61 CA THR A 61 528.914 651.449 593.145 1.00 0.00 C +ATOM 62 CA GLY A 62 526.838 654.508 594.067 1.00 0.00 C +ATOM 63 CA LYS A 63 527.343 657.946 592.505 1.00 0.00 C +ATOM 64 CA LYS A 64 531.087 658.603 592.245 1.00 0.00 C +ATOM 65 CA LYS A 65 534.289 657.975 594.212 1.00 0.00 C +ATOM 66 CA GLY A 66 535.303 661.195 595.978 1.00 0.00 C +ATOM 67 CA LYS A 67 534.374 664.819 596.699 1.00 0.00 C +ATOM 68 CA LYS A 68 532.959 668.329 597.141 1.00 0.00 C +ATOM 69 CA GLY A 69 532.178 672.056 597.255 1.00 0.00 C +ATOM 70 CA ASN A 70 530.817 675.524 598.051 1.00 0.00 C +ATOM 71 CA LYS A 71 528.456 677.039 595.472 1.00 0.00 C +ATOM 72 CA LYS A 72 525.355 674.970 594.689 1.00 0.00 C +ATOM 73 CA GLY A 73 523.266 671.784 594.641 1.00 0.00 C +ATOM 74 CA THR A 74 521.005 669.809 592.294 1.00 0.00 C +ATOM 75 CA GLN A 75 520.182 666.810 590.092 1.00 0.00 C +ATOM 76 CA GLN A 76 517.415 664.229 590.531 1.00 0.00 C +ATOM 77 CA ASP A 77 517.454 661.666 587.712 1.00 0.00 C +ATOM 78 CA ASP A 78 520.138 660.144 585.478 1.00 0.00 C +ATOM 79 CA ASP A 79 520.578 661.166 581.834 1.00 0.00 C +ATOM 80 CA ASP A 80 521.784 661.079 578.221 1.00 0.00 C +ATOM 81 CA ASP A 81 522.435 658.494 575.499 1.00 0.00 C +ATOM 82 CA PHE A 82 520.003 656.138 573.751 1.00 0.00 C +ATOM 83 CA SER A 83 517.404 653.613 572.575 1.00 0.00 C +ATOM 84 CA ASP A 84 518.673 650.134 573.470 1.00 0.00 C +ATOM 85 CA LYS A 85 522.477 650.332 573.474 1.00 0.00 C +ATOM 86 CA VAL A 86 526.007 651.651 572.910 1.00 0.00 C +ATOM 87 CA SER A 87 527.337 655.090 573.872 1.00 0.00 C +ATOM 88 CA ALA A 88 529.327 658.225 574.724 1.00 0.00 C +ATOM 89 CA ALA A 89 528.932 661.647 576.352 1.00 0.00 C +ATOM 90 CA GLY A 90 528.630 662.669 580.010 1.00 0.00 C +ATOM 91 CA VAL A 91 528.427 665.770 582.213 1.00 0.00 C +ATOM 92 CA LYS A 92 527.572 668.945 584.138 1.00 0.00 C +ATOM 93 CA ASP A 93 526.145 670.146 587.460 1.00 0.00 C +ATOM 94 CA ASP A 94 528.222 672.349 589.773 1.00 0.00 C +ATOM 95 CA VAL A 95 530.418 669.896 591.689 1.00 0.00 C +ATOM 96 CA PRO A 96 529.992 666.310 590.475 1.00 0.00 C +ATOM 97 CA GLU A 97 528.058 664.005 588.139 1.00 0.00 C +ATOM 98 CA ILE A 98 526.532 661.377 585.840 1.00 0.00 C +ATOM 99 CA ALA A 99 527.882 658.012 584.670 1.00 0.00 C +ATOM 100 CA PHE A 100 525.799 655.388 586.485 1.00 0.00 C +ATOM 101 CA VAL A 101 523.722 652.909 584.471 1.00 0.00 C +ATOM 102 CA GLY A 102 520.612 651.901 586.427 1.00 0.00 C +ATOM 103 CA LYS A 103 519.603 648.514 587.851 1.00 0.00 C +ATOM 104 CA LYS A 104 522.164 645.710 587.533 1.00 0.00 C +ATOM 105 CA LYS A 105 523.101 642.744 585.333 1.00 0.00 C +ATOM 106 CA SER A 106 523.826 643.840 581.757 1.00 0.00 C +ATOM 107 CA LYS A 107 523.041 641.796 578.639 1.00 0.00 C +ATOM 108 CA GLY A 108 523.644 643.569 575.321 1.00 0.00 C +ATOM 109 CA LYS A 109 526.808 641.986 573.907 1.00 0.00 C +ATOM 110 CA LYS A 110 527.392 639.038 571.566 1.00 0.00 C +ATOM 111 CA GLY A 111 529.883 636.436 572.808 1.00 0.00 C +ATOM 112 CA GLY A 112 532.236 636.993 575.752 1.00 0.00 C +ATOM 113 CA GLY A 113 532.678 634.171 578.274 1.00 0.00 C +ATOM 114 CA SER A 114 533.788 633.228 581.794 1.00 0.00 C +ATOM 115 CA VAL A 115 534.436 634.259 585.404 1.00 0.00 C +ATOM 116 CA SER A 116 534.521 632.570 588.819 1.00 0.00 C +ATOM 117 CA PHE A 117 537.750 630.579 589.175 1.00 0.00 C +ATOM 118 CA ALA A 118 539.787 631.521 592.253 1.00 0.00 C +ATOM 119 CA LEU A 119 540.689 628.451 594.321 1.00 0.00 C +ATOM 120 CA LEU A 120 538.861 627.687 597.575 1.00 0.00 C +ATOM 121 CA ASP A 121 535.071 627.323 597.726 1.00 0.00 C +ATOM 122 CA ASP A 122 531.917 627.758 599.818 1.00 0.00 C +ATOM 123 CA GLU A 123 530.347 629.129 603.007 1.00 0.00 C +ATOM 124 CA ASP A 124 527.585 627.134 604.712 1.00 0.00 C +ATOM 125 CA GLU A 125 527.946 623.548 605.948 1.00 0.00 C +ATOM 126 CA LYS A 126 529.466 621.503 608.781 1.00 0.00 C +ATOM 127 CA GLU A 127 527.073 618.662 609.631 1.00 0.00 C +ATOM 128 CA ASP A 128 528.943 615.356 609.333 1.00 0.00 C +ATOM 129 CA ASN A 129 527.273 613.036 611.851 1.00 0.00 C +ATOM 130 CA GLU A 130 528.300 609.446 612.609 1.00 0.00 C +ATOM 131 CA SER A 131 529.603 607.719 609.473 1.00 0.00 C +ATOM 132 CA ASP A 132 530.752 609.547 606.333 1.00 0.00 C +ATOM 133 CA GLY A 133 533.701 607.570 604.951 1.00 0.00 C +ATOM 134 CA ASP A 134 536.294 606.100 602.578 1.00 0.00 C +ATOM 135 CA LYS A 135 539.313 603.847 602.007 1.00 0.00 C +ATOM 136 CA ASP A 136 539.371 602.707 598.371 1.00 0.00 C +ATOM 137 CA ASP A 137 537.826 601.925 594.978 1.00 0.00 C +ATOM 138 CA GLU A 138 535.021 602.599 592.489 1.00 0.00 C +ATOM 139 CA PRO A 139 532.694 599.592 592.234 1.00 0.00 C +ATOM 140 CA VAL A 140 534.203 596.110 591.902 1.00 0.00 C +ATOM 141 CA ILE A 141 533.259 593.083 594.015 1.00 0.00 C +ATOM 142 CA SER A 142 532.750 589.788 595.860 1.00 0.00 C +ATOM 143 CA PHE A 143 531.349 586.348 595.013 1.00 0.00 C +ATOM 144 CA THR A 144 534.181 584.064 593.883 1.00 0.00 C +ATOM 145 CA GLY A 145 537.259 584.453 596.095 1.00 0.00 C +ATOM 146 CA LYS A 146 539.560 581.501 596.808 1.00 0.00 C +ATOM 147 CA LYS A 147 538.025 578.023 597.052 1.00 0.00 C +ATOM 148 CA HIS A 148 537.676 575.408 599.801 1.00 0.00 C +ATOM 149 CA ALA A 149 537.620 571.761 598.700 1.00 0.00 C +ATOM 150 CA SER A 150 536.823 570.396 595.233 1.00 0.00 C +ATOM 151 CA LYS A 151 534.336 569.219 592.598 1.00 0.00 C +ATOM 152 CA LYS A 152 533.957 568.605 588.857 1.00 0.00 C +ATOM 153 CA GLY A 153 534.347 565.944 586.158 1.00 0.00 C +ATOM 154 CA LYS A 154 531.933 566.674 583.302 1.00 0.00 C +ATOM 155 CA LYS A 155 528.702 565.442 581.703 1.00 0.00 C +ATOM 156 CA GLY A 156 529.205 565.674 577.934 1.00 0.00 C +ATOM 157 CA GLY A 157 531.214 568.281 576.014 1.00 0.00 C +ATOM 158 CA ASN A 158 534.872 568.555 574.985 1.00 0.00 C +ATOM 159 CA SER A 159 537.425 566.659 577.084 1.00 0.00 C +ATOM 160 CA PHE A 160 538.371 563.366 578.750 1.00 0.00 C +ATOM 161 CA ALA A 161 538.870 562.736 582.474 1.00 0.00 C +ATOM 162 CA ALA A 162 540.683 559.448 583.120 1.00 0.00 C +ATOM 163 CA SER A 163 543.202 556.593 582.977 1.00 0.00 C +ATOM 164 CA ALA A 164 542.827 552.958 584.053 1.00 0.00 C +ATOM 165 CA PHE A 165 544.720 550.477 581.867 1.00 0.00 C +ATOM 166 CA ASP A 166 544.191 547.276 579.869 1.00 0.00 C +ATOM 167 CA ALA A 167 546.231 547.723 576.682 1.00 0.00 C +ATOM 168 CA LEU A 168 543.839 549.387 574.228 1.00 0.00 C +ATOM 169 CA GLY A 169 541.967 550.428 571.077 1.00 0.00 C +ATOM 170 CA SER A 170 539.678 553.474 571.096 1.00 0.00 C +ATOM 171 CA ASP A 171 535.879 553.587 571.367 1.00 0.00 C +ATOM 172 CA ASP A 172 532.242 554.720 571.382 1.00 0.00 C +ATOM 173 CA ASP A 173 528.929 554.345 573.227 1.00 0.00 C +ATOM 174 CA ASP A 174 525.330 554.798 572.062 1.00 0.00 C +ATOM 175 CA THR A 175 524.488 556.610 568.818 1.00 0.00 C +ATOM 176 CA GLU A 176 525.314 557.018 565.121 1.00 0.00 C +ATOM 177 CA GLU A 177 526.233 554.635 562.294 1.00 0.00 C +ATOM 178 CA VAL A 178 530.017 554.214 562.411 1.00 0.00 C +ATOM 179 CA HIS A 179 532.484 556.542 560.676 1.00 0.00 C +ATOM 180 CA GLU A 180 534.476 558.561 558.132 1.00 0.00 C +ATOM 181 CA ASP A 181 535.905 556.961 554.983 1.00 0.00 C +ATOM 182 CA GLU A 182 534.622 557.387 551.421 1.00 0.00 C +ATOM 183 CA GLU A 183 536.769 559.887 549.510 1.00 0.00 C +ATOM 184 CA GLU A 184 536.166 560.076 545.753 1.00 0.00 C +ATOM 185 CA GLU A 185 538.351 558.274 543.204 1.00 0.00 C +ATOM 186 CA SER A 186 537.423 556.388 540.027 1.00 0.00 C +ATOM 187 CA PRO A 187 535.155 555.763 537.030 1.00 0.00 C +ATOM 188 CA ILE A 188 532.726 552.933 536.252 1.00 0.00 C +ATOM 189 CA THR A 189 530.883 549.639 536.774 1.00 0.00 C +ATOM 190 CA PHE A 190 529.433 548.312 533.510 1.00 0.00 C +ATOM 191 CA SER A 191 528.133 544.815 532.739 1.00 0.00 C +ATOM 192 CA GLY A 192 525.027 542.900 531.641 1.00 0.00 C +ATOM 193 CA LYS A 193 521.456 542.154 532.739 1.00 0.00 C +ATOM 194 CA LYS A 194 519.466 539.304 534.300 1.00 0.00 C +ATOM 195 CA LYS A 195 515.762 539.616 535.138 1.00 0.00 C +ATOM 196 CA LYS A 196 514.434 538.191 538.412 1.00 0.00 C +ATOM 197 CA SER A 197 514.874 535.226 540.764 1.00 0.00 C +ATOM 198 CA SER A 198 515.698 531.800 539.316 1.00 0.00 C +ATOM 199 CA LYS A 199 515.277 529.422 536.369 1.00 0.00 C +ATOM 200 CA SER A 200 511.777 528.247 535.429 1.00 0.00 C +ATOM 201 CA SER A 201 509.524 528.612 538.480 1.00 0.00 C +ATOM 202 CA LYS A 202 509.453 527.246 542.036 1.00 0.00 C +ATOM 203 CA LYS A 203 506.287 525.276 542.818 1.00 0.00 C +ATOM 204 CA ASN A 204 502.767 526.716 543.051 1.00 0.00 C +ATOM 205 CA THR A 205 500.078 525.252 545.318 1.00 0.00 C +ATOM 206 CA ASN A 206 499.846 527.402 548.455 1.00 0.00 C +ATOM 207 CA SER A 207 497.633 529.453 550.781 1.00 0.00 C +ATOM 208 CA PHE A 208 495.608 531.872 548.645 1.00 0.00 C +ATOM 209 CA THR A 209 493.031 530.181 546.405 1.00 0.00 C +ATOM 210 CA ALA A 210 491.399 528.659 543.317 1.00 0.00 C +ATOM 211 CA ASP A 211 490.870 528.393 539.553 1.00 0.00 C +ATOM 212 CA LEU A 212 489.104 526.500 536.758 1.00 0.00 C +ATOM 213 CA LEU A 213 488.864 528.700 533.657 1.00 0.00 C +ATOM 214 CA ASP A 214 488.810 528.957 529.856 1.00 0.00 C +ATOM 215 CA GLU A 215 491.380 527.901 527.249 1.00 0.00 C +ATOM 216 CA GLU A 216 490.478 525.260 524.656 1.00 0.00 C +ATOM 217 CA GLU A 217 491.648 525.772 521.067 1.00 0.00 C +ATOM 218 CA GLY A 218 492.836 523.056 518.672 1.00 0.00 C +ATOM 219 CA THR A 219 492.803 519.252 518.879 1.00 0.00 C +ATOM 220 CA ASP A 220 493.340 518.489 522.573 1.00 0.00 C +ATOM 221 CA ALA A 221 495.916 517.843 525.305 1.00 0.00 C +ATOM 222 CA SER A 222 494.643 515.334 527.874 1.00 0.00 C +ATOM 223 CA ASN A 223 492.047 512.680 528.729 1.00 0.00 C +ATOM 224 CA SER A 224 490.182 509.575 527.549 1.00 0.00 C +ATOM 225 CA ARG A 225 488.010 506.527 528.265 1.00 0.00 C +ATOM 226 CA ASP A 226 486.906 503.619 530.465 1.00 0.00 C +ATOM 227 CA ASP A 227 488.237 502.428 533.831 1.00 0.00 C +ATOM 228 CA GLU A 228 489.208 503.871 537.220 1.00 0.00 C +ATOM 229 CA ASN A 229 488.053 505.162 540.614 1.00 0.00 C +ATOM 230 CA THR A 230 490.107 506.212 543.646 1.00 0.00 C +ATOM 231 CA ILE A 231 491.047 509.879 544.079 1.00 0.00 C +ATOM 232 CA GLU A 232 489.981 512.814 541.896 1.00 0.00 C +ATOM 233 CA ASP A 233 492.154 515.096 539.754 1.00 0.00 C +ATOM 234 CA GLU A 234 495.359 517.059 539.132 1.00 0.00 C +ATOM 235 CA GLU A 235 498.971 517.280 537.939 1.00 0.00 C +ATOM 236 CA SER A 236 498.855 519.178 534.638 1.00 0.00 C +ATOM 237 CA PRO A 237 502.215 519.186 532.841 1.00 0.00 C +ATOM 238 CA GLU A 238 503.626 519.580 529.324 1.00 0.00 C +ATOM 239 CA VAL A 239 505.597 520.614 526.232 1.00 0.00 C +ATOM 240 CA THR A 240 509.214 521.390 525.319 1.00 0.00 C +ATOM 241 CA PHE A 241 512.559 522.562 523.922 1.00 0.00 C +ATOM 242 CA SER A 242 515.723 522.175 526.009 1.00 0.00 C +ATOM 243 CA GLY A 243 518.844 520.051 525.497 1.00 0.00 C +ATOM 244 CA LYS A 244 521.948 518.988 523.560 1.00 0.00 C +ATOM 245 CA LYS A 245 522.264 516.116 521.076 1.00 0.00 C +ATOM 246 CA LYS A 246 524.805 513.292 521.362 1.00 0.00 C +ATOM 247 CA SER A 247 525.504 511.412 518.123 1.00 0.00 C +ATOM 248 CA SER A 248 526.719 507.959 517.066 1.00 0.00 C +ATOM 249 CA LYS A 249 525.153 506.069 514.152 1.00 0.00 C +ATOM 250 CA LYS A 250 524.752 502.341 513.474 1.00 0.00 C +ATOM 251 CA LYS A 251 522.052 499.799 512.601 1.00 0.00 C +ATOM 252 CA GLY A 252 521.200 496.635 510.657 1.00 0.00 C +ATOM 253 CA GLY A 253 519.459 496.619 507.268 1.00 0.00 C +ATOM 254 CA SER A 254 518.114 500.043 506.280 1.00 0.00 C +ATOM 255 CA VAL A 255 516.217 503.223 507.178 1.00 0.00 C +ATOM 256 CA LEU A 256 515.473 506.655 505.699 1.00 0.00 C +ATOM 257 CA ALA A 257 516.912 509.459 507.840 1.00 0.00 C +ATOM 258 CA SER A 258 515.194 510.275 511.142 1.00 0.00 C +ATOM 259 CA VAL A 259 514.241 507.845 513.917 1.00 0.00 C +ATOM 260 CA GLY A 260 514.411 506.544 517.494 1.00 0.00 C +ATOM 261 CA ASP A 261 512.208 503.494 518.099 1.00 0.00 C +ATOM 262 CA ASP A 262 514.075 500.321 517.117 1.00 0.00 C +ATOM 263 CA SER A 263 513.487 499.216 513.519 1.00 0.00 C +ATOM 264 CA VAL A 264 511.385 498.951 510.352 1.00 0.00 C +ATOM 265 CA ALA A 265 511.239 495.749 508.292 1.00 0.00 C +ATOM 266 CA ASP A 266 508.427 495.502 505.733 1.00 0.00 C +ATOM 267 CA GLU A 267 507.300 495.996 502.128 1.00 0.00 C +ATOM 268 CA THR A 268 507.295 496.801 498.404 1.00 0.00 C +ATOM 269 CA LYS A 269 510.871 496.219 497.226 1.00 0.00 C +ATOM 270 CA THR A 270 514.542 496.856 496.432 1.00 0.00 C +ATOM 271 CA SER A 271 516.910 497.598 499.323 1.00 0.00 C +ATOM 272 CA ASP A 272 520.537 498.172 500.339 1.00 0.00 C +ATOM 273 CA THR A 273 524.114 498.839 499.209 1.00 0.00 C +ATOM 274 CA LYS A 274 525.669 501.045 496.521 1.00 0.00 C +ATOM 275 CA ASN A 275 529.235 502.374 496.331 1.00 0.00 C +ATOM 276 CA VAL A 276 531.142 505.625 495.775 1.00 0.00 C +ATOM 277 CA GLU A 277 531.122 508.889 493.811 1.00 0.00 C +ATOM 278 CA VAL A 278 529.319 512.244 493.701 1.00 0.00 C +ATOM 279 CA VAL A 279 531.795 515.126 493.422 1.00 0.00 C +ATOM 280 CA GLU A 280 532.946 515.298 489.794 1.00 0.00 C +ATOM 281 CA THR A 281 530.149 514.328 487.395 1.00 0.00 C +ATOM 282 CA GLY A 282 530.046 510.672 486.327 1.00 0.00 C +ATOM 283 CA LYS A 283 532.899 508.384 487.397 1.00 0.00 C +ATOM 284 CA SER A 284 536.099 507.149 485.739 1.00 0.00 C +ATOM 285 CA LYS A 285 536.705 506.754 481.998 1.00 0.00 C +ATOM 286 CA LYS A 286 533.772 506.926 479.573 1.00 0.00 C +ATOM 287 CA LYS A 287 532.037 505.157 476.678 1.00 0.00 C +ATOM 288 CA LYS A 288 530.896 501.674 477.720 1.00 0.00 C +ATOM 289 CA LYS A 289 528.259 499.099 478.682 1.00 0.00 C +ATOM 290 CA ASN A 290 529.464 495.656 479.782 1.00 0.00 C +ATOM 291 CA ASN A 291 526.395 493.631 480.781 1.00 0.00 C +ATOM 292 CA LYS A 292 522.738 494.190 479.871 1.00 0.00 C +ATOM 293 CA SER A 293 521.685 492.084 476.875 1.00 0.00 C +ATOM 294 CA GLY A 294 518.560 491.188 474.889 1.00 0.00 C +ATOM 295 CA ARG A 295 519.625 490.414 471.314 1.00 0.00 C +ATOM 296 CA THR A 296 518.290 487.622 469.091 1.00 0.00 C +ATOM 297 CA VAL A 297 514.600 488.258 468.391 1.00 0.00 C +ATOM 298 CA GLN A 298 511.554 486.844 466.591 1.00 0.00 C +ATOM 299 CA GLU A 299 507.858 487.134 467.468 1.00 0.00 C +ATOM 300 CA GLU A 300 506.337 484.123 469.239 1.00 0.00 C +ATOM 301 CA GLU A 301 505.243 480.523 468.640 1.00 0.00 C +ATOM 302 CA ASP A 302 503.441 478.101 466.316 1.00 0.00 C +ATOM 303 CA LEU A 303 501.923 476.908 463.031 1.00 0.00 C +ATOM 304 CA ASP A 304 498.874 474.672 463.504 1.00 0.00 C +ATOM 305 CA LYS A 305 495.651 474.207 465.483 1.00 0.00 C +ATOM 306 CA LEU A 306 493.261 474.285 468.449 1.00 0.00 C +ATOM 307 CA LEU A 307 494.645 474.629 471.982 1.00 0.00 C +ATOM 308 CA ALA A 308 498.066 474.671 473.658 1.00 0.00 C +ATOM 309 CA ALA A 309 501.475 476.133 472.785 1.00 0.00 C +ATOM 310 CA LEU A 310 504.854 476.792 474.417 1.00 0.00 C +ATOM 311 CA GLY A 311 507.247 476.631 477.377 1.00 0.00 C +ATOM 312 CA GLU A 312 510.732 478.155 477.583 1.00 0.00 C +ATOM 313 CA THR A 313 514.186 479.755 477.747 1.00 0.00 C +ATOM 314 CA PRO A 314 516.784 479.211 475.013 1.00 0.00 C +ATOM 315 CA ALA A 315 520.240 480.093 473.675 1.00 0.00 C +ATOM 316 CA ALA A 316 522.159 479.056 470.551 1.00 0.00 C +ATOM 317 CA GLU A 317 521.064 479.497 466.929 1.00 0.00 C +ATOM 318 CA ARG A 318 519.447 476.187 465.955 1.00 0.00 C +ATOM 319 CA PRO A 319 516.474 474.055 467.017 1.00 0.00 C +ATOM 320 CA ALA A 320 517.627 470.690 468.383 1.00 0.00 C +ATOM 321 CA SER A 321 519.837 467.659 469.055 1.00 0.00 C +ATOM 322 CA SER A 322 521.383 465.540 471.818 1.00 0.00 C +ATOM 323 CA THR A 323 520.408 464.340 475.300 1.00 0.00 C +ATOM 324 CA PRO A 324 521.075 464.220 479.049 1.00 0.00 C +ATOM 325 CA VAL A 325 523.610 462.167 481.018 1.00 0.00 C +ATOM 326 CA GLU A 326 527.076 460.586 480.927 1.00 0.00 C +ATOM 327 CA GLU A 327 529.760 458.763 478.931 1.00 0.00 C +ATOM 328 CA LYS A 328 533.369 458.123 477.892 1.00 0.00 C +ATOM 329 CA ALA A 329 536.767 456.517 478.519 1.00 0.00 C +ATOM 330 CA ALA A 330 537.262 452.739 478.539 1.00 0.00 C +ATOM 331 CA GLN A 331 536.703 448.996 478.979 1.00 0.00 C +ATOM 332 CA PRO A 332 538.635 445.803 478.213 1.00 0.00 C +ATOM 333 CA GLU A 333 542.013 444.832 479.685 1.00 0.00 C +ATOM 334 CA PRO A 334 543.536 442.168 481.943 1.00 0.00 C +ATOM 335 CA VAL A 335 542.607 438.590 481.022 1.00 0.00 C +ATOM 336 CA ALA A 336 542.149 435.386 479.010 1.00 0.00 C +ATOM 337 CA PRO A 337 541.171 432.399 481.164 1.00 0.00 C +ATOM 338 CA VAL A 338 538.769 429.714 482.403 1.00 0.00 C +ATOM 339 CA GLU A 339 538.780 427.022 485.099 1.00 0.00 C +ATOM 340 CA ASN A 340 540.413 424.493 487.433 1.00 0.00 C +ATOM 341 CA ALA A 341 538.490 424.091 490.698 1.00 0.00 C +ATOM 342 CA GLY A 342 537.516 424.146 494.381 1.00 0.00 C +ATOM 343 CA GLU A 343 539.800 425.317 497.196 1.00 0.00 C +ATOM 344 CA LYS A 344 542.476 424.781 499.855 1.00 0.00 C +ATOM 345 CA GLU A 345 544.211 424.083 503.175 1.00 0.00 C +ATOM 346 CA GLY A 346 541.789 424.228 506.113 1.00 0.00 C +ATOM 347 CA GLU A 347 542.866 426.514 508.964 1.00 0.00 C +ATOM 348 CA GLU A 348 545.811 426.323 511.374 1.00 0.00 C +ATOM 349 CA GLU A 349 548.784 428.474 510.349 1.00 0.00 C +ATOM 350 CA THR A 350 551.857 426.774 508.871 1.00 0.00 C +ATOM 351 CA ALA A 351 554.765 427.901 511.059 1.00 0.00 C +ATOM 352 CA ALA A 352 555.509 425.207 513.650 1.00 0.00 C +ATOM 353 CA GLU A 353 558.349 426.000 516.062 1.00 0.00 C +ATOM 354 CA LYS A 354 559.009 422.758 517.950 1.00 0.00 C +ATOM 355 CA LYS A 355 558.987 418.977 517.479 1.00 0.00 C +ATOM 356 CA LYS A 356 557.556 416.705 514.776 1.00 0.00 C +ATOM 357 CA LYS A 357 554.746 416.400 512.222 1.00 0.00 C +ATOM 358 CA LYS A 358 552.581 417.803 509.419 1.00 0.00 C +ATOM 359 CA LYS A 359 553.614 420.697 507.167 1.00 0.00 C +ATOM 360 CA LYS A 360 554.209 420.315 503.423 1.00 0.00 C +ATOM 361 CA GLU A 361 556.533 418.078 501.394 1.00 0.00 C +ATOM 362 CA LYS A 362 557.017 418.526 497.642 1.00 0.00 C +ATOM 363 CA GLU A 363 556.203 418.133 493.941 1.00 0.00 C +ATOM 364 CA LYS A 364 557.045 418.645 490.261 1.00 0.00 C +ATOM 365 CA GLU A 365 557.198 419.756 486.619 1.00 0.00 C +ATOM 366 CA LYS A 366 557.304 420.623 482.911 1.00 0.00 C +ATOM 367 CA LYS A 367 560.642 421.258 481.188 1.00 0.00 C +ATOM 368 CA ALA A 368 564.167 420.157 482.127 1.00 0.00 C +ATOM 369 CA ALA A 369 565.747 417.104 483.769 1.00 0.00 C +ATOM 370 CA ALA A 370 567.504 413.728 483.950 1.00 0.00 C +ATOM 371 CA ALA A 371 566.494 411.671 480.907 1.00 0.00 C +ATOM 372 CA ALA A 372 568.771 408.665 480.363 1.00 0.00 C +ATOM 373 CA ALA A 373 569.885 405.373 478.801 1.00 0.00 C +ATOM 374 CA ALA A 374 571.729 406.395 475.628 1.00 0.00 C +ATOM 375 CA THR A 375 571.867 409.401 473.290 1.00 0.00 C +ATOM 376 CA SER A 376 575.027 411.398 474.025 1.00 0.00 C +ATOM 377 CA SER A 377 575.846 411.846 477.719 1.00 0.00 C +ATOM 378 CA VAL A 378 576.351 412.225 481.477 1.00 0.00 C +ATOM 379 CA GLU A 379 576.837 410.032 484.554 1.00 0.00 C +ATOM 380 CA VAL A 380 577.076 406.230 484.527 1.00 0.00 C +ATOM 381 CA LYS A 381 578.024 403.143 482.505 1.00 0.00 C +ATOM 382 CA GLU A 382 578.265 403.631 478.734 1.00 0.00 C +ATOM 383 CA GLU A 383 578.792 400.841 476.194 1.00 0.00 C +ATOM 384 CA LYS A 384 580.100 400.304 472.656 1.00 0.00 C +ATOM 385 CA GLN A 385 582.672 398.412 470.577 1.00 0.00 C +ATOM 386 CA GLU A 386 586.178 397.256 469.635 1.00 0.00 C +ATOM 387 CA GLU A 387 587.418 394.627 467.171 1.00 0.00 C +ATOM 388 CA SER A 388 587.648 390.982 466.087 1.00 0.00 C +ATOM 389 CA VAL A 389 589.424 387.959 464.597 1.00 0.00 C +ATOM 390 CA THR A 390 587.673 384.981 466.205 1.00 0.00 C +ATOM 391 CA GLU A 391 587.835 383.767 469.813 1.00 0.00 C +ATOM 392 CA PRO A 392 585.551 384.053 472.849 1.00 0.00 C +ATOM 393 CA LEU A 393 584.356 380.956 474.718 1.00 0.00 C +ATOM 394 CA GLN A 394 585.762 379.618 477.996 1.00 0.00 C +ATOM 395 CA PRO A 395 587.956 381.927 480.088 1.00 0.00 C +ATOM 396 CA LYS A 396 591.572 383.115 480.247 1.00 0.00 C +ATOM 397 CA LYS A 397 594.272 382.186 482.770 1.00 0.00 C +ATOM 398 CA LYS A 398 596.558 379.232 483.516 1.00 0.00 C +ATOM 399 CA ASP A 399 600.058 380.738 483.516 1.00 0.00 C +ATOM 400 CA ALA A 400 601.541 383.306 485.908 1.00 0.00 C +ATOM 401 CA LYS A 401 602.712 386.739 487.074 1.00 0.00 C +ATOM 402 CA GLY A 402 601.627 390.052 488.611 1.00 0.00 C +ATOM 403 CA LYS A 403 599.922 391.966 491.430 1.00 0.00 C +ATOM 404 CA ALA A 404 597.804 391.409 494.547 1.00 0.00 C +ATOM 405 CA ALA A 405 595.557 394.437 495.093 1.00 0.00 C +ATOM 406 CA GLU A 406 593.571 396.937 493.014 1.00 0.00 C +ATOM 407 CA LYS A 407 591.447 399.177 495.247 1.00 0.00 C +ATOM 408 CA LYS A 408 589.767 399.807 498.608 1.00 0.00 C +ATOM 409 CA ILE A 409 587.532 396.797 499.286 1.00 0.00 C +ATOM 410 CA PRO A 410 585.606 394.016 501.039 1.00 0.00 C +ATOM 411 CA LYS A 411 583.184 391.078 500.895 1.00 0.00 C +ATOM 412 CA HIS A 412 579.784 391.469 499.220 1.00 0.00 C +ATOM 413 CA VAL A 413 579.208 395.219 498.872 1.00 0.00 C +ATOM 414 CA ARG A 414 575.646 395.947 497.736 1.00 0.00 C +ATOM 415 CA GLU A 415 572.663 394.847 499.836 1.00 0.00 C +ATOM 416 CA MET A 416 572.034 391.118 499.369 1.00 0.00 C +ATOM 417 CA GLN A 417 573.514 388.372 501.557 1.00 0.00 C +ATOM 418 CA GLU A 418 571.910 384.917 501.647 1.00 0.00 C +ATOM 419 CA ALA A 419 568.220 384.007 501.380 1.00 0.00 C +ATOM 420 CA LEU A 420 566.196 385.422 504.282 1.00 0.00 C +ATOM 421 CA ALA A 421 563.763 382.796 505.586 1.00 0.00 C +ATOM 422 CA ARG A 422 562.890 379.099 505.297 1.00 0.00 C +ATOM 423 CA ARG A 423 562.378 376.031 503.096 1.00 0.00 C +ATOM 424 CA GLN A 424 563.099 372.370 502.325 1.00 0.00 C +ATOM 425 CA GLU A 425 560.114 370.459 503.724 1.00 0.00 C +ATOM 426 CA ALA A 426 556.474 369.392 503.366 1.00 0.00 C +ATOM 427 CA GLU A 427 553.070 370.048 501.786 1.00 0.00 C +ATOM 428 CA GLU A 428 549.650 368.402 502.123 1.00 0.00 C +ATOM 429 CA ARG A 429 547.536 365.337 502.931 1.00 0.00 C +ATOM 430 CA LYS A 430 546.111 362.026 504.164 1.00 0.00 C +ATOM 431 CA LYS A 431 547.020 359.438 506.809 1.00 0.00 C +ATOM 432 CA LYS A 432 548.504 360.480 510.160 1.00 0.00 C +ATOM 433 CA GLU A 433 548.906 359.586 513.841 1.00 0.00 C +ATOM 434 CA GLU A 434 550.549 361.612 516.618 1.00 0.00 C +ATOM 435 CA GLU A 435 550.810 359.470 519.759 1.00 0.00 C +ATOM 436 CA GLU A 436 554.496 358.868 520.514 1.00 0.00 C +ATOM 437 CA LYS A 437 556.772 355.871 521.107 1.00 0.00 C +TER 438 LYS A 437 +END diff --git a/Plants/Q8GV08/Q8GV08.dcd b/Plants/Q8GV08/Q8GV08.dcd new file mode 100644 index 0000000000000000000000000000000000000000..b072fe90fd141bb7dca0ed53d98df92159eed35b --- /dev/null +++ b/Plants/Q8GV08/Q8GV08.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5dc064c99dbea9c91ec4f3e6936b759b7ffc154b231df576f8e3a4a6a6bb9977 +size 43320276 diff --git a/Plants/Q8GV08/top.pdb b/Plants/Q8GV08/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..8607084de4c10f90bfa102249ce270b9120e3d6f --- /dev/null +++ b/Plants/Q8GV08/top.pdb @@ -0,0 +1,238 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 255.869 308.082 206.788 1.00 0.00 C +ATOM 2 CA ALA A 2 253.225 310.821 206.962 1.00 0.00 C +ATOM 3 CA GLU A 3 250.312 311.562 209.302 1.00 0.00 C +ATOM 4 CA GLU A 4 246.542 311.936 208.899 1.00 0.00 C +ATOM 5 CA ILE A 5 244.828 308.553 209.260 1.00 0.00 C +ATOM 6 CA LYS A 6 241.040 308.137 209.284 1.00 0.00 C +ATOM 7 CA LYS A 7 238.592 305.550 207.933 1.00 0.00 C +ATOM 8 CA GLN A 8 235.910 305.058 210.594 1.00 0.00 C +ATOM 9 CA GLN A 9 234.487 304.921 214.126 1.00 0.00 C +ATOM 10 CA LYS A 10 231.445 302.800 215.000 1.00 0.00 C +ATOM 11 CA SER A 11 232.409 299.255 213.990 1.00 0.00 C +ATOM 12 CA HIS A 12 231.423 295.914 212.448 1.00 0.00 C +ATOM 13 CA GLU A 13 232.359 293.032 210.138 1.00 0.00 C +ATOM 14 CA TYR A 14 235.040 290.373 210.647 1.00 0.00 C +ATOM 15 CA GLU A 15 236.144 286.942 209.412 1.00 0.00 C +ATOM 16 CA PRO A 16 236.654 284.628 206.428 1.00 0.00 C +ATOM 17 CA SER A 17 238.226 283.832 203.050 1.00 0.00 C +ATOM 18 CA VAL A 18 239.675 280.333 202.635 1.00 0.00 C +ATOM 19 CA GLY A 19 241.681 277.807 200.609 1.00 0.00 C +ATOM 20 CA THR A 20 243.596 279.136 197.595 1.00 0.00 C +ATOM 21 CA GLU A 21 243.033 282.807 196.743 1.00 0.00 C +ATOM 22 CA GLY A 22 240.322 284.485 194.658 1.00 0.00 C +ATOM 23 CA ALA A 23 240.080 288.287 194.721 1.00 0.00 C +ATOM 24 CA VAL A 24 240.140 291.243 197.125 1.00 0.00 C +ATOM 25 CA GLU A 25 237.571 292.910 199.391 1.00 0.00 C +ATOM 26 CA THR A 26 233.814 292.298 199.541 1.00 0.00 C +ATOM 27 CA LYS A 27 230.938 293.578 197.395 1.00 0.00 C +ATOM 28 CA ASP A 28 228.536 292.721 194.565 1.00 0.00 C +ATOM 29 CA ARG A 29 225.493 290.539 193.861 1.00 0.00 C +ATOM 30 CA GLY A 30 222.422 290.455 196.115 1.00 0.00 C +ATOM 31 CA MET A 31 218.736 291.269 195.596 1.00 0.00 C +ATOM 32 CA LEU A 32 216.401 290.502 192.684 1.00 0.00 C +ATOM 33 CA ASP A 33 215.990 292.739 189.628 1.00 0.00 C +ATOM 34 CA PHE A 34 214.238 290.765 186.880 1.00 0.00 C +ATOM 35 CA LEU A 35 215.542 287.252 186.191 1.00 0.00 C +ATOM 36 CA GLY A 36 214.837 283.627 187.128 1.00 0.00 C +ATOM 37 CA LYS A 37 211.264 283.098 188.340 1.00 0.00 C +ATOM 38 CA LYS A 38 207.718 282.430 187.117 1.00 0.00 C +ATOM 39 CA GLU A 39 205.656 280.422 189.613 1.00 0.00 C +ATOM 40 CA GLU A 40 205.452 276.852 190.929 1.00 0.00 C +ATOM 41 CA GLU A 41 202.992 275.038 193.204 1.00 0.00 C +ATOM 42 CA LYS A 42 203.511 275.624 196.932 1.00 0.00 C +ATOM 43 CA PRO A 43 206.400 273.639 198.425 1.00 0.00 C +ATOM 44 CA GLN A 44 206.646 273.391 202.219 1.00 0.00 C +ATOM 45 CA HIS A 45 206.954 269.688 203.061 1.00 0.00 C +ATOM 46 CA HIS A 46 207.122 265.892 203.335 1.00 0.00 C +ATOM 47 CA ASP A 47 209.329 263.010 204.493 1.00 0.00 C +ATOM 48 CA GLN A 48 210.051 262.934 208.233 1.00 0.00 C +ATOM 49 CA GLU A 49 213.483 264.537 208.647 1.00 0.00 C +ATOM 50 CA VAL A 50 216.795 265.933 209.911 1.00 0.00 C +ATOM 51 CA ILE A 51 220.385 267.207 209.961 1.00 0.00 C +ATOM 52 CA ALA A 52 223.616 265.236 209.522 1.00 0.00 C +ATOM 53 CA THR A 53 225.670 262.292 208.247 1.00 0.00 C +ATOM 54 CA GLU A 54 228.642 261.759 205.922 1.00 0.00 C +ATOM 55 CA PHE A 55 232.035 263.461 205.597 1.00 0.00 C +ATOM 56 CA GLU A 56 231.524 267.222 205.930 1.00 0.00 C +ATOM 57 CA LYS A 57 233.630 269.887 207.656 1.00 0.00 C +ATOM 58 CA VAL A 58 235.364 272.204 210.134 1.00 0.00 C +ATOM 59 CA HIS A 59 236.147 275.787 209.100 1.00 0.00 C +ATOM 60 CA VAL A 60 233.965 278.755 210.074 1.00 0.00 C +ATOM 61 CA SER A 61 232.432 279.876 213.377 1.00 0.00 C +ATOM 62 CA GLU A 62 232.457 278.219 216.808 1.00 0.00 C +ATOM 63 CA PRO A 63 235.153 276.487 218.869 1.00 0.00 C +ATOM 64 CA GLN A 64 237.521 273.990 220.504 1.00 0.00 C +ATOM 65 CA PRO A 65 240.711 272.477 219.073 1.00 0.00 C +ATOM 66 CA LYS A 66 241.995 274.922 216.448 1.00 0.00 C +ATOM 67 CA VAL A 67 245.200 276.404 215.016 1.00 0.00 C +ATOM 68 CA GLU A 68 248.929 276.450 215.796 1.00 0.00 C +ATOM 69 CA GLU A 69 249.090 277.102 219.546 1.00 0.00 C +ATOM 70 CA HIS A 70 247.600 274.490 221.886 1.00 0.00 C +ATOM 71 CA ARG A 71 249.853 273.565 224.816 1.00 0.00 C +ATOM 72 CA LYS A 72 252.740 272.272 226.940 1.00 0.00 C +ATOM 73 CA GLU A 73 255.722 274.229 228.278 1.00 0.00 C +ATOM 74 CA GLU A 74 259.419 275.147 228.183 1.00 0.00 C +ATOM 75 CA LYS A 75 261.502 273.676 231.014 1.00 0.00 C +ATOM 76 CA GLU A 76 263.066 273.746 234.487 1.00 0.00 C +ATOM 77 CA GLU A 77 265.459 274.417 237.376 1.00 0.00 C +ATOM 78 CA GLU A 78 267.605 273.373 240.345 1.00 0.00 C +ATOM 79 CA LYS A 79 270.936 275.210 240.561 1.00 0.00 C +ATOM 80 CA LYS A 80 273.395 274.831 237.676 1.00 0.00 C +ATOM 81 CA PRO A 81 275.202 271.504 237.246 1.00 0.00 C +ATOM 82 CA GLY A 82 276.730 268.360 235.731 1.00 0.00 C +ATOM 83 CA PHE A 83 275.106 265.044 236.670 1.00 0.00 C +ATOM 84 CA LEU A 84 272.523 262.385 237.551 1.00 0.00 C +ATOM 85 CA ASP A 85 269.616 263.015 239.932 1.00 0.00 C +ATOM 86 CA LYS A 86 266.388 262.615 241.916 1.00 0.00 C +ATOM 87 CA LEU A 87 266.837 260.128 244.768 1.00 0.00 C +ATOM 88 CA HIS A 88 267.305 260.886 248.472 1.00 0.00 C +ATOM 89 CA ARG A 89 269.268 264.146 248.651 1.00 0.00 C +ATOM 90 CA SER A 90 269.559 267.532 250.375 1.00 0.00 C +ATOM 91 CA THR A 91 269.247 269.511 253.615 1.00 0.00 C +ATOM 92 CA SER A 92 266.305 268.748 255.913 1.00 0.00 C +ATOM 93 CA SER A 93 262.610 268.889 254.995 1.00 0.00 C +ATOM 94 CA SER A 94 261.382 265.727 253.260 1.00 0.00 C +ATOM 95 CA SER A 95 260.070 262.805 251.197 1.00 0.00 C +ATOM 96 CA SER A 96 258.734 260.872 248.197 1.00 0.00 C +ATOM 97 CA SER A 97 259.379 257.657 246.257 1.00 0.00 C +ATOM 98 CA SER A 98 259.941 258.638 242.619 1.00 0.00 C +ATOM 99 CA ASP A 99 260.215 262.243 241.414 1.00 0.00 C +ATOM 100 CA GLU A 100 260.934 262.950 237.741 1.00 0.00 C +ATOM 101 CA GLU A 101 262.938 259.994 236.413 1.00 0.00 C +ATOM 102 CA GLU A 102 265.053 257.333 234.691 1.00 0.00 C +ATOM 103 CA GLY A 103 267.978 256.275 236.891 1.00 0.00 C +ATOM 104 CA ASP A 104 269.330 252.819 237.755 1.00 0.00 C +ATOM 105 CA ASP A 105 270.307 251.009 234.548 1.00 0.00 C +ATOM 106 CA GLU A 106 268.814 247.800 233.136 1.00 0.00 C +ATOM 107 CA GLU A 107 266.005 245.493 234.277 1.00 0.00 C +ATOM 108 CA LYS A 108 267.168 243.032 236.943 1.00 0.00 C +ATOM 109 CA LYS A 109 266.603 242.123 240.600 1.00 0.00 C +ATOM 110 CA LYS A 110 268.784 242.495 243.701 1.00 0.00 C +ATOM 111 CA LYS A 111 270.673 240.108 245.993 1.00 0.00 C +ATOM 112 CA LYS A 112 271.213 236.337 245.948 1.00 0.00 C +ATOM 113 CA LYS A 113 268.206 234.130 246.725 1.00 0.00 C +ATOM 114 CA GLU A 114 264.926 232.196 246.853 1.00 0.00 C +ATOM 115 CA LYS A 115 261.493 233.143 248.208 1.00 0.00 C +ATOM 116 CA LYS A 116 257.944 233.266 249.587 1.00 0.00 C +ATOM 117 CA GLY A 117 254.326 234.133 250.409 1.00 0.00 C +ATOM 118 CA LEU A 118 254.049 236.481 253.396 1.00 0.00 C +ATOM 119 CA LYS A 119 254.113 234.657 256.741 1.00 0.00 C +ATOM 120 CA GLU A 120 254.172 236.868 259.843 1.00 0.00 C +ATOM 121 CA LYS A 121 257.544 236.874 261.617 1.00 0.00 C +ATOM 122 CA LEU A 122 259.376 233.597 262.266 1.00 0.00 C +ATOM 123 CA LYS A 123 260.656 230.197 261.119 1.00 0.00 C +ATOM 124 CA GLU A 124 262.782 227.777 263.154 1.00 0.00 C +ATOM 125 CA LYS A 125 266.214 226.123 263.141 1.00 0.00 C +ATOM 126 CA ILE A 126 268.181 225.653 266.370 1.00 0.00 C +ATOM 127 CA SER A 127 270.758 225.570 269.176 1.00 0.00 C +ATOM 128 CA GLY A 128 274.331 225.699 270.492 1.00 0.00 C +ATOM 129 CA GLU A 129 277.526 227.490 271.540 1.00 0.00 C +ATOM 130 CA LYS A 130 278.020 227.298 275.313 1.00 0.00 C +ATOM 131 CA GLU A 131 276.057 225.859 278.244 1.00 0.00 C +ATOM 132 CA GLU A 132 274.118 224.580 281.264 1.00 0.00 C +ATOM 133 CA ASP A 133 272.701 223.888 284.732 1.00 0.00 C +ATOM 134 CA THR A 134 269.144 224.742 285.797 1.00 0.00 C +ATOM 135 CA THR A 135 266.803 227.709 285.310 1.00 0.00 C +ATOM 136 CA VAL A 136 264.300 230.487 284.582 1.00 0.00 C +ATOM 137 CA PRO A 137 261.454 232.949 283.983 1.00 0.00 C +ATOM 138 CA VAL A 138 259.784 235.369 286.406 1.00 0.00 C +ATOM 139 CA GLU A 139 257.841 238.097 288.223 1.00 0.00 C +ATOM 140 CA LYS A 140 254.451 239.669 287.480 1.00 0.00 C +ATOM 141 CA LEU A 141 250.768 238.715 287.680 1.00 0.00 C +ATOM 142 CA ASP A 142 247.752 236.774 288.964 1.00 0.00 C +ATOM 143 CA ASP A 143 246.553 234.021 286.619 1.00 0.00 C +ATOM 144 CA VAL A 144 247.201 232.328 283.267 1.00 0.00 C +ATOM 145 CA HIS A 145 250.143 233.489 281.144 1.00 0.00 C +ATOM 146 CA ALA A 146 250.760 232.556 277.502 1.00 0.00 C +ATOM 147 CA PRO A 147 251.166 228.769 277.413 1.00 0.00 C +ATOM 148 CA HIS A 148 252.862 227.034 274.476 1.00 0.00 C +ATOM 149 CA HIS A 149 253.117 229.312 271.433 1.00 0.00 C +ATOM 150 CA GLN A 150 254.623 229.869 267.977 1.00 0.00 C +ATOM 151 CA GLU A 151 256.275 226.786 266.467 1.00 0.00 C +ATOM 152 CA GLU A 152 255.205 223.444 267.951 1.00 0.00 C +ATOM 153 CA ALA A 153 252.461 221.451 269.687 1.00 0.00 C +ATOM 154 CA HIS A 154 249.551 218.993 269.801 1.00 0.00 C +ATOM 155 CA PRO A 155 248.830 215.423 270.919 1.00 0.00 C +ATOM 156 CA GLU A 156 249.551 212.935 268.125 1.00 0.00 C +ATOM 157 CA GLU A 157 252.716 210.827 268.342 1.00 0.00 C +ATOM 158 CA LYS A 158 255.825 208.631 268.518 1.00 0.00 C +ATOM 159 CA LYS A 159 256.567 208.011 272.204 1.00 0.00 C +ATOM 160 CA GLY A 160 254.181 205.682 274.047 1.00 0.00 C +ATOM 161 CA PHE A 161 251.761 203.987 271.642 1.00 0.00 C +ATOM 162 CA LEU A 162 249.054 206.236 270.184 1.00 0.00 C +ATOM 163 CA ASN A 163 245.464 204.961 270.168 1.00 0.00 C +ATOM 164 CA LYS A 164 241.816 205.162 269.087 1.00 0.00 C +ATOM 165 CA ILE A 165 239.116 207.461 270.478 1.00 0.00 C +ATOM 166 CA LYS A 166 237.140 209.852 272.691 1.00 0.00 C +ATOM 167 CA GLU A 167 237.057 208.686 276.317 1.00 0.00 C +ATOM 168 CA LYS A 168 237.715 209.275 280.024 1.00 0.00 C +ATOM 169 CA LEU A 169 239.893 207.492 282.592 1.00 0.00 C +ATOM 170 CA PRO A 170 240.989 207.709 286.234 1.00 0.00 C +ATOM 171 CA GLY A 171 241.863 206.487 289.735 1.00 0.00 C +ATOM 172 CA GLN A 172 241.244 203.034 291.222 1.00 0.00 C +ATOM 173 CA GLN A 173 241.522 200.345 293.907 1.00 0.00 C +ATOM 174 CA LYS A 174 240.781 196.614 293.686 1.00 0.00 C +ATOM 175 CA LYS A 175 237.766 195.181 295.523 1.00 0.00 C +ATOM 176 CA PRO A 176 237.635 191.509 296.533 1.00 0.00 C +ATOM 177 CA GLY A 177 240.792 189.523 297.307 1.00 0.00 C +ATOM 178 CA ASP A 178 243.171 191.407 299.611 1.00 0.00 C +ATOM 179 CA HIS A 179 243.623 190.093 303.159 1.00 0.00 C +ATOM 180 CA GLN A 180 245.955 192.472 305.008 1.00 0.00 C +ATOM 181 CA VAL A 181 245.240 194.978 307.787 1.00 0.00 C +ATOM 182 CA PRO A 182 243.952 197.825 309.967 1.00 0.00 C +ATOM 183 CA SER A 183 242.011 200.150 307.655 1.00 0.00 C +ATOM 184 CA PRO A 184 241.970 203.955 307.467 1.00 0.00 C +ATOM 185 CA PRO A 185 242.682 207.543 306.401 1.00 0.00 C +ATOM 186 CA ALA A 186 246.153 207.561 304.829 1.00 0.00 C +ATOM 187 CA ALA A 187 246.600 210.772 302.827 1.00 0.00 C +ATOM 188 CA GLU A 188 249.076 213.106 301.112 1.00 0.00 C +ATOM 189 CA HIS A 189 252.267 214.931 302.110 1.00 0.00 C +ATOM 190 CA PRO A 190 255.050 216.463 300.005 1.00 0.00 C +ATOM 191 CA THR A 191 255.333 220.179 299.213 1.00 0.00 C +ATOM 192 CA SER A 192 256.828 223.179 301.023 1.00 0.00 C +ATOM 193 CA VAL A 193 256.560 226.969 300.734 1.00 0.00 C +ATOM 194 CA GLU A 194 258.921 229.835 301.588 1.00 0.00 C +ATOM 195 CA ALA A 195 262.442 228.418 301.248 1.00 0.00 C +ATOM 196 CA PRO A 196 264.268 228.926 297.943 1.00 0.00 C +ATOM 197 CA GLU A 197 263.436 230.277 294.479 1.00 0.00 C +ATOM 198 CA ALA A 198 263.227 227.470 291.912 1.00 0.00 C +ATOM 199 CA GLU A 199 260.297 225.311 290.787 1.00 0.00 C +ATOM 200 CA ALA A 200 260.179 225.410 286.980 1.00 0.00 C +ATOM 201 CA LYS A 201 259.678 226.149 283.276 1.00 0.00 C +ATOM 202 CA GLU A 202 257.300 227.541 280.645 1.00 0.00 C +ATOM 203 CA LYS A 203 257.084 231.156 279.462 1.00 0.00 C +ATOM 204 CA LYS A 204 257.026 234.815 278.400 1.00 0.00 C +ATOM 205 CA GLY A 205 256.266 236.908 275.309 1.00 0.00 C +ATOM 206 CA ILE A 206 257.574 240.482 275.484 1.00 0.00 C +ATOM 207 CA LEU A 207 259.245 241.043 272.106 1.00 0.00 C +ATOM 208 CA GLU A 208 258.179 242.263 268.657 1.00 0.00 C +ATOM 209 CA LYS A 209 255.652 245.054 269.239 1.00 0.00 C +ATOM 210 CA LEU A 210 254.249 246.763 272.342 1.00 0.00 C +ATOM 211 CA LYS A 211 255.488 249.231 274.967 1.00 0.00 C +ATOM 212 CA GLU A 212 258.133 248.281 277.539 1.00 0.00 C +ATOM 213 CA LYS A 213 259.801 251.168 279.383 1.00 0.00 C +ATOM 214 CA LEU A 214 258.531 253.673 281.957 1.00 0.00 C +ATOM 215 CA PRO A 215 256.320 256.704 281.292 1.00 0.00 C +ATOM 216 CA GLY A 216 257.234 260.302 280.435 1.00 0.00 C +ATOM 217 CA TYR A 217 260.802 261.614 280.182 1.00 0.00 C +ATOM 218 CA HIS A 218 263.485 259.542 281.922 1.00 0.00 C +ATOM 219 CA PRO A 219 267.009 260.787 281.185 1.00 0.00 C +ATOM 220 CA LYS A 220 267.873 259.925 277.576 1.00 0.00 C +ATOM 221 CA SER A 221 269.342 260.307 274.081 1.00 0.00 C +ATOM 222 CA GLU A 222 273.040 259.391 274.085 1.00 0.00 C +ATOM 223 CA ASP A 223 273.205 255.910 272.546 1.00 0.00 C +ATOM 224 CA GLU A 224 274.309 252.688 274.254 1.00 0.00 C +ATOM 225 CA LYS A 225 272.865 249.174 273.967 1.00 0.00 C +ATOM 226 CA ASP A 226 272.127 245.833 272.290 1.00 0.00 C +ATOM 227 CA LYS A 227 269.659 245.046 269.497 1.00 0.00 C +ATOM 228 CA ASP A 228 267.392 242.189 268.394 1.00 0.00 C +ATOM 229 CA LYS A 229 268.409 240.070 265.396 1.00 0.00 C +ATOM 230 CA GLU A 230 267.584 236.504 266.454 1.00 0.00 C +ATOM 231 CA THR A 231 267.203 234.497 269.671 1.00 0.00 C +ATOM 232 CA ALA A 232 264.698 235.762 272.248 1.00 0.00 C +ATOM 233 CA ALA A 233 261.208 234.238 272.350 1.00 0.00 C +ATOM 234 CA HIS A 234 258.906 234.894 269.386 1.00 0.00 C +TER 235 HIS A 234 +END diff --git a/Plants/Q8GV15/Q8GV15.dcd b/Plants/Q8GV15/Q8GV15.dcd new file mode 100644 index 0000000000000000000000000000000000000000..84788f63e91222c1c09933132d3cc204011c6165 --- /dev/null +++ b/Plants/Q8GV15/Q8GV15.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:51b4c7271d83ec18064e15a385abedc859738b4eb6cb67f0dedf187a5def42d4 +size 11240276 diff --git a/Plants/Q8GV15/top.pdb b/Plants/Q8GV15/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..5b34310bc13251fb7df221d95741b758f4f59fe0 --- /dev/null +++ b/Plants/Q8GV15/top.pdb @@ -0,0 +1,91 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 224.989 239.654 225.143 1.00 0.00 C +ATOM 2 CA SER A 2 225.849 242.682 222.996 1.00 0.00 C +ATOM 3 CA GLY A 3 228.173 241.846 220.095 1.00 0.00 C +ATOM 4 CA ILE A 4 230.678 239.678 218.214 1.00 0.00 C +ATOM 5 CA VAL A 5 229.924 235.943 218.206 1.00 0.00 C +ATOM 6 CA HIS A 6 226.612 234.415 219.305 1.00 0.00 C +ATOM 7 CA LYS A 7 226.884 230.628 218.982 1.00 0.00 C +ATOM 8 CA ILE A 8 228.886 228.605 221.515 1.00 0.00 C +ATOM 9 CA GLU A 9 232.299 228.158 219.881 1.00 0.00 C +ATOM 10 CA GLU A 10 235.681 226.601 220.691 1.00 0.00 C +ATOM 11 CA LYS A 11 236.121 224.398 223.768 1.00 0.00 C +ATOM 12 CA LEU A 12 239.800 224.265 224.749 1.00 0.00 C +ATOM 13 CA HIS A 13 241.155 227.818 224.989 1.00 0.00 C +ATOM 14 CA MET A 14 244.846 228.754 224.848 1.00 0.00 C +ATOM 15 CA GLY A 15 247.107 230.488 222.320 1.00 0.00 C +ATOM 16 CA ASP A 16 249.504 233.439 222.065 1.00 0.00 C +ATOM 17 CA HIS A 17 251.631 236.540 222.674 1.00 0.00 C +ATOM 18 CA LYS A 18 254.665 236.793 220.383 1.00 0.00 C +ATOM 19 CA ASP A 19 257.450 239.215 219.436 1.00 0.00 C +ATOM 20 CA ALA A 20 258.279 242.214 221.635 1.00 0.00 C +ATOM 21 CA ASP A 21 259.652 245.420 223.168 1.00 0.00 C +ATOM 22 CA LYS A 22 260.430 245.915 226.865 1.00 0.00 C +ATOM 23 CA LYS A 23 258.701 248.676 228.842 1.00 0.00 C +ATOM 24 CA GLY A 24 256.753 251.088 231.055 1.00 0.00 C +ATOM 25 CA GLU A 25 253.640 252.483 232.752 1.00 0.00 C +ATOM 26 CA GLU A 26 251.719 252.344 236.039 1.00 0.00 C +ATOM 27 CA HIS A 27 252.226 255.262 238.436 1.00 0.00 C +ATOM 28 CA LYS A 28 253.684 258.186 240.395 1.00 0.00 C +ATOM 29 CA GLU A 29 251.816 261.165 241.862 1.00 0.00 C +ATOM 30 CA LYS A 30 250.916 261.729 245.521 1.00 0.00 C +ATOM 31 CA LYS A 31 253.996 263.343 247.080 1.00 0.00 C +ATOM 32 CA LYS A 32 254.902 262.085 250.560 1.00 0.00 C +ATOM 33 CA GLU A 33 257.477 259.826 252.228 1.00 0.00 C +ATOM 34 CA LYS A 34 257.009 256.272 253.519 1.00 0.00 C +ATOM 35 CA GLY A 35 259.442 253.360 253.187 1.00 0.00 C +ATOM 36 CA GLU A 36 260.581 252.990 249.570 1.00 0.00 C +ATOM 37 CA GLY A 37 261.046 250.004 247.249 1.00 0.00 C +ATOM 38 CA HIS A 38 262.176 246.423 246.605 1.00 0.00 C +ATOM 39 CA ARG A 39 261.795 242.840 247.843 1.00 0.00 C +ATOM 40 CA GLU A 40 261.366 241.490 251.380 1.00 0.00 C +ATOM 41 CA LYS A 41 260.162 237.878 251.244 1.00 0.00 C +ATOM 42 CA ILE A 42 256.540 237.728 252.417 1.00 0.00 C +ATOM 43 CA LYS A 43 253.813 239.392 254.493 1.00 0.00 C +ATOM 44 CA GLU A 44 250.358 239.535 252.892 1.00 0.00 C +ATOM 45 CA LYS A 45 247.522 237.000 253.102 1.00 0.00 C +ATOM 46 CA LEU A 46 245.435 234.131 251.711 1.00 0.00 C +ATOM 47 CA HIS A 47 243.362 235.672 248.911 1.00 0.00 C +ATOM 48 CA GLY A 48 241.911 238.370 246.646 1.00 0.00 C +ATOM 49 CA ASP A 49 241.447 242.102 247.255 1.00 0.00 C +ATOM 50 CA ASP A 50 242.994 244.695 249.579 1.00 0.00 C +ATOM 51 CA HIS A 51 244.128 247.923 251.255 1.00 0.00 C +ATOM 52 CA LYS A 52 243.432 251.667 251.388 1.00 0.00 C +ATOM 53 CA ASP A 53 243.988 254.036 254.319 1.00 0.00 C +ATOM 54 CA GLY A 54 241.080 256.331 255.205 1.00 0.00 C +ATOM 55 CA GLU A 55 238.023 257.712 253.397 1.00 0.00 C +ATOM 56 CA GLU A 56 238.397 261.500 253.227 1.00 0.00 C +ATOM 57 CA LYS A 57 237.145 264.557 255.126 1.00 0.00 C +ATOM 58 CA LYS A 58 238.353 266.351 258.262 1.00 0.00 C +ATOM 59 CA LYS A 59 240.608 264.056 260.303 1.00 0.00 C +ATOM 60 CA LYS A 60 241.359 264.562 264.004 1.00 0.00 C +ATOM 61 CA LYS A 61 241.826 264.102 267.757 1.00 0.00 C +ATOM 62 CA LYS A 62 241.146 267.210 269.855 1.00 0.00 C +ATOM 63 CA ASP A 63 243.355 266.998 272.952 1.00 0.00 C +ATOM 64 CA LYS A 64 245.753 264.386 274.346 1.00 0.00 C +ATOM 65 CA LYS A 65 246.774 264.330 278.016 1.00 0.00 C +ATOM 66 CA ASP A 66 246.725 263.171 281.645 1.00 0.00 C +ATOM 67 CA LYS A 67 249.047 261.006 283.751 1.00 0.00 C +ATOM 68 CA LYS A 68 249.536 257.291 284.442 1.00 0.00 C +ATOM 69 CA GLU A 69 251.128 255.372 281.560 1.00 0.00 C +ATOM 70 CA LYS A 70 254.465 255.755 279.762 1.00 0.00 C +ATOM 71 CA LYS A 71 255.535 259.394 279.398 1.00 0.00 C +ATOM 72 CA HIS A 72 258.915 260.176 280.972 1.00 0.00 C +ATOM 73 CA ASP A 73 262.436 260.449 279.541 1.00 0.00 C +ATOM 74 CA ASP A 74 264.224 263.041 277.397 1.00 0.00 C +ATOM 75 CA ASP A 75 261.519 265.587 276.548 1.00 0.00 C +ATOM 76 CA SER A 76 262.401 269.216 275.794 1.00 0.00 C +ATOM 77 CA SER A 77 264.385 270.289 272.723 1.00 0.00 C +ATOM 78 CA SER A 78 266.296 268.152 270.213 1.00 0.00 C +ATOM 79 CA SER A 79 267.155 264.452 270.513 1.00 0.00 C +ATOM 80 CA SER A 80 268.981 261.352 269.262 1.00 0.00 C +ATOM 81 CA SER A 81 269.454 259.395 266.027 1.00 0.00 C +ATOM 82 CA SER A 82 267.848 256.601 263.994 1.00 0.00 C +ATOM 83 CA GLY A 83 266.082 254.362 266.521 1.00 0.00 C +ATOM 84 CA SER A 84 263.707 256.193 268.870 1.00 0.00 C +ATOM 85 CA ASP A 85 260.832 253.947 269.970 1.00 0.00 C +ATOM 86 CA SER A 86 260.682 251.409 272.808 1.00 0.00 C +ATOM 87 CA ASP A 87 259.879 248.131 274.575 1.00 0.00 C +TER 88 ASP A 87 +END diff --git a/Plants/Q8GVP2/Q8GVP2.dcd b/Plants/Q8GVP2/Q8GVP2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..e6effc0b603e1ba0c7553849d9881ec813c82683 --- /dev/null +++ b/Plants/Q8GVP2/Q8GVP2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e060c4e8b1cbf976c655a786f3391bca2ff7dc3e451af42d9d4dee4dcb5f4a70 +size 12920276 diff --git a/Plants/Q8GVP2/top.pdb b/Plants/Q8GVP2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..b9e0c712f7966467ee2d5ba90eeb99e5d73a0e56 --- /dev/null +++ b/Plants/Q8GVP2/top.pdb @@ -0,0 +1,105 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 262.095 254.729 247.274 1.00 0.00 C +ATOM 2 CA PRO A 2 263.967 251.531 246.388 1.00 0.00 C +ATOM 3 CA GLU A 3 264.193 247.769 246.945 1.00 0.00 C +ATOM 4 CA PRO A 4 267.464 246.456 248.392 1.00 0.00 C +ATOM 5 CA LYS A 5 269.517 243.533 247.067 1.00 0.00 C +ATOM 6 CA LEU A 6 269.244 239.817 246.267 1.00 0.00 C +ATOM 7 CA GLU A 7 268.561 239.260 242.561 1.00 0.00 C +ATOM 8 CA SER A 8 264.930 239.981 241.656 1.00 0.00 C +ATOM 9 CA GLU A 9 263.056 236.781 242.532 1.00 0.00 C +ATOM 10 CA THR A 10 263.297 236.300 246.304 1.00 0.00 C +ATOM 11 CA ASN A 11 260.431 237.973 248.174 1.00 0.00 C +ATOM 12 CA THR A 12 257.269 236.494 249.702 1.00 0.00 C +ATOM 13 CA ALA A 13 256.030 238.331 252.802 1.00 0.00 C +ATOM 14 CA SER A 14 254.512 240.484 255.554 1.00 0.00 C +ATOM 15 CA PRO A 15 255.063 243.858 257.237 1.00 0.00 C +ATOM 16 CA ALA A 16 256.298 244.088 260.834 1.00 0.00 C +ATOM 17 CA ARG A 17 253.680 243.008 263.383 1.00 0.00 C +ATOM 18 CA ALA A 18 251.119 243.281 266.191 1.00 0.00 C +ATOM 19 CA PRO A 19 250.208 245.157 269.380 1.00 0.00 C +ATOM 20 CA LEU A 20 249.211 246.010 272.957 1.00 0.00 C +ATOM 21 CA SER A 21 248.266 242.818 274.811 1.00 0.00 C +ATOM 22 CA SER A 22 246.979 241.681 278.212 1.00 0.00 C +ATOM 23 CA LEU A 23 243.235 240.974 278.207 1.00 0.00 C +ATOM 24 CA VAL A 24 240.068 241.483 276.152 1.00 0.00 C +ATOM 25 CA VAL A 25 238.342 238.333 274.881 1.00 0.00 C +ATOM 26 CA LYS A 26 234.807 236.911 274.877 1.00 0.00 C +ATOM 27 CA PRO A 27 232.427 239.736 275.807 1.00 0.00 C +ATOM 28 CA SER A 28 229.596 241.360 273.840 1.00 0.00 C +ATOM 29 CA PRO A 29 226.005 242.479 273.233 1.00 0.00 C +ATOM 30 CA ARG A 30 224.307 245.890 273.234 1.00 0.00 C +ATOM 31 CA LYS A 31 224.825 247.613 269.876 1.00 0.00 C +ATOM 32 CA GLY A 32 227.345 249.882 268.139 1.00 0.00 C +ATOM 33 CA ASN A 33 231.118 250.358 268.382 1.00 0.00 C +ATOM 34 CA ASP A 34 233.640 251.092 265.622 1.00 0.00 C +ATOM 35 CA ALA A 35 235.406 250.975 262.249 1.00 0.00 C +ATOM 36 CA SER A 36 235.038 249.827 258.634 1.00 0.00 C +ATOM 37 CA SER A 37 238.263 248.468 257.128 1.00 0.00 C +ATOM 38 CA SER A 38 239.692 247.914 253.640 1.00 0.00 C +ATOM 39 CA SER A 39 237.486 247.953 250.534 1.00 0.00 C +ATOM 40 CA ASP A 40 237.187 247.674 246.746 1.00 0.00 C +ATOM 41 CA ALA A 41 236.600 250.490 244.247 1.00 0.00 C +ATOM 42 CA ALA A 42 237.254 253.567 242.097 1.00 0.00 C +ATOM 43 CA VAL A 43 236.007 257.139 242.547 1.00 0.00 C +ATOM 44 CA ALA A 44 235.401 260.535 244.163 1.00 0.00 C +ATOM 45 CA ALA A 45 237.383 262.754 246.543 1.00 0.00 C +ATOM 46 CA ALA A 46 239.491 261.093 249.247 1.00 0.00 C +ATOM 47 CA CYS A 47 239.079 259.009 252.410 1.00 0.00 C +ATOM 48 CA SER A 48 241.074 258.996 255.655 1.00 0.00 C +ATOM 49 CA SER A 49 243.190 257.673 258.534 1.00 0.00 C +ATOM 50 CA PRO A 50 246.901 257.386 257.722 1.00 0.00 C +ATOM 51 CA THR A 51 248.378 256.456 254.335 1.00 0.00 C +ATOM 52 CA PRO A 52 247.992 257.619 250.728 1.00 0.00 C +ATOM 53 CA ALA A 53 246.284 256.422 247.539 1.00 0.00 C +ATOM 54 CA THR A 54 248.521 256.640 244.462 1.00 0.00 C +ATOM 55 CA SER A 55 251.322 255.460 242.164 1.00 0.00 C +ATOM 56 CA ALA A 56 254.692 255.468 240.386 1.00 0.00 C +ATOM 57 CA GLU A 57 257.525 257.956 239.835 1.00 0.00 C +ATOM 58 CA ILE A 58 261.222 258.785 239.436 1.00 0.00 C +ATOM 59 CA ASP A 59 264.504 259.999 237.930 1.00 0.00 C +ATOM 60 CA ALA A 60 266.880 262.396 239.698 1.00 0.00 C +ATOM 61 CA ASP A 61 268.835 265.572 238.917 1.00 0.00 C +ATOM 62 CA THR A 62 267.809 269.225 239.257 1.00 0.00 C +ATOM 63 CA VAL A 63 267.331 269.851 242.985 1.00 0.00 C +ATOM 64 CA LEU A 64 268.743 269.430 246.498 1.00 0.00 C +ATOM 65 CA GLN A 65 271.727 267.062 246.460 1.00 0.00 C +ATOM 66 CA GLN A 66 275.004 265.155 246.087 1.00 0.00 C +ATOM 67 CA PRO A 67 276.018 262.695 248.814 1.00 0.00 C +ATOM 68 CA PRO A 68 275.861 261.163 252.299 1.00 0.00 C +ATOM 69 CA PRO A 69 273.291 258.381 252.716 1.00 0.00 C +ATOM 70 CA PRO A 70 273.979 256.024 255.630 1.00 0.00 C +ATOM 71 CA SER A 71 271.754 255.652 258.700 1.00 0.00 C +ATOM 72 CA PRO A 72 268.534 253.798 259.542 1.00 0.00 C +ATOM 73 CA THR A 73 267.196 250.289 258.903 1.00 0.00 C +ATOM 74 CA CYS A 74 263.399 250.479 259.151 1.00 0.00 C +ATOM 75 CA ALA A 75 260.437 250.149 261.525 1.00 0.00 C +ATOM 76 CA PRO A 76 257.310 250.078 259.350 1.00 0.00 C +ATOM 77 CA LEU A 77 254.087 251.081 257.584 1.00 0.00 C +ATOM 78 CA ILE A 78 253.312 251.162 253.854 1.00 0.00 C +ATOM 79 CA ASN A 79 253.820 249.039 250.732 1.00 0.00 C +ATOM 80 CA SER A 80 252.861 249.290 247.053 1.00 0.00 C +ATOM 81 CA LEU A 81 250.223 249.855 244.362 1.00 0.00 C +ATOM 82 CA ILE A 82 247.396 250.392 241.865 1.00 0.00 C +ATOM 83 CA VAL A 83 243.665 250.166 242.605 1.00 0.00 C +ATOM 84 CA LYS A 84 241.786 247.225 241.078 1.00 0.00 C +ATOM 85 CA PRO A 85 241.461 246.400 237.373 1.00 0.00 C +ATOM 86 CA SER A 86 240.609 242.777 236.559 1.00 0.00 C +ATOM 87 CA PRO A 87 241.752 239.160 236.919 1.00 0.00 C +ATOM 88 CA ARG A 88 243.144 235.626 236.624 1.00 0.00 C +ATOM 89 CA GLU A 89 246.874 236.084 236.002 1.00 0.00 C +ATOM 90 CA GLY A 90 248.362 239.582 236.264 1.00 0.00 C +ATOM 91 CA ASN A 91 248.904 241.934 233.317 1.00 0.00 C +ATOM 92 CA ASN A 92 245.548 242.876 231.778 1.00 0.00 C +ATOM 93 CA ALA A 93 245.572 245.219 228.774 1.00 0.00 C +ATOM 94 CA SER A 94 243.605 244.694 225.553 1.00 0.00 C +ATOM 95 CA SER A 95 240.730 245.629 223.235 1.00 0.00 C +ATOM 96 CA SER A 96 237.239 246.931 222.436 1.00 0.00 C +ATOM 97 CA LEU A 97 237.190 250.723 222.076 1.00 0.00 C +ATOM 98 CA SER A 98 234.232 252.434 223.761 1.00 0.00 C +ATOM 99 CA LEU A 99 233.099 255.048 226.290 1.00 0.00 C +ATOM 100 CA THR A 100 235.846 257.590 227.005 1.00 0.00 C +ATOM 101 CA LEU A 101 237.575 259.973 224.587 1.00 0.00 C +TER 102 LEU A 101 +END diff --git a/Plants/Q8GVQ4/Q8GVQ4.dcd b/Plants/Q8GVQ4/Q8GVQ4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..e39bc78c253d0dc67e57fb49df9f92b285e1d457 --- /dev/null +++ b/Plants/Q8GVQ4/Q8GVQ4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:cfc9e81cd197b16de8b32305a3af70e870b4eb89912d32ed743f629944b95b54 +size 12920276 diff --git a/Plants/Q8GVQ4/top.pdb b/Plants/Q8GVQ4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..1f25cbf5959e1ba81c3b1c4ee1cf7162e84fbfd1 --- /dev/null +++ b/Plants/Q8GVQ4/top.pdb @@ -0,0 +1,105 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 303.678 231.576 272.827 1.00 0.00 C +ATOM 2 CA GLY A 2 305.296 232.962 275.986 1.00 0.00 C +ATOM 3 CA THR A 3 302.876 234.777 278.302 1.00 0.00 C +ATOM 4 CA GLU A 4 299.545 235.225 280.096 1.00 0.00 C +ATOM 5 CA GLU A 5 296.961 237.251 278.164 1.00 0.00 C +ATOM 6 CA LEU A 6 295.431 240.047 280.251 1.00 0.00 C +ATOM 7 CA VAL A 7 295.827 243.481 278.647 1.00 0.00 C +ATOM 8 CA GLY A 8 296.181 243.621 274.856 1.00 0.00 C +ATOM 9 CA ALA A 9 295.873 244.022 271.080 1.00 0.00 C +ATOM 10 CA SER A 10 297.676 241.091 269.446 1.00 0.00 C +ATOM 11 CA GLY A 11 295.575 239.552 266.665 1.00 0.00 C +ATOM 12 CA GLY A 12 297.234 236.820 264.590 1.00 0.00 C +ATOM 13 CA ASP A 13 298.351 233.178 264.567 1.00 0.00 C +ATOM 14 CA ALA A 14 296.423 230.001 265.404 1.00 0.00 C +ATOM 15 CA GLU A 15 293.661 229.684 268.009 1.00 0.00 C +ATOM 16 CA ALA A 16 293.323 232.054 270.972 1.00 0.00 C +ATOM 17 CA GLY A 17 292.449 235.723 270.428 1.00 0.00 C +ATOM 18 CA ALA A 18 288.991 237.261 270.872 1.00 0.00 C +ATOM 19 CA ASP A 19 285.322 237.370 269.852 1.00 0.00 C +ATOM 20 CA GLU A 20 282.814 240.147 269.132 1.00 0.00 C +ATOM 21 CA GLN A 21 283.804 241.550 265.731 1.00 0.00 C +ATOM 22 CA ARG A 22 282.818 244.329 263.318 1.00 0.00 C +ATOM 23 CA ARG A 23 280.552 242.957 260.580 1.00 0.00 C +ATOM 24 CA PRO A 24 278.278 242.996 257.523 1.00 0.00 C +ATOM 25 CA VAL A 25 276.048 245.593 255.851 1.00 0.00 C +ATOM 26 CA ALA A 26 275.130 249.288 255.685 1.00 0.00 C +ATOM 27 CA GLU A 27 271.437 249.844 254.934 1.00 0.00 C +ATOM 28 CA ALA A 28 269.842 253.302 255.063 1.00 0.00 C +ATOM 29 CA ARG A 29 271.445 256.561 253.913 1.00 0.00 C +ATOM 30 CA ARG A 30 273.290 258.323 251.083 1.00 0.00 C +ATOM 31 CA ALA A 31 276.329 256.230 250.135 1.00 0.00 C +ATOM 32 CA ALA A 32 277.427 253.791 247.421 1.00 0.00 C +ATOM 33 CA THR A 33 276.428 252.777 243.887 1.00 0.00 C +ATOM 34 CA GLY A 34 277.209 255.806 241.712 1.00 0.00 C +ATOM 35 CA PRO A 35 274.472 256.592 239.182 1.00 0.00 C +ATOM 36 CA GLY A 36 271.197 257.819 237.671 1.00 0.00 C +ATOM 37 CA GLY A 37 268.331 258.916 239.929 1.00 0.00 C +ATOM 38 CA ASP A 38 264.673 258.412 238.991 1.00 0.00 C +ATOM 39 CA GLU A 39 262.247 260.870 237.383 1.00 0.00 C +ATOM 40 CA ALA A 40 258.713 260.888 238.806 1.00 0.00 C +ATOM 41 CA ARG A 41 255.815 261.642 236.449 1.00 0.00 C +ATOM 42 CA THR A 42 252.573 259.645 236.584 1.00 0.00 C +ATOM 43 CA SER A 43 249.638 257.486 235.472 1.00 0.00 C +ATOM 44 CA ASN A 44 250.245 254.129 237.169 1.00 0.00 C +ATOM 45 CA GLY A 45 249.806 252.155 240.399 1.00 0.00 C +ATOM 46 CA GLY A 46 246.958 249.796 241.316 1.00 0.00 C +ATOM 47 CA GLN A 47 244.780 247.539 239.154 1.00 0.00 C +ATOM 48 CA SER A 48 244.596 244.793 236.519 1.00 0.00 C +ATOM 49 CA ARG A 49 247.004 245.212 233.596 1.00 0.00 C +ATOM 50 CA THR A 50 246.643 242.796 230.673 1.00 0.00 C +ATOM 51 CA ARG A 51 246.001 239.756 228.468 1.00 0.00 C +ATOM 52 CA ARG A 52 246.266 236.009 227.828 1.00 0.00 C +ATOM 53 CA ARG A 53 247.316 232.574 229.098 1.00 0.00 C +ATOM 54 CA PRO A 54 248.549 231.153 232.411 1.00 0.00 C +ATOM 55 CA VAL A 55 246.052 231.104 235.289 1.00 0.00 C +ATOM 56 CA ALA A 56 243.105 233.446 235.874 1.00 0.00 C +ATOM 57 CA GLU A 57 242.676 233.701 239.651 1.00 0.00 C +ATOM 58 CA ALA A 58 242.127 234.110 243.399 1.00 0.00 C +ATOM 59 CA ASN A 59 241.451 236.513 246.278 1.00 0.00 C +ATOM 60 CA ALA A 60 241.110 240.308 246.244 1.00 0.00 C +ATOM 61 CA ASP A 61 241.185 244.115 246.133 1.00 0.00 C +ATOM 62 CA GLU A 62 243.158 247.277 245.341 1.00 0.00 C +ATOM 63 CA ARG A 63 241.552 250.732 245.335 1.00 0.00 C +ATOM 64 CA ARG A 64 240.085 254.114 246.297 1.00 0.00 C +ATOM 65 CA SER A 65 238.253 257.366 245.532 1.00 0.00 C +ATOM 66 CA GLY A 66 235.977 260.420 245.426 1.00 0.00 C +ATOM 67 CA ALA A 67 234.560 261.892 248.642 1.00 0.00 C +ATOM 68 CA GLU A 68 236.499 261.183 251.845 1.00 0.00 C +ATOM 69 CA ARG A 69 237.725 261.969 255.365 1.00 0.00 C +ATOM 70 CA GLU A 70 238.206 265.748 255.444 1.00 0.00 C +ATOM 71 CA ALA A 71 235.914 268.285 253.762 1.00 0.00 C +ATOM 72 CA VAL A 72 233.515 269.948 256.211 1.00 0.00 C +ATOM 73 CA GLY A 73 230.890 268.796 258.720 1.00 0.00 C +ATOM 74 CA ALA A 74 227.750 267.577 260.502 1.00 0.00 C +ATOM 75 CA ASP A 75 224.580 269.033 262.033 1.00 0.00 C +ATOM 76 CA ASP A 76 220.799 269.372 262.359 1.00 0.00 C +ATOM 77 CA GLU A 77 218.299 269.041 259.503 1.00 0.00 C +ATOM 78 CA ARG A 78 219.270 268.141 255.931 1.00 0.00 C +ATOM 79 CA ARG A 79 217.957 268.168 252.354 1.00 0.00 C +ATOM 80 CA ARG A 80 214.517 269.110 251.016 1.00 0.00 C +ATOM 81 CA SER A 81 212.427 269.276 247.835 1.00 0.00 C +ATOM 82 CA VAL A 82 208.916 270.583 247.144 1.00 0.00 C +ATOM 83 CA ALA A 83 205.616 269.702 245.455 1.00 0.00 C +ATOM 84 CA GLU A 84 205.294 266.673 243.166 1.00 0.00 C +ATOM 85 CA ALA A 85 204.926 262.901 242.773 1.00 0.00 C +ATOM 86 CA VAL A 86 205.983 260.424 245.467 1.00 0.00 C +ATOM 87 CA ALA A 87 207.633 256.990 245.464 1.00 0.00 C +ATOM 88 CA ASP A 88 211.097 256.097 244.153 1.00 0.00 C +ATOM 89 CA GLU A 89 211.209 252.720 242.391 1.00 0.00 C +ATOM 90 CA MET A 90 210.609 253.422 238.694 1.00 0.00 C +ATOM 91 CA THR A 91 209.979 255.097 235.331 1.00 0.00 C +ATOM 92 CA ALA A 92 206.563 256.781 235.432 1.00 0.00 C +ATOM 93 CA GLY A 93 203.429 254.765 234.643 1.00 0.00 C +ATOM 94 CA ARG A 94 201.392 253.527 231.671 1.00 0.00 C +ATOM 95 CA GLY A 95 198.572 251.052 232.334 1.00 0.00 C +ATOM 96 CA GLY A 96 199.753 247.730 233.778 1.00 0.00 C +ATOM 97 CA GLY A 97 197.193 246.187 236.140 1.00 0.00 C +ATOM 98 CA GLY A 98 199.055 243.892 238.544 1.00 0.00 C +ATOM 99 CA ARG A 99 200.039 240.661 236.781 1.00 0.00 C +ATOM 100 CA ARG A 100 200.231 236.999 237.816 1.00 0.00 C +ATOM 101 CA GLY A 101 203.521 235.679 236.418 1.00 0.00 C +TER 102 GLY A 101 +END diff --git a/Plants/Q8GVR5/Q8GVR5.dcd b/Plants/Q8GVR5/Q8GVR5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..2d8df9a205e2fc55cbeb7cb8cf59b543813af0be --- /dev/null +++ b/Plants/Q8GVR5/Q8GVR5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:51c71dd0fb1038c1952eecdd31d90a68d713b0295abc7020cc5de2fa6da307c6 +size 22040276 diff --git a/Plants/Q8GVR5/top.pdb b/Plants/Q8GVR5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a8dd94417f9a043326d8ac2f76f69724c51211e3 --- /dev/null +++ b/Plants/Q8GVR5/top.pdb @@ -0,0 +1,181 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 263.810 212.082 266.020 1.00 0.00 C +ATOM 2 CA THR A 2 267.217 210.587 265.201 1.00 0.00 C +ATOM 3 CA ILE A 3 269.366 210.834 268.338 1.00 0.00 C +ATOM 4 CA SER A 4 272.975 211.196 267.174 1.00 0.00 C +ATOM 5 CA SER A 5 274.872 214.500 267.201 1.00 0.00 C +ATOM 6 CA ASN A 6 274.877 218.147 266.097 1.00 0.00 C +ATOM 7 CA ILE A 7 274.161 221.754 265.102 1.00 0.00 C +ATOM 8 CA VAL A 8 273.805 225.424 266.062 1.00 0.00 C +ATOM 9 CA LYS A 9 272.418 227.824 268.676 1.00 0.00 C +ATOM 10 CA LYS A 10 271.923 231.374 267.383 1.00 0.00 C +ATOM 11 CA TYR A 11 272.595 232.271 263.742 1.00 0.00 C +ATOM 12 CA GLN A 12 274.637 234.667 261.595 1.00 0.00 C +ATOM 13 CA HIS A 13 278.214 235.354 260.477 1.00 0.00 C +ATOM 14 CA SER A 14 278.078 238.669 258.604 1.00 0.00 C +ATOM 15 CA HIS A 15 276.837 242.159 257.713 1.00 0.00 C +ATOM 16 CA ALA A 16 277.263 244.794 254.994 1.00 0.00 C +ATOM 17 CA ALA A 17 277.899 247.735 252.657 1.00 0.00 C +ATOM 18 CA ALA A 18 279.858 249.101 249.688 1.00 0.00 C +ATOM 19 CA ALA A 19 279.537 252.520 248.037 1.00 0.00 C +ATOM 20 CA ASP A 20 279.578 255.703 245.943 1.00 0.00 C +ATOM 21 CA GLU A 21 278.795 256.389 242.279 1.00 0.00 C +ATOM 22 CA GLY A 22 276.830 259.525 241.370 1.00 0.00 C +ATOM 23 CA LYS A 23 275.216 259.353 237.923 1.00 0.00 C +ATOM 24 CA GLY A 24 272.161 261.217 236.615 1.00 0.00 C +ATOM 25 CA ARG A 25 270.925 264.378 238.346 1.00 0.00 C +ATOM 26 CA ARG A 26 269.109 267.622 237.513 1.00 0.00 C +ATOM 27 CA GLY A 27 270.537 271.134 237.132 1.00 0.00 C +ATOM 28 CA GLU A 28 267.613 273.497 236.516 1.00 0.00 C +ATOM 29 CA GLY A 29 264.706 272.769 238.868 1.00 0.00 C +ATOM 30 CA GLU A 30 263.063 272.236 242.264 1.00 0.00 C +ATOM 31 CA LYS A 31 265.587 271.884 245.097 1.00 0.00 C +ATOM 32 CA GLU A 32 267.440 272.399 248.385 1.00 0.00 C +ATOM 33 CA GLY A 33 266.831 272.399 252.146 1.00 0.00 C +ATOM 34 CA PRO A 34 265.191 272.500 255.584 1.00 0.00 C +ATOM 35 CA ARG A 35 263.696 274.237 258.628 1.00 0.00 C +ATOM 36 CA ARG A 36 261.319 276.896 257.287 1.00 0.00 C +ATOM 37 CA LEU A 37 262.687 277.894 253.874 1.00 0.00 C +ATOM 38 CA ARG A 38 261.441 276.899 250.413 1.00 0.00 C +ATOM 39 CA TRP A 39 260.942 273.283 249.320 1.00 0.00 C +ATOM 40 CA PRO A 40 258.248 270.617 249.703 1.00 0.00 C +ATOM 41 CA PRO A 41 258.045 267.627 252.057 1.00 0.00 C +ATOM 42 CA PRO A 42 257.260 265.852 255.335 1.00 0.00 C +ATOM 43 CA PRO A 43 257.460 262.553 257.231 1.00 0.00 C +ATOM 44 CA SER A 44 254.817 259.821 256.970 1.00 0.00 C +ATOM 45 CA PRO A 45 251.852 261.115 258.983 1.00 0.00 C +ATOM 46 CA PRO A 46 248.564 259.196 259.131 1.00 0.00 C +ATOM 47 CA LEU A 47 247.390 257.609 255.872 1.00 0.00 C +ATOM 48 CA GLY A 48 249.999 254.970 255.007 1.00 0.00 C +ATOM 49 CA ARG A 49 248.761 251.507 254.010 1.00 0.00 C +ATOM 50 CA ALA A 50 247.896 248.171 255.633 1.00 0.00 C +ATOM 51 CA VAL A 51 245.109 245.573 255.617 1.00 0.00 C +ATOM 52 CA ALA A 52 243.125 242.331 255.876 1.00 0.00 C +ATOM 53 CA GLY A 53 241.809 238.767 256.167 1.00 0.00 C +ATOM 54 CA PRO A 54 238.582 238.330 254.190 1.00 0.00 C +ATOM 55 CA GLY A 55 237.382 241.448 252.359 1.00 0.00 C +ATOM 56 CA PRO A 56 236.351 241.636 248.696 1.00 0.00 C +ATOM 57 CA THR A 57 235.172 243.969 245.924 1.00 0.00 C +ATOM 58 CA LEU A 58 233.698 245.567 242.795 1.00 0.00 C +ATOM 59 CA LEU A 59 236.003 247.540 240.491 1.00 0.00 C +ATOM 60 CA PRO A 60 236.225 247.798 236.696 1.00 0.00 C +ATOM 61 CA PRO A 61 235.741 244.733 234.485 1.00 0.00 C +ATOM 62 CA ALA A 62 231.969 244.501 234.002 1.00 0.00 C +ATOM 63 CA ASP A 63 228.558 244.037 235.636 1.00 0.00 C +ATOM 64 CA GLY A 64 225.671 246.263 236.744 1.00 0.00 C +ATOM 65 CA ASP A 65 221.864 246.179 236.618 1.00 0.00 C +ATOM 66 CA VAL A 66 218.347 247.569 237.078 1.00 0.00 C +ATOM 67 CA ASP A 67 215.207 245.742 235.932 1.00 0.00 C +ATOM 68 CA PRO A 68 214.733 243.059 233.269 1.00 0.00 C +ATOM 69 CA GLU A 69 214.073 239.954 231.163 1.00 0.00 C +ATOM 70 CA THR A 70 211.812 239.552 228.123 1.00 0.00 C +ATOM 71 CA GLY A 71 208.098 240.402 228.196 1.00 0.00 C +ATOM 72 CA GLY A 72 205.495 243.161 228.549 1.00 0.00 C +ATOM 73 CA LYS A 73 202.490 244.771 226.848 1.00 0.00 C +ATOM 74 CA GLY A 74 199.342 243.936 228.826 1.00 0.00 C +ATOM 75 CA GLY A 75 198.646 246.419 231.631 1.00 0.00 C +ATOM 76 CA HIS A 76 195.479 248.529 231.460 1.00 0.00 C +ATOM 77 CA ARG A 77 196.468 252.169 231.995 1.00 0.00 C +ATOM 78 CA LEU A 78 199.261 253.274 229.651 1.00 0.00 C +ATOM 79 CA LEU A 79 202.691 251.859 228.786 1.00 0.00 C +ATOM 80 CA PRO A 80 205.835 250.323 230.294 1.00 0.00 C +ATOM 81 CA GLN A 81 208.382 252.180 232.433 1.00 0.00 C +ATOM 82 CA PRO A 82 211.272 249.816 233.191 1.00 0.00 C +ATOM 83 CA THR A 83 214.086 251.845 234.767 1.00 0.00 C +ATOM 84 CA ARG A 84 213.989 255.279 233.119 1.00 0.00 C +ATOM 85 CA GLY A 85 216.406 256.577 230.476 1.00 0.00 C +ATOM 86 CA ARG A 86 219.548 255.484 228.620 1.00 0.00 C +ATOM 87 CA GLY A 87 220.222 255.198 224.881 1.00 0.00 C +ATOM 88 CA GLY A 88 219.643 258.430 222.949 1.00 0.00 C +ATOM 89 CA GLY A 89 222.146 260.967 221.600 1.00 0.00 C +ATOM 90 CA GLY A 90 223.450 260.929 218.021 1.00 0.00 C +ATOM 91 CA GLY A 91 225.696 263.748 216.788 1.00 0.00 C +ATOM 92 CA GLU A 92 227.007 267.324 216.672 1.00 0.00 C +ATOM 93 CA GLY A 93 227.893 268.852 220.048 1.00 0.00 C +ATOM 94 CA MET A 94 227.055 267.851 223.627 1.00 0.00 C +ATOM 95 CA GLY A 95 228.655 270.042 226.302 1.00 0.00 C +ATOM 96 CA ARG A 96 231.171 269.917 229.160 1.00 0.00 C +ATOM 97 CA ARG A 97 232.854 267.476 231.552 1.00 0.00 C +ATOM 98 CA ARG A 98 234.418 265.448 234.373 1.00 0.00 C +ATOM 99 CA SER A 99 235.529 263.177 237.224 1.00 0.00 C +ATOM 100 CA PRO A 100 237.415 260.342 235.515 1.00 0.00 C +ATOM 101 CA ALA A 101 241.183 259.801 235.670 1.00 0.00 C +ATOM 102 CA ALA A 102 243.873 262.169 234.376 1.00 0.00 C +ATOM 103 CA LEU A 103 246.692 261.476 231.908 1.00 0.00 C +ATOM 104 CA PRO A 104 249.141 259.229 233.770 1.00 0.00 C +ATOM 105 CA ALA A 105 252.024 257.444 235.507 1.00 0.00 C +ATOM 106 CA ALA A 106 253.426 256.401 238.893 1.00 0.00 C +ATOM 107 CA ALA A 107 253.119 256.771 242.672 1.00 0.00 C +ATOM 108 CA PRO A 108 250.407 257.545 245.234 1.00 0.00 C +ATOM 109 CA LEU A 109 248.189 260.475 244.231 1.00 0.00 C +ATOM 110 CA PRO A 110 249.157 263.766 245.888 1.00 0.00 C +ATOM 111 CA PRO A 111 251.213 266.279 243.894 1.00 0.00 C +ATOM 112 CA THR A 112 254.764 264.907 243.745 1.00 0.00 C +ATOM 113 CA GLY A 113 256.977 265.568 240.715 1.00 0.00 C +ATOM 114 CA LEU A 114 260.187 263.518 240.596 1.00 0.00 C +ATOM 115 CA PRO A 115 263.012 261.117 241.471 1.00 0.00 C +ATOM 116 CA LEU A 116 263.746 258.308 243.939 1.00 0.00 C +ATOM 117 CA PRO A 117 262.616 259.100 247.490 1.00 0.00 C +ATOM 118 CA LEU A 118 261.232 257.303 250.552 1.00 0.00 C +ATOM 119 CA PRO A 119 261.460 253.557 249.893 1.00 0.00 C +ATOM 120 CA PRO A 120 264.278 252.300 252.127 1.00 0.00 C +ATOM 121 CA GLN A 121 267.433 254.079 253.311 1.00 0.00 C +ATOM 122 CA PRO A 122 269.966 256.039 255.375 1.00 0.00 C +ATOM 123 CA GLN A 123 273.522 255.692 256.697 1.00 0.00 C +ATOM 124 CA LEU A 124 274.627 258.520 258.999 1.00 0.00 C +ATOM 125 CA ALA A 125 271.812 260.409 260.738 1.00 0.00 C +ATOM 126 CA PRO A 126 269.158 262.935 261.783 1.00 0.00 C +ATOM 127 CA ARG A 127 267.159 261.437 264.660 1.00 0.00 C +ATOM 128 CA LEU A 128 266.972 262.434 268.333 1.00 0.00 C +ATOM 129 CA LEU A 129 269.036 262.570 271.532 1.00 0.00 C +ATOM 130 CA LEU A 130 269.654 259.742 274.009 1.00 0.00 C +ATOM 131 CA LEU A 131 268.571 256.134 273.435 1.00 0.00 C +ATOM 132 CA VAL A 132 265.007 254.852 273.843 1.00 0.00 C +ATOM 133 CA ALA A 133 262.891 251.757 273.165 1.00 0.00 C +ATOM 134 CA PRO A 134 265.090 248.646 273.185 1.00 0.00 C +ATOM 135 CA SER A 135 266.729 247.012 270.159 1.00 0.00 C +ATOM 136 CA LEU A 136 266.159 246.199 266.480 1.00 0.00 C +ATOM 137 CA THR A 137 265.046 246.556 262.854 1.00 0.00 C +ATOM 138 CA GLU A 138 266.104 246.025 259.232 1.00 0.00 C +ATOM 139 CA GLY A 139 264.184 244.466 256.334 1.00 0.00 C +ATOM 140 CA ARG A 140 260.956 242.491 255.895 1.00 0.00 C +ATOM 141 CA GLY A 141 259.616 241.308 259.259 1.00 0.00 C +ATOM 142 CA GLY A 142 258.972 240.900 262.992 1.00 0.00 C +ATOM 143 CA GLY A 143 257.229 238.706 265.574 1.00 0.00 C +ATOM 144 CA GLY A 144 259.715 236.104 266.824 1.00 0.00 C +ATOM 145 CA GLY A 145 258.981 232.378 267.138 1.00 0.00 C +ATOM 146 CA GLY A 146 260.841 229.670 265.210 1.00 0.00 C +ATOM 147 CA GLY A 147 261.804 225.994 265.488 1.00 0.00 C +ATOM 148 CA GLU A 148 261.895 222.804 267.570 1.00 0.00 C +ATOM 149 CA ARG A 149 258.664 220.825 267.969 1.00 0.00 C +ATOM 150 CA LYS A 150 257.233 217.386 267.171 1.00 0.00 C +ATOM 151 CA GLU A 151 253.642 217.685 265.931 1.00 0.00 C +ATOM 152 CA GLU A 152 250.475 219.665 265.181 1.00 0.00 C +ATOM 153 CA ARG A 153 249.537 221.720 268.249 1.00 0.00 C +ATOM 154 CA GLY A 154 249.404 225.105 269.992 1.00 0.00 C +ATOM 155 CA GLY A 155 246.065 226.939 270.013 1.00 0.00 C +ATOM 156 CA GLU A 156 245.846 230.285 271.822 1.00 0.00 C +ATOM 157 CA GLU A 157 247.182 233.792 272.480 1.00 0.00 C +ATOM 158 CA GLU A 158 246.774 237.535 273.064 1.00 0.00 C +ATOM 159 CA GLU A 159 247.352 241.155 274.102 1.00 0.00 C +ATOM 160 CA GLU A 160 249.582 243.635 275.942 1.00 0.00 C +ATOM 161 CA LYS A 161 250.855 246.263 273.495 1.00 0.00 C +ATOM 162 CA GLU A 162 250.862 247.271 269.821 1.00 0.00 C +ATOM 163 CA GLY A 163 251.038 251.070 269.584 1.00 0.00 C +ATOM 164 CA GLU A 164 252.800 254.199 268.311 1.00 0.00 C +ATOM 165 CA GLY A 165 252.431 254.830 264.572 1.00 0.00 C +ATOM 166 CA LYS A 166 255.621 256.139 262.950 1.00 0.00 C +ATOM 167 CA ARG A 167 257.928 253.759 261.071 1.00 0.00 C +ATOM 168 CA HIS A 168 256.235 250.818 259.340 1.00 0.00 C +ATOM 169 CA VAL A 169 256.298 250.778 255.531 1.00 0.00 C +ATOM 170 CA SER A 170 254.284 248.074 253.757 1.00 0.00 C +ATOM 171 CA ARG A 171 255.062 246.392 250.428 1.00 0.00 C +ATOM 172 CA GLU A 172 252.926 246.393 247.273 1.00 0.00 C +ATOM 173 CA ARG A 173 250.232 243.997 246.043 1.00 0.00 C +ATOM 174 CA ARG A 174 249.074 240.799 247.761 1.00 0.00 C +ATOM 175 CA ARG A 175 246.840 239.545 250.580 1.00 0.00 C +ATOM 176 CA ARG A 176 246.899 236.126 252.262 1.00 0.00 C +ATOM 177 CA ARG A 177 246.658 232.407 253.051 1.00 0.00 C +TER 178 ARG A 177 +END diff --git a/Plants/Q8GVZ9/Q8GVZ9.dcd b/Plants/Q8GVZ9/Q8GVZ9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..42ed210ea8ab63351f841804112154f99fefe668 --- /dev/null +++ b/Plants/Q8GVZ9/Q8GVZ9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:28ddab1472b8db297ef1514c7ad0e2a65bca6ddcbf5ad12a16248afdefc53ffc +size 19760276 diff --git a/Plants/Q8GVZ9/top.pdb b/Plants/Q8GVZ9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..4139744a6e84839faaabdce49bf3e73b13517a2f --- /dev/null +++ b/Plants/Q8GVZ9/top.pdb @@ -0,0 +1,162 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 306.580 229.663 283.091 1.00 0.00 C +ATOM 2 CA THR A 2 303.189 231.116 282.139 1.00 0.00 C +ATOM 3 CA PRO A 3 300.920 234.103 282.805 1.00 0.00 C +ATOM 4 CA ALA A 4 298.887 237.177 283.772 1.00 0.00 C +ATOM 5 CA GLY A 5 297.517 240.731 283.682 1.00 0.00 C +ATOM 6 CA GLY A 6 298.429 242.193 280.284 1.00 0.00 C +ATOM 7 CA LYS A 7 300.072 239.565 278.068 1.00 0.00 C +ATOM 8 CA ARG A 8 298.238 238.716 274.838 1.00 0.00 C +ATOM 9 CA GLU A 9 298.666 237.217 271.362 1.00 0.00 C +ATOM 10 CA LYS A 10 301.118 239.116 269.149 1.00 0.00 C +ATOM 11 CA GLY A 11 300.520 242.872 268.935 1.00 0.00 C +ATOM 12 CA GLY A 12 298.400 245.384 267.008 1.00 0.00 C +ATOM 13 CA GLU A 13 298.517 249.177 266.666 1.00 0.00 C +ATOM 14 CA LYS A 14 298.047 250.554 270.187 1.00 0.00 C +ATOM 15 CA GLY A 15 294.700 252.152 271.060 1.00 0.00 C +ATOM 16 CA GLY A 16 291.362 252.440 269.245 1.00 0.00 C +ATOM 17 CA LEU A 17 287.845 252.494 267.781 1.00 0.00 C +ATOM 18 CA PRO A 18 284.284 251.220 268.239 1.00 0.00 C +ATOM 19 CA LEU A 19 281.084 251.852 266.271 1.00 0.00 C +ATOM 20 CA ALA A 20 278.364 254.382 267.117 1.00 0.00 C +ATOM 21 CA THR A 21 275.171 253.162 268.800 1.00 0.00 C +ATOM 22 CA LEU A 22 274.582 249.964 270.786 1.00 0.00 C +ATOM 23 CA GLY A 23 276.523 246.686 270.837 1.00 0.00 C +ATOM 24 CA LYS A 24 279.710 244.717 271.534 1.00 0.00 C +ATOM 25 CA GLY A 25 283.120 243.357 270.515 1.00 0.00 C +ATOM 26 CA GLY A 26 286.460 241.564 270.886 1.00 0.00 C +ATOM 27 CA ARG A 27 290.134 240.596 271.184 1.00 0.00 C +ATOM 28 CA ARG A 28 290.535 237.258 269.392 1.00 0.00 C +ATOM 29 CA GLU A 29 293.252 235.382 267.491 1.00 0.00 C +ATOM 30 CA GLY A 30 295.869 232.974 266.123 1.00 0.00 C +ATOM 31 CA ASP A 31 296.344 231.853 262.513 1.00 0.00 C +ATOM 32 CA ALA A 32 298.977 229.825 260.650 1.00 0.00 C +ATOM 33 CA GLY A 33 302.503 229.613 259.223 1.00 0.00 C +ATOM 34 CA GLU A 34 303.669 228.316 255.835 1.00 0.00 C +ATOM 35 CA GLY A 35 302.760 224.808 254.660 1.00 0.00 C +ATOM 36 CA GLY A 36 302.564 224.258 250.895 1.00 0.00 C +ATOM 37 CA GLY A 37 303.080 220.667 249.732 1.00 0.00 C +ATOM 38 CA ALA A 38 305.374 220.965 246.705 1.00 0.00 C +ATOM 39 CA GLN A 39 306.964 221.138 243.247 1.00 0.00 C +ATOM 40 CA PRO A 40 305.359 222.247 239.975 1.00 0.00 C +ATOM 41 CA PRO A 41 303.860 225.425 238.501 1.00 0.00 C +ATOM 42 CA SER A 42 300.559 225.304 236.603 1.00 0.00 C +ATOM 43 CA LEU A 43 298.597 222.264 235.411 1.00 0.00 C +ATOM 44 CA GLY A 44 297.638 218.880 236.875 1.00 0.00 C +ATOM 45 CA GLY A 45 295.052 216.177 236.150 1.00 0.00 C +ATOM 46 CA THR A 46 291.304 216.846 236.009 1.00 0.00 C +ATOM 47 CA ARG A 47 288.413 219.145 235.074 1.00 0.00 C +ATOM 48 CA GLY A 48 285.104 220.963 234.560 1.00 0.00 C +ATOM 49 CA GLU A 49 282.008 219.634 236.337 1.00 0.00 C +ATOM 50 CA ARG A 50 281.567 217.985 239.744 1.00 0.00 C +ATOM 51 CA ARG A 51 281.999 214.779 241.756 1.00 0.00 C +ATOM 52 CA GLY A 52 285.305 213.725 243.331 1.00 0.00 C +ATOM 53 CA ARG A 53 285.204 214.222 247.107 1.00 0.00 C +ATOM 54 CA VAL A 54 283.562 213.860 250.526 1.00 0.00 C +ATOM 55 CA ASP A 55 280.247 212.806 252.081 1.00 0.00 C +ATOM 56 CA ASP A 56 277.888 214.677 254.416 1.00 0.00 C +ATOM 57 CA ASN A 57 275.941 217.007 256.717 1.00 0.00 C +ATOM 58 CA GLY A 58 273.066 217.786 259.092 1.00 0.00 C +ATOM 59 CA ASP A 59 270.703 220.645 258.220 1.00 0.00 C +ATOM 60 CA ASP A 60 267.199 222.135 258.351 1.00 0.00 C +ATOM 61 CA GLY A 61 266.060 223.069 261.864 1.00 0.00 C +ATOM 62 CA GLY A 62 264.797 225.943 264.023 1.00 0.00 C +ATOM 63 CA PRO A 63 262.159 227.065 266.532 1.00 0.00 C +ATOM 64 CA VAL A 64 262.402 229.710 269.264 1.00 0.00 C +ATOM 65 CA TRP A 65 263.531 233.236 268.365 1.00 0.00 C +ATOM 66 CA SER A 66 265.409 236.547 268.191 1.00 0.00 C +ATOM 67 CA GLY A 67 267.671 239.504 268.998 1.00 0.00 C +ATOM 68 CA ALA A 68 270.285 240.843 266.570 1.00 0.00 C +ATOM 69 CA ALA A 69 273.192 243.166 265.753 1.00 0.00 C +ATOM 70 CA THR A 70 275.104 241.993 262.674 1.00 0.00 C +ATOM 71 CA ARG A 71 274.111 242.876 259.103 1.00 0.00 C +ATOM 72 CA ALA A 72 273.504 246.626 258.813 1.00 0.00 C +ATOM 73 CA VAL A 73 272.040 249.768 257.231 1.00 0.00 C +ATOM 74 CA ASP A 74 269.772 252.566 255.989 1.00 0.00 C +ATOM 75 CA ALA A 75 269.833 252.401 252.183 1.00 0.00 C +ATOM 76 CA GLY A 76 272.151 255.167 250.960 1.00 0.00 C +ATOM 77 CA GLN A 77 269.851 258.073 250.077 1.00 0.00 C +ATOM 78 CA ALA A 78 266.048 257.990 249.861 1.00 0.00 C +ATOM 79 CA ARG A 79 262.996 259.498 251.571 1.00 0.00 C +ATOM 80 CA GLN A 80 259.726 258.058 250.249 1.00 0.00 C +ATOM 81 CA ALA A 81 257.114 260.717 251.039 1.00 0.00 C +ATOM 82 CA LEU A 82 253.379 260.395 251.719 1.00 0.00 C +ATOM 83 CA THR A 83 250.169 259.340 253.479 1.00 0.00 C +ATOM 84 CA ALA A 84 246.575 258.382 254.306 1.00 0.00 C +ATOM 85 CA ALA A 85 244.438 258.909 251.196 1.00 0.00 C +ATOM 86 CA ALA A 86 241.145 260.718 250.565 1.00 0.00 C +ATOM 87 CA THR A 87 239.289 262.857 253.114 1.00 0.00 C +ATOM 88 CA GLY A 88 238.077 266.251 251.879 1.00 0.00 C +ATOM 89 CA ARG A 89 237.984 269.440 253.961 1.00 0.00 C +ATOM 90 CA SER A 90 239.404 271.228 257.011 1.00 0.00 C +ATOM 91 CA ALA A 91 238.726 272.206 260.630 1.00 0.00 C +ATOM 92 CA THR A 92 235.417 273.776 261.680 1.00 0.00 C +ATOM 93 CA THR A 93 235.363 277.521 262.378 1.00 0.00 C +ATOM 94 CA ALA A 94 232.534 280.022 262.886 1.00 0.00 C +ATOM 95 CA ARG A 95 231.322 283.144 264.702 1.00 0.00 C +ATOM 96 CA ALA A 96 228.185 284.204 266.586 1.00 0.00 C +ATOM 97 CA ARG A 97 224.654 285.420 265.829 1.00 0.00 C +ATOM 98 CA ALA A 98 221.217 285.112 264.213 1.00 0.00 C +ATOM 99 CA GLY A 99 219.369 288.388 263.608 1.00 0.00 C +ATOM 100 CA GLY A 100 217.878 288.405 260.102 1.00 0.00 C +ATOM 101 CA ALA A 101 214.927 290.562 259.026 1.00 0.00 C +ATOM 102 CA ALA A 102 212.618 293.310 257.748 1.00 0.00 C +ATOM 103 CA ILE A 103 209.855 291.427 255.923 1.00 0.00 C +ATOM 104 CA TRP A 104 208.193 288.664 253.893 1.00 0.00 C +ATOM 105 CA ALA A 105 208.360 285.754 251.439 1.00 0.00 C +ATOM 106 CA ALA A 106 208.443 287.074 247.866 1.00 0.00 C +ATOM 107 CA SER A 107 207.830 284.126 245.531 1.00 0.00 C +ATOM 108 CA ALA A 108 208.397 280.772 243.816 1.00 0.00 C +ATOM 109 CA GLY A 109 206.625 277.763 245.340 1.00 0.00 C +ATOM 110 CA LYS A 110 203.024 276.996 244.358 1.00 0.00 C +ATOM 111 CA ALA A 111 201.339 279.975 242.684 1.00 0.00 C +ATOM 112 CA ALA A 112 197.848 281.209 243.579 1.00 0.00 C +ATOM 113 CA ARG A 113 194.095 280.781 244.077 1.00 0.00 C +ATOM 114 CA ALA A 114 190.876 279.244 245.418 1.00 0.00 C +ATOM 115 CA GLY A 115 191.692 277.404 248.653 1.00 0.00 C +ATOM 116 CA GLY A 116 192.864 275.305 251.608 1.00 0.00 C +ATOM 117 CA ARG A 117 194.486 272.841 254.020 1.00 0.00 C +ATOM 118 CA ALA A 118 197.787 271.824 252.413 1.00 0.00 C +ATOM 119 CA ARG A 119 199.606 273.296 249.406 1.00 0.00 C +ATOM 120 CA ARG A 120 197.243 273.013 246.431 1.00 0.00 C +ATOM 121 CA GLY A 121 195.382 271.524 243.458 1.00 0.00 C +ATOM 122 CA SER A 122 196.780 272.660 240.101 1.00 0.00 C +ATOM 123 CA ARG A 123 196.299 270.536 236.975 1.00 0.00 C +ATOM 124 CA GLN A 124 197.661 267.898 234.586 1.00 0.00 C +ATOM 125 CA SER A 125 198.420 264.541 232.953 1.00 0.00 C +ATOM 126 CA GLY A 126 195.576 262.242 231.883 1.00 0.00 C +ATOM 127 CA GLU A 127 196.315 259.139 229.799 1.00 0.00 C +ATOM 128 CA ARG A 128 195.883 255.942 231.826 1.00 0.00 C +ATOM 129 CA GLU A 129 198.491 253.912 233.722 1.00 0.00 C +ATOM 130 CA ARG A 130 202.157 253.251 232.920 1.00 0.00 C +ATOM 131 CA GLU A 131 205.411 253.628 234.864 1.00 0.00 C +ATOM 132 CA LYS A 132 205.745 257.222 236.084 1.00 0.00 C +ATOM 133 CA GLU A 133 206.632 257.838 239.737 1.00 0.00 C +ATOM 134 CA ARG A 134 208.048 255.962 242.736 1.00 0.00 C +ATOM 135 CA GLU A 135 210.159 253.013 241.568 1.00 0.00 C +ATOM 136 CA ARG A 136 213.170 250.679 241.485 1.00 0.00 C +ATOM 137 CA GLU A 137 216.617 250.947 239.884 1.00 0.00 C +ATOM 138 CA GLN A 138 216.247 251.936 236.223 1.00 0.00 C +ATOM 139 CA GLY A 139 213.812 253.633 233.834 1.00 0.00 C +ATOM 140 CA ARG A 140 213.854 253.487 230.027 1.00 0.00 C +ATOM 141 CA GLU A 141 216.285 253.563 227.094 1.00 0.00 C +ATOM 142 CA GLY A 142 215.529 251.811 223.797 1.00 0.00 C +ATOM 143 CA GLU A 143 214.478 250.131 220.542 1.00 0.00 C +ATOM 144 CA MET A 144 214.890 251.349 216.956 1.00 0.00 C +ATOM 145 CA GLY A 145 215.435 254.492 214.873 1.00 0.00 C +ATOM 146 CA ARG A 146 212.486 255.822 212.859 1.00 0.00 C +ATOM 147 CA GLU A 147 211.707 257.402 209.481 1.00 0.00 C +ATOM 148 CA GLY A 148 209.015 255.980 207.189 1.00 0.00 C +ATOM 149 CA PHE A 149 209.388 252.894 204.986 1.00 0.00 C +ATOM 150 CA GLY A 150 208.836 249.421 203.519 1.00 0.00 C +ATOM 151 CA PRO A 151 206.791 246.918 205.535 1.00 0.00 C +ATOM 152 CA SER A 152 204.175 244.842 207.369 1.00 0.00 C +ATOM 153 CA ASN A 153 203.642 241.575 209.256 1.00 0.00 C +ATOM 154 CA SER A 154 205.688 241.120 212.437 1.00 0.00 C +ATOM 155 CA MET A 155 206.058 238.904 215.514 1.00 0.00 C +ATOM 156 CA GLU A 156 208.110 240.136 218.478 1.00 0.00 C +ATOM 157 CA ALA A 157 210.046 243.091 219.906 1.00 0.00 C +ATOM 158 CA LYS A 158 210.889 242.945 223.618 1.00 0.00 C +TER 159 LYS A 158 +END diff --git a/Plants/Q8GWM3/Q8GWM3.dcd b/Plants/Q8GWM3/Q8GWM3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..b791fcc4c9f5a5b31d4617aba2607e866ed99b3d --- /dev/null +++ b/Plants/Q8GWM3/Q8GWM3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:97b70baee209d91ff2730e7daa97b150bb4c23b6320a5ea12455cd7b7574fd17 +size 10520276 diff --git a/Plants/Q8GWM3/top.pdb b/Plants/Q8GWM3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a00f4bfa54e6547aaca6c72dd4adaeb6c8624783 --- /dev/null +++ b/Plants/Q8GWM3/top.pdb @@ -0,0 +1,85 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 208.995 268.865 244.343 1.00 0.00 C +ATOM 2 CA ALA A 2 211.951 266.856 245.662 1.00 0.00 C +ATOM 3 CA PRO A 3 213.923 264.864 248.242 1.00 0.00 C +ATOM 4 CA GLU A 4 216.230 264.121 251.182 1.00 0.00 C +ATOM 5 CA GLU A 5 214.778 262.433 254.274 1.00 0.00 C +ATOM 6 CA GLU A 6 215.388 258.704 253.783 1.00 0.00 C +ATOM 7 CA LYS A 7 214.413 255.982 251.303 1.00 0.00 C +ATOM 8 CA LEU A 8 214.039 252.406 252.563 1.00 0.00 C +ATOM 9 CA THR A 9 217.047 250.288 253.554 1.00 0.00 C +ATOM 10 CA ARG A 10 219.997 247.943 252.993 1.00 0.00 C +ATOM 11 CA ARG A 11 220.518 245.343 255.729 1.00 0.00 C +ATOM 12 CA ASN A 12 223.410 243.769 257.646 1.00 0.00 C +ATOM 13 CA PRO A 13 224.472 240.822 255.479 1.00 0.00 C +ATOM 14 CA LEU A 14 225.795 241.302 251.938 1.00 0.00 C +ATOM 15 CA ASP A 15 223.581 242.615 249.129 1.00 0.00 C +ATOM 16 CA PHE A 16 223.689 242.751 245.322 1.00 0.00 C +ATOM 17 CA PRO A 17 227.173 242.963 243.795 1.00 0.00 C +ATOM 18 CA ILE A 18 228.124 239.751 241.980 1.00 0.00 C +ATOM 19 CA GLU A 19 230.743 238.621 239.454 1.00 0.00 C +ATOM 20 CA TRP A 20 233.812 240.528 238.247 1.00 0.00 C +ATOM 21 CA GLU A 21 235.407 243.456 240.091 1.00 0.00 C +ATOM 22 CA ARG A 22 237.790 242.381 242.862 1.00 0.00 C +ATOM 23 CA PRO A 23 240.201 242.236 245.809 1.00 0.00 C +ATOM 24 CA LYS A 24 240.552 239.840 248.751 1.00 0.00 C +ATOM 25 CA PRO A 25 240.277 241.520 252.159 1.00 0.00 C +ATOM 26 CA GLY A 26 239.845 244.744 254.143 1.00 0.00 C +ATOM 27 CA ARG A 27 243.043 246.727 253.553 1.00 0.00 C +ATOM 28 CA ARG A 28 244.886 246.495 250.227 1.00 0.00 C +ATOM 29 CA PRO A 29 246.309 243.238 248.855 1.00 0.00 C +ATOM 30 CA ASP A 30 247.232 239.865 250.368 1.00 0.00 C +ATOM 31 CA ILE A 31 246.186 238.805 253.875 1.00 0.00 C +ATOM 32 CA PHE A 32 245.384 240.949 256.921 1.00 0.00 C +ATOM 33 CA PRO A 33 247.381 243.383 259.067 1.00 0.00 C +ATOM 34 CA LYS A 34 250.443 244.217 261.175 1.00 0.00 C +ATOM 35 CA PHE A 35 253.858 245.804 260.597 1.00 0.00 C +ATOM 36 CA SER A 36 256.030 247.672 258.086 1.00 0.00 C +ATOM 37 CA PRO A 37 257.851 247.061 254.795 1.00 0.00 C +ATOM 38 CA MET A 38 260.859 246.836 252.468 1.00 0.00 C +ATOM 39 CA LYS A 39 263.882 245.825 250.380 1.00 0.00 C +ATOM 40 CA SER A 40 267.327 247.264 251.140 1.00 0.00 C +ATOM 41 CA PRO A 41 268.125 250.959 250.666 1.00 0.00 C +ATOM 42 CA LEU A 42 270.516 251.965 253.456 1.00 0.00 C +ATOM 43 CA PRO A 43 272.906 249.175 254.468 1.00 0.00 C +ATOM 44 CA PRO A 44 273.269 245.476 253.632 1.00 0.00 C +ATOM 45 CA PRO A 45 272.671 243.220 250.620 1.00 0.00 C +ATOM 46 CA MET A 46 273.861 240.048 248.878 1.00 0.00 C +ATOM 47 CA PRO A 47 277.284 239.625 247.260 1.00 0.00 C +ATOM 48 CA TYR A 48 278.819 236.558 245.599 1.00 0.00 C +ATOM 49 CA ASP A 49 281.778 237.066 243.254 1.00 0.00 C +ATOM 50 CA PRO A 50 282.079 237.164 239.457 1.00 0.00 C +ATOM 51 CA PRO A 51 280.799 238.901 236.317 1.00 0.00 C +ATOM 52 CA GLU A 52 278.490 241.931 236.332 1.00 0.00 C +ATOM 53 CA GLU A 53 275.608 243.158 234.163 1.00 0.00 C +ATOM 54 CA GLU A 54 272.707 245.523 234.875 1.00 0.00 C +ATOM 55 CA GLU A 55 271.540 247.028 238.175 1.00 0.00 C +ATOM 56 CA GLU A 56 269.038 248.098 240.842 1.00 0.00 C +ATOM 57 CA GLU A 57 267.609 250.376 243.541 1.00 0.00 C +ATOM 58 CA GLU A 58 264.977 253.130 243.579 1.00 0.00 C +ATOM 59 CA GLU A 59 261.653 253.073 241.717 1.00 0.00 C +ATOM 60 CA LYS A 60 258.319 254.758 242.466 1.00 0.00 C +ATOM 61 CA LYS A 61 257.808 258.513 242.073 1.00 0.00 C +ATOM 62 CA GLU A 62 257.049 261.371 244.476 1.00 0.00 C +ATOM 63 CA GLU A 63 255.560 263.645 247.145 1.00 0.00 C +ATOM 64 CA GLU A 64 255.443 262.235 250.683 1.00 0.00 C +ATOM 65 CA THR A 65 256.740 259.100 252.415 1.00 0.00 C +ATOM 66 CA GLU A 66 260.416 258.262 251.864 1.00 0.00 C +ATOM 67 CA ASP A 67 263.111 255.766 252.874 1.00 0.00 C +ATOM 68 CA ASP A 68 266.254 257.698 253.824 1.00 0.00 C +ATOM 69 CA PRO A 69 267.697 257.842 257.348 1.00 0.00 C +ATOM 70 CA GLU A 70 266.768 260.609 259.796 1.00 0.00 C +ATOM 71 CA LYS A 71 265.313 264.109 260.186 1.00 0.00 C +ATOM 72 CA GLU A 72 261.563 264.742 259.967 1.00 0.00 C +ATOM 73 CA ASP A 73 258.544 266.885 259.068 1.00 0.00 C +ATOM 74 CA GLU A 74 256.065 265.074 256.812 1.00 0.00 C +ATOM 75 CA ASP A 75 252.546 263.781 256.133 1.00 0.00 C +ATOM 76 CA GLN A 76 250.470 260.658 256.806 1.00 0.00 C +ATOM 77 CA PRO A 77 252.804 258.208 258.557 1.00 0.00 C +ATOM 78 CA ASP A 78 255.841 255.911 258.449 1.00 0.00 C +ATOM 79 CA ASN A 79 257.700 253.590 256.066 1.00 0.00 C +ATOM 80 CA ARG A 80 255.266 252.892 253.219 1.00 0.00 C +ATOM 81 CA SER A 81 252.175 252.634 251.007 1.00 0.00 C +TER 82 SER A 81 +END diff --git a/Plants/Q8GWS9/Q8GWS9.dcd b/Plants/Q8GWS9/Q8GWS9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..788caa27188fef7bc9fabe54e944abd62eb34c55 --- /dev/null +++ b/Plants/Q8GWS9/Q8GWS9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:84386562013a71cf8547c1ecaecf7fbd05ec1ad90af0187a3ec60d5292926f9c +size 10640276 diff --git a/Plants/Q8GWS9/top.pdb b/Plants/Q8GWS9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..72863cdb6f404cea26afc9f8e0ffc7996829f114 --- /dev/null +++ b/Plants/Q8GWS9/top.pdb @@ -0,0 +1,86 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 258.252 233.872 256.522 1.00 0.00 C +ATOM 2 CA PRO A 2 254.908 235.520 257.309 1.00 0.00 C +ATOM 3 CA ARG A 3 255.731 239.196 257.875 1.00 0.00 C +ATOM 4 CA VAL A 4 258.536 239.710 260.402 1.00 0.00 C +ATOM 5 CA VAL A 5 258.494 242.969 262.375 1.00 0.00 C +ATOM 6 CA SER A 6 257.856 244.205 265.922 1.00 0.00 C +ATOM 7 CA THR A 7 256.076 247.240 267.384 1.00 0.00 C +ATOM 8 CA LYS A 8 258.534 249.471 269.253 1.00 0.00 C +ATOM 9 CA ASN A 9 259.183 250.330 272.908 1.00 0.00 C +ATOM 10 CA GLY A 10 260.388 253.889 273.539 1.00 0.00 C +ATOM 11 CA LEU A 11 263.454 255.437 271.891 1.00 0.00 C +ATOM 12 CA GLY A 12 263.467 257.007 268.419 1.00 0.00 C +ATOM 13 CA VAL A 13 261.721 257.279 265.044 1.00 0.00 C +ATOM 14 CA LYS A 14 257.988 257.519 264.319 1.00 0.00 C +ATOM 15 CA ASP A 15 254.815 255.578 265.144 1.00 0.00 C +ATOM 16 CA ARG A 16 251.782 255.688 262.842 1.00 0.00 C +ATOM 17 CA PRO A 17 252.595 253.517 259.818 1.00 0.00 C +ATOM 18 CA GLN A 18 253.467 250.043 261.117 1.00 0.00 C +ATOM 19 CA PHE A 19 252.583 246.821 259.285 1.00 0.00 C +ATOM 20 CA LYS A 20 250.281 244.362 257.505 1.00 0.00 C +ATOM 21 CA ARG A 21 249.165 245.000 253.919 1.00 0.00 C +ATOM 22 CA ASN A 22 246.372 245.516 251.380 1.00 0.00 C +ATOM 23 CA ARG A 23 243.107 244.702 253.166 1.00 0.00 C +ATOM 24 CA ALA A 24 242.370 241.117 254.225 1.00 0.00 C +ATOM 25 CA LYS A 25 238.624 240.690 254.776 1.00 0.00 C +ATOM 26 CA GLY A 26 237.398 237.285 253.586 1.00 0.00 C +ATOM 27 CA PRO A 27 235.608 233.980 254.211 1.00 0.00 C +ATOM 28 CA ASN A 28 232.939 232.219 256.282 1.00 0.00 C +ATOM 29 CA PRO A 29 232.000 230.134 259.330 1.00 0.00 C +ATOM 30 CA LEU A 30 230.242 226.810 259.943 1.00 0.00 C +ATOM 31 CA SER A 31 229.548 225.247 256.538 1.00 0.00 C +ATOM 32 CA CYS A 32 228.392 222.433 254.244 1.00 0.00 C +ATOM 33 CA MET A 33 229.690 221.925 250.698 1.00 0.00 C +ATOM 34 CA LYS A 34 227.131 223.625 248.445 1.00 0.00 C +ATOM 35 CA LYS A 35 228.971 226.052 246.155 1.00 0.00 C +ATOM 36 CA LYS A 36 231.919 228.326 246.961 1.00 0.00 C +ATOM 37 CA LYS A 37 233.775 229.835 243.995 1.00 0.00 C +ATOM 38 CA GLU A 38 235.474 232.683 242.120 1.00 0.00 C +ATOM 39 CA ASN A 39 234.799 236.020 240.410 1.00 0.00 C +ATOM 40 CA PRO A 40 236.659 236.515 237.122 1.00 0.00 C +ATOM 41 CA GLN A 41 238.743 236.095 233.961 1.00 0.00 C +ATOM 42 CA SER A 42 238.909 237.789 230.552 1.00 0.00 C +ATOM 43 CA LYS A 43 238.207 240.560 228.033 1.00 0.00 C +ATOM 44 CA SER A 44 234.663 241.887 228.469 1.00 0.00 C +ATOM 45 CA LYS A 45 231.849 243.734 230.255 1.00 0.00 C +ATOM 46 CA ALA A 46 230.583 246.845 232.053 1.00 0.00 C +ATOM 47 CA ASP A 47 230.663 250.141 233.962 1.00 0.00 C +ATOM 48 CA SER A 48 230.391 253.856 233.163 1.00 0.00 C +ATOM 49 CA ASN A 49 233.729 255.620 232.650 1.00 0.00 C +ATOM 50 CA SER A 50 237.042 256.172 234.449 1.00 0.00 C +ATOM 51 CA ASN A 51 236.757 259.572 236.146 1.00 0.00 C +ATOM 52 CA ALA A 52 236.946 260.306 239.880 1.00 0.00 C +ATOM 53 CA GLN A 53 234.489 260.683 242.767 1.00 0.00 C +ATOM 54 CA LYS A 54 232.828 257.370 243.653 1.00 0.00 C +ATOM 55 CA GLU A 55 231.968 256.171 247.166 1.00 0.00 C +ATOM 56 CA LYS A 56 233.727 252.896 247.999 1.00 0.00 C +ATOM 57 CA LYS A 57 237.091 252.404 246.278 1.00 0.00 C +ATOM 58 CA GLU A 58 239.502 254.596 244.305 1.00 0.00 C +ATOM 59 CA GLY A 59 241.905 257.044 242.645 1.00 0.00 C +ATOM 60 CA GLY A 60 245.374 258.581 242.990 1.00 0.00 C +ATOM 61 CA SER A 61 244.848 262.348 242.767 1.00 0.00 C +ATOM 62 CA ASP A 62 245.840 265.286 244.980 1.00 0.00 C +ATOM 63 CA THR A 63 249.070 265.611 246.974 1.00 0.00 C +ATOM 64 CA GLN A 64 251.081 265.012 250.154 1.00 0.00 C +ATOM 65 CA LYS A 65 253.733 266.859 252.173 1.00 0.00 C +ATOM 66 CA ARG A 66 256.860 266.820 249.996 1.00 0.00 C +ATOM 67 CA SER A 67 259.421 264.141 250.878 1.00 0.00 C +ATOM 68 CA ARG A 68 262.715 263.625 249.035 1.00 0.00 C +ATOM 69 CA LYS A 69 265.222 266.066 247.527 1.00 0.00 C +ATOM 70 CA ARG A 70 267.720 268.936 247.314 1.00 0.00 C +ATOM 71 CA SER A 71 269.262 272.018 248.938 1.00 0.00 C +ATOM 72 CA LYS A 72 273.035 271.487 248.933 1.00 0.00 C +ATOM 73 CA LYS A 73 274.754 268.437 247.431 1.00 0.00 C +ATOM 74 CA GLY A 74 274.133 266.599 244.152 1.00 0.00 C +ATOM 75 CA LYS A 75 276.221 263.425 243.866 1.00 0.00 C +ATOM 76 CA SER A 76 279.767 263.263 245.250 1.00 0.00 C +ATOM 77 CA GLY A 77 283.502 263.144 244.505 1.00 0.00 C +ATOM 78 CA PRO A 78 285.757 262.631 247.533 1.00 0.00 C +ATOM 79 CA GLU A 79 287.700 261.700 250.676 1.00 0.00 C +ATOM 80 CA ARG A 80 291.038 262.174 252.449 1.00 0.00 C +ATOM 81 CA THR A 81 293.460 263.831 250.019 1.00 0.00 C +ATOM 82 CA GLU A 82 295.202 264.498 246.697 1.00 0.00 C +TER 83 GLU A 82 +END diff --git a/Plants/Q8GWV7/Q8GWV7.dcd b/Plants/Q8GWV7/Q8GWV7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..28bddba09dc39ee45a832fefe0d7e6161394a7a0 --- /dev/null +++ b/Plants/Q8GWV7/Q8GWV7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:15970512e9eb56d2991eb2234437fcb4d0f0464bae5c6df7b61886f88bc4d717 +size 8120276 diff --git a/Plants/Q8GWV7/top.pdb b/Plants/Q8GWV7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..da8e3b950e9abeba5a6bae645b4ffc31de294953 --- /dev/null +++ b/Plants/Q8GWV7/top.pdb @@ -0,0 +1,65 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 271.162 250.112 218.430 1.00 0.00 C +ATOM 2 CA PRO A 2 273.272 247.066 217.542 1.00 0.00 C +ATOM 3 CA PHE A 3 275.835 244.404 218.467 1.00 0.00 C +ATOM 4 CA ILE A 4 279.207 243.734 220.110 1.00 0.00 C +ATOM 5 CA SER A 5 280.700 245.517 223.127 1.00 0.00 C +ATOM 6 CA GLN A 6 280.157 246.514 226.764 1.00 0.00 C +ATOM 7 CA ASN A 7 280.073 250.298 227.196 1.00 0.00 C +ATOM 8 CA VAL A 8 276.542 251.463 228.030 1.00 0.00 C +ATOM 9 CA ALA A 9 273.353 251.340 225.949 1.00 0.00 C +ATOM 10 CA SER A 10 270.636 253.139 227.924 1.00 0.00 C +ATOM 11 CA SER A 11 267.651 250.778 228.101 1.00 0.00 C +ATOM 12 CA SER A 12 264.378 250.216 226.233 1.00 0.00 C +ATOM 13 CA SER A 13 262.848 246.847 225.325 1.00 0.00 C +ATOM 14 CA GLY A 14 264.984 245.000 222.767 1.00 0.00 C +ATOM 15 CA GLU A 15 268.506 245.508 221.407 1.00 0.00 C +ATOM 16 CA ALA A 16 271.560 245.537 223.685 1.00 0.00 C +ATOM 17 CA ALA A 17 274.293 244.491 226.125 1.00 0.00 C +ATOM 18 CA THR A 18 274.521 244.700 229.922 1.00 0.00 C +ATOM 19 CA GLY A 19 271.264 244.048 231.789 1.00 0.00 C +ATOM 20 CA ARG A 20 268.503 243.382 234.328 1.00 0.00 C +ATOM 21 CA GLY A 21 267.365 241.350 237.344 1.00 0.00 C +ATOM 22 CA SER A 22 267.955 242.922 240.764 1.00 0.00 C +ATOM 23 CA ASN A 23 264.941 245.196 241.281 1.00 0.00 C +ATOM 24 CA SER A 24 264.412 246.955 244.619 1.00 0.00 C +ATOM 25 CA ARG A 25 265.211 246.689 248.334 1.00 0.00 C +ATOM 26 CA GLN A 26 263.015 248.839 250.586 1.00 0.00 C +ATOM 27 CA ALA A 27 259.846 249.502 252.595 1.00 0.00 C +ATOM 28 CA SER A 28 258.706 249.862 256.213 1.00 0.00 C +ATOM 29 CA SER A 29 255.014 248.926 256.126 1.00 0.00 C +ATOM 30 CA ARG A 30 252.319 250.868 254.259 1.00 0.00 C +ATOM 31 CA GLU A 31 248.742 249.723 253.619 1.00 0.00 C +ATOM 32 CA ALA A 32 245.659 249.083 255.763 1.00 0.00 C +ATOM 33 CA GLU A 33 245.028 245.353 256.214 1.00 0.00 C +ATOM 34 CA GLU A 34 243.533 244.183 259.518 1.00 0.00 C +ATOM 35 CA GLU A 35 243.518 240.614 260.851 1.00 0.00 C +ATOM 36 CA GLU A 36 240.396 240.248 263.005 1.00 0.00 C +ATOM 37 CA GLY A 37 237.012 239.870 261.296 1.00 0.00 C +ATOM 38 CA THR A 38 234.516 242.538 262.375 1.00 0.00 C +ATOM 39 CA GLU A 39 230.721 242.870 262.399 1.00 0.00 C +ATOM 40 CA ARG A 40 227.836 243.967 264.633 1.00 0.00 C +ATOM 41 CA GLY A 41 224.860 245.212 262.605 1.00 0.00 C +ATOM 42 CA ASN A 42 222.921 247.956 260.808 1.00 0.00 C +ATOM 43 CA SER A 43 221.700 251.258 259.354 1.00 0.00 C +ATOM 44 CA THR A 44 221.245 255.024 259.719 1.00 0.00 C +ATOM 45 CA ARG A 45 223.083 257.441 262.020 1.00 0.00 C +ATOM 46 CA ARG A 46 226.480 259.076 261.471 1.00 0.00 C +ATOM 47 CA PRO A 47 230.135 259.570 262.426 1.00 0.00 C +ATOM 48 CA GLU A 48 232.197 262.707 263.079 1.00 0.00 C +ATOM 49 CA PRO A 49 230.703 265.738 264.838 1.00 0.00 C +ATOM 50 CA PRO A 50 227.264 266.168 266.421 1.00 0.00 C +ATOM 51 CA SER A 51 224.369 264.828 268.504 1.00 0.00 C +ATOM 52 CA PRO A 52 221.994 265.476 271.412 1.00 0.00 C +ATOM 53 CA PRO A 53 222.922 263.838 274.725 1.00 0.00 C +ATOM 54 CA GLU A 54 226.628 263.325 275.445 1.00 0.00 C +ATOM 55 CA SER A 55 227.125 261.190 278.561 1.00 0.00 C +ATOM 56 CA LYS A 56 230.192 258.941 278.783 1.00 0.00 C +ATOM 57 CA ARG A 57 232.059 255.704 278.041 1.00 0.00 C +ATOM 58 CA GLN A 58 231.717 251.952 278.610 1.00 0.00 C +ATOM 59 CA ARG A 59 234.859 249.958 277.790 1.00 0.00 C +ATOM 60 CA ARG A 60 235.361 247.205 280.374 1.00 0.00 C +ATOM 61 CA GLU A 61 236.997 243.785 279.995 1.00 0.00 C +TER 62 GLU A 61 +END diff --git a/Plants/Q8GXU7/Q8GXU7.dcd b/Plants/Q8GXU7/Q8GXU7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..11f6b1d6e738213187a21759d1425e5dd1761636 --- /dev/null +++ b/Plants/Q8GXU7/Q8GXU7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:858b6a0bdb961e055f3aa893040d9420890fbfc361a368af78c3220b6793af1e +size 9320276 diff --git a/Plants/Q8GXU7/top.pdb b/Plants/Q8GXU7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..be623ae47c4dafb1acf704a8e7222d020e41631b --- /dev/null +++ b/Plants/Q8GXU7/top.pdb @@ -0,0 +1,75 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 221.923 272.285 226.741 1.00 0.00 C +ATOM 2 CA THR A 2 223.030 269.477 224.416 1.00 0.00 C +ATOM 3 CA ARG A 3 224.320 265.898 224.222 1.00 0.00 C +ATOM 4 CA GLY A 4 222.271 263.062 222.713 1.00 0.00 C +ATOM 5 CA SER A 5 224.564 260.878 220.594 1.00 0.00 C +ATOM 6 CA GLN A 6 225.111 258.148 217.994 1.00 0.00 C +ATOM 7 CA ARG A 7 228.404 256.246 218.228 1.00 0.00 C +ATOM 8 CA GLU A 8 232.098 255.367 218.540 1.00 0.00 C +ATOM 9 CA ARG A 9 235.621 255.398 217.089 1.00 0.00 C +ATOM 10 CA ASP A 10 238.128 258.261 217.253 1.00 0.00 C +ATOM 11 CA ARG A 11 241.893 258.239 217.842 1.00 0.00 C +ATOM 12 CA GLU A 12 243.873 258.836 221.041 1.00 0.00 C +ATOM 13 CA ARG A 13 245.019 258.519 224.661 1.00 0.00 C +ATOM 14 CA ALA A 14 246.004 257.045 228.033 1.00 0.00 C +ATOM 15 CA ALA A 15 247.430 256.888 231.563 1.00 0.00 C +ATOM 16 CA ALA A 16 248.383 254.399 234.286 1.00 0.00 C +ATOM 17 CA ARG A 17 249.302 250.824 235.227 1.00 0.00 C +ATOM 18 CA ALA A 18 248.674 248.907 238.459 1.00 0.00 C +ATOM 19 CA GLY A 19 246.428 245.933 237.668 1.00 0.00 C +ATOM 20 CA GLY A 20 243.626 243.573 236.623 1.00 0.00 C +ATOM 21 CA LYS A 21 240.293 244.909 237.897 1.00 0.00 C +ATOM 22 CA GLY A 22 237.968 242.102 239.005 1.00 0.00 C +ATOM 23 CA LYS A 23 236.848 240.576 242.312 1.00 0.00 C +ATOM 24 CA ASN A 24 237.508 236.848 242.740 1.00 0.00 C +ATOM 25 CA GLY A 25 236.246 234.010 244.947 1.00 0.00 C +ATOM 26 CA ASP A 26 236.452 233.580 248.727 1.00 0.00 C +ATOM 27 CA ASP A 27 237.759 236.687 250.503 1.00 0.00 C +ATOM 28 CA GLY A 28 240.806 237.023 252.766 1.00 0.00 C +ATOM 29 CA LEU A 29 240.316 234.730 255.770 1.00 0.00 C +ATOM 30 CA THR A 30 242.340 231.592 256.522 1.00 0.00 C +ATOM 31 CA PRO A 31 245.845 230.117 256.768 1.00 0.00 C +ATOM 32 CA GLU A 32 249.371 231.559 256.741 1.00 0.00 C +ATOM 33 CA GLN A 33 252.741 229.953 257.503 1.00 0.00 C +ATOM 34 CA ARG A 34 255.485 232.495 258.227 1.00 0.00 C +ATOM 35 CA ARG A 35 257.004 235.695 259.630 1.00 0.00 C +ATOM 36 CA GLU A 36 260.679 236.568 260.131 1.00 0.00 C +ATOM 37 CA ARG A 37 261.690 239.106 262.786 1.00 0.00 C +ATOM 38 CA ASP A 38 262.120 242.283 264.844 1.00 0.00 C +ATOM 39 CA GLY A 39 261.033 245.606 266.359 1.00 0.00 C +ATOM 40 CA LYS A 40 262.901 248.736 267.470 1.00 0.00 C +ATOM 41 CA ALA A 41 266.201 250.579 267.945 1.00 0.00 C +ATOM 42 CA LEU A 42 267.302 252.938 270.726 1.00 0.00 C +ATOM 43 CA GLN A 43 269.738 255.201 272.588 1.00 0.00 C +ATOM 44 CA GLU A 44 268.964 258.887 272.015 1.00 0.00 C +ATOM 45 CA LYS A 45 268.836 261.502 269.247 1.00 0.00 C +ATOM 46 CA ALA A 46 267.882 259.610 266.081 1.00 0.00 C +ATOM 47 CA ALA A 47 268.025 257.290 263.062 1.00 0.00 C +ATOM 48 CA LYS A 48 267.594 255.305 259.839 1.00 0.00 C +ATOM 49 CA LYS A 49 267.794 251.556 260.491 1.00 0.00 C +ATOM 50 CA ALA A 50 264.255 250.537 261.466 1.00 0.00 C +ATOM 51 CA ALA A 51 261.726 249.147 258.978 1.00 0.00 C +ATOM 52 CA GLN A 52 261.056 245.442 259.559 1.00 0.00 C +ATOM 53 CA ALA A 53 257.427 244.763 260.502 1.00 0.00 C +ATOM 54 CA ALA A 54 254.962 247.414 261.690 1.00 0.00 C +ATOM 55 CA GLY A 55 251.929 245.712 263.246 1.00 0.00 C +ATOM 56 CA ALA A 56 248.316 244.564 262.862 1.00 0.00 C +ATOM 57 CA SER A 57 247.743 243.016 259.429 1.00 0.00 C +ATOM 58 CA SER A 58 246.928 244.794 256.159 1.00 0.00 C +ATOM 59 CA GLY A 59 248.728 247.456 254.112 1.00 0.00 C +ATOM 60 CA GLY A 60 252.216 247.662 255.631 1.00 0.00 C +ATOM 61 CA ALA A 61 254.403 249.493 253.105 1.00 0.00 C +ATOM 62 CA ALA A 62 257.656 251.463 253.335 1.00 0.00 C +ATOM 63 CA GLY A 63 259.295 254.597 254.753 1.00 0.00 C +ATOM 64 CA GLY A 64 260.579 257.345 257.058 1.00 0.00 C +ATOM 65 CA LYS A 65 262.484 259.739 259.329 1.00 0.00 C +ATOM 66 CA GLY A 66 261.342 259.516 262.957 1.00 0.00 C +ATOM 67 CA ALA A 67 261.297 261.892 265.935 1.00 0.00 C +ATOM 68 CA ALA A 68 258.727 261.663 268.738 1.00 0.00 C +ATOM 69 CA ALA A 69 260.150 263.473 271.774 1.00 0.00 C +ATOM 70 CA LYS A 70 258.689 261.938 274.940 1.00 0.00 C +ATOM 71 CA LYS A 71 256.249 263.144 277.605 1.00 0.00 C +TER 72 LYS A 71 +END diff --git a/Plants/Q8GZZ1/Q8GZZ1.dcd b/Plants/Q8GZZ1/Q8GZZ1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..cab71dc455374fef20c30e0f1425f35e6cc800b1 --- /dev/null +++ b/Plants/Q8GZZ1/Q8GZZ1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:19c78ef6f20f977b255524bc3e4c5bb4dab8438185101862b66f86bbff45bda3 +size 8840276 diff --git a/Plants/Q8GZZ1/top.pdb b/Plants/Q8GZZ1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..d3854c996f5207ed8dea0e20f4fa4a8f29f84b54 --- /dev/null +++ b/Plants/Q8GZZ1/top.pdb @@ -0,0 +1,71 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 222.462 284.385 235.794 1.00 0.00 C +ATOM 2 CA ASP A 2 225.829 282.624 235.519 1.00 0.00 C +ATOM 3 CA GLY A 3 227.318 279.531 237.172 1.00 0.00 C +ATOM 4 CA GLY A 4 227.537 279.635 240.975 1.00 0.00 C +ATOM 5 CA GLN A 5 229.381 277.623 243.634 1.00 0.00 C +ATOM 6 CA ASP A 6 229.437 274.211 245.327 1.00 0.00 C +ATOM 7 CA HIS A 7 232.139 272.176 243.574 1.00 0.00 C +ATOM 8 CA ASP A 8 235.439 270.681 244.753 1.00 0.00 C +ATOM 9 CA GLU A 9 236.115 270.389 248.491 1.00 0.00 C +ATOM 10 CA ARG A 10 235.802 270.048 252.273 1.00 0.00 C +ATOM 11 CA LYS A 11 236.424 266.753 254.083 1.00 0.00 C +ATOM 12 CA LYS A 12 239.241 265.113 252.111 1.00 0.00 C +ATOM 13 CA SER A 13 240.235 261.599 251.026 1.00 0.00 C +ATOM 14 CA HIS A 14 243.196 260.971 248.712 1.00 0.00 C +ATOM 15 CA GLY A 15 242.871 259.306 245.301 1.00 0.00 C +ATOM 16 CA ASN A 16 242.829 258.275 241.633 1.00 0.00 C +ATOM 17 CA PRO A 17 243.696 254.631 240.936 1.00 0.00 C +ATOM 18 CA TYR A 18 245.486 251.760 239.183 1.00 0.00 C +ATOM 19 CA PRO A 19 248.683 250.697 237.404 1.00 0.00 C +ATOM 20 CA ARG A 20 250.188 253.915 236.030 1.00 0.00 C +ATOM 21 CA ARG A 21 252.421 255.964 233.720 1.00 0.00 C +ATOM 22 CA GLY A 22 251.685 255.139 230.074 1.00 0.00 C +ATOM 23 CA ASP A 23 253.205 257.393 227.406 1.00 0.00 C +ATOM 24 CA ILE A 24 250.314 258.135 225.038 1.00 0.00 C +ATOM 25 CA LYS A 25 246.701 258.619 226.148 1.00 0.00 C +ATOM 26 CA ARG A 26 244.811 259.137 229.415 1.00 0.00 C +ATOM 27 CA LYS A 27 241.313 259.512 230.878 1.00 0.00 C +ATOM 28 CA ILE A 28 238.053 259.548 232.849 1.00 0.00 C +ATOM 29 CA VAL A 29 236.705 257.395 235.690 1.00 0.00 C +ATOM 30 CA GLN A 30 236.729 254.164 237.707 1.00 0.00 C +ATOM 31 CA ASP A 31 234.309 251.245 238.087 1.00 0.00 C +ATOM 32 CA VAL A 32 234.931 248.274 240.389 1.00 0.00 C +ATOM 33 CA PHE A 33 233.741 244.841 239.241 1.00 0.00 C +ATOM 34 CA GLY A 34 233.343 242.611 242.305 1.00 0.00 C +ATOM 35 CA LYS A 35 233.382 239.671 244.728 1.00 0.00 C +ATOM 36 CA SER A 36 236.322 237.267 245.027 1.00 0.00 C +ATOM 37 CA SER A 37 238.543 235.305 247.421 1.00 0.00 C +ATOM 38 CA ASP A 38 236.527 234.494 250.551 1.00 0.00 C +ATOM 39 CA PRO A 39 237.074 235.068 254.277 1.00 0.00 C +ATOM 40 CA PRO A 40 240.779 235.414 255.095 1.00 0.00 C +ATOM 41 CA ALA A 41 243.997 233.576 255.977 1.00 0.00 C +ATOM 42 CA THR A 42 245.668 230.231 255.244 1.00 0.00 C +ATOM 43 CA SER A 43 249.201 229.805 256.605 1.00 0.00 C +ATOM 44 CA LYS A 44 252.716 231.210 256.171 1.00 0.00 C +ATOM 45 CA PRO A 45 256.501 230.955 255.822 1.00 0.00 C +ATOM 46 CA ALA A 46 258.617 230.138 258.882 1.00 0.00 C +ATOM 47 CA GLY A 47 262.372 230.773 258.773 1.00 0.00 C +ATOM 48 CA ALA A 48 264.734 233.728 258.318 1.00 0.00 C +ATOM 49 CA GLY A 49 267.821 234.908 260.215 1.00 0.00 C +ATOM 50 CA ASN A 50 271.592 235.439 260.111 1.00 0.00 C +ATOM 51 CA GLY A 51 274.333 234.196 262.446 1.00 0.00 C +ATOM 52 CA ASP A 52 275.106 236.581 265.315 1.00 0.00 C +ATOM 53 CA GLY A 53 276.404 238.834 268.100 1.00 0.00 C +ATOM 54 CA GLY A 54 277.436 238.503 271.753 1.00 0.00 C +ATOM 55 CA ASP A 55 274.828 236.335 273.487 1.00 0.00 C +ATOM 56 CA ASP A 56 272.140 233.718 274.156 1.00 0.00 C +ATOM 57 CA ALA A 57 270.191 233.089 270.943 1.00 0.00 C +ATOM 58 CA ALA A 58 269.103 234.293 267.496 1.00 0.00 C +ATOM 59 CA ALA A 59 269.093 237.658 265.708 1.00 0.00 C +ATOM 60 CA ALA A 60 266.375 240.327 265.651 1.00 0.00 C +ATOM 61 CA GLY A 61 266.979 243.478 263.596 1.00 0.00 C +ATOM 62 CA SER A 62 270.436 244.981 263.040 1.00 0.00 C +ATOM 63 CA TYR A 63 273.316 245.347 265.508 1.00 0.00 C +ATOM 64 CA TYR A 64 272.395 248.415 267.572 1.00 0.00 C +ATOM 65 CA GLY A 65 272.171 251.281 265.072 1.00 0.00 C +ATOM 66 CA HIS A 66 274.862 252.807 262.848 1.00 0.00 C +ATOM 67 CA TYR A 67 276.419 255.875 261.212 1.00 0.00 C +TER 68 TYR A 67 +END diff --git a/Plants/Q8H0H7/Q8H0H7.dcd b/Plants/Q8H0H7/Q8H0H7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..090cff9d331ff1b1bd5f164dcafd6eef53266a1e --- /dev/null +++ b/Plants/Q8H0H7/Q8H0H7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:91fd1f3be53a238a6c9420401581cc5e3a9837af3698e3d449b7ecd517370828 +size 7280276 diff --git a/Plants/Q8H0H7/top.pdb b/Plants/Q8H0H7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..f118fa9c5c47ee97c6592f740a585b5d664ddf13 --- /dev/null +++ b/Plants/Q8H0H7/top.pdb @@ -0,0 +1,58 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 245.569 241.036 253.423 1.00 0.00 C +ATOM 2 CA GLN A 2 248.690 242.394 255.133 1.00 0.00 C +ATOM 3 CA THR A 3 252.244 241.644 253.981 1.00 0.00 C +ATOM 4 CA THR A 4 253.485 244.939 252.525 1.00 0.00 C +ATOM 5 CA LYS A 5 252.967 248.470 251.192 1.00 0.00 C +ATOM 6 CA LEU A 6 249.224 248.963 250.681 1.00 0.00 C +ATOM 7 CA HIS A 7 246.549 251.452 251.759 1.00 0.00 C +ATOM 8 CA GLN A 8 242.916 251.319 252.899 1.00 0.00 C +ATOM 9 CA PRO A 9 240.697 254.280 251.990 1.00 0.00 C +ATOM 10 CA LEU A 10 242.011 257.770 252.772 1.00 0.00 C +ATOM 11 CA THR A 11 243.212 260.915 250.988 1.00 0.00 C +ATOM 12 CA ILE A 12 244.275 263.689 248.601 1.00 0.00 C +ATOM 13 CA ARG A 13 245.662 267.204 249.084 1.00 0.00 C +ATOM 14 CA THR A 14 245.432 268.799 245.631 1.00 0.00 C +ATOM 15 CA PRO A 15 247.175 269.728 242.373 1.00 0.00 C +ATOM 16 CA PRO A 16 249.709 270.212 239.569 1.00 0.00 C +ATOM 17 CA LYS A 17 253.330 269.724 238.490 1.00 0.00 C +ATOM 18 CA ILE A 18 255.760 267.273 240.103 1.00 0.00 C +ATOM 19 CA SER A 19 256.988 265.472 243.228 1.00 0.00 C +ATOM 20 CA LYS A 20 256.772 261.780 244.142 1.00 0.00 C +ATOM 21 CA ILE A 21 255.796 258.776 242.011 1.00 0.00 C +ATOM 22 CA GLN A 22 258.384 257.919 239.350 1.00 0.00 C +ATOM 23 CA LEU A 23 256.796 255.208 237.195 1.00 0.00 C +ATOM 24 CA GLN A 24 254.020 252.609 237.419 1.00 0.00 C +ATOM 25 CA LYS A 25 255.144 249.626 239.506 1.00 0.00 C +ATOM 26 CA VAL A 26 256.577 246.258 238.451 1.00 0.00 C +ATOM 27 CA ALA A 27 260.145 245.019 238.952 1.00 0.00 C +ATOM 28 CA GLU A 28 262.943 246.666 240.947 1.00 0.00 C +ATOM 29 CA THR A 29 265.612 249.383 240.878 1.00 0.00 C +ATOM 30 CA GLN A 30 264.215 252.217 243.007 1.00 0.00 C +ATOM 31 CA HIS A 31 260.472 251.888 243.634 1.00 0.00 C +ATOM 32 CA GLN A 32 258.436 249.234 245.458 1.00 0.00 C +ATOM 33 CA THR A 33 257.616 245.811 246.916 1.00 0.00 C +ATOM 34 CA THR A 34 259.837 245.059 249.918 1.00 0.00 C +ATOM 35 CA PRO A 35 260.937 247.460 252.664 1.00 0.00 C +ATOM 36 CA LYS A 36 259.736 248.271 256.188 1.00 0.00 C +ATOM 37 CA ASN A 37 260.509 245.435 258.611 1.00 0.00 C +ATOM 38 CA SER A 38 258.721 242.731 260.613 1.00 0.00 C +ATOM 39 CA SER A 39 256.394 242.129 263.569 1.00 0.00 C +ATOM 40 CA ARG A 40 253.082 241.770 265.418 1.00 0.00 C +ATOM 41 CA ARG A 41 249.400 241.302 266.280 1.00 0.00 C +ATOM 42 CA THR A 42 247.445 238.949 264.009 1.00 0.00 C +ATOM 43 CA ILE A 43 244.766 236.742 265.578 1.00 0.00 C +ATOM 44 CA PHE A 44 241.628 236.568 263.425 1.00 0.00 C +ATOM 45 CA ASP A 45 240.740 237.781 259.924 1.00 0.00 C +ATOM 46 CA GLU A 46 239.918 241.499 259.799 1.00 0.00 C +ATOM 47 CA GLU A 47 237.434 244.184 258.734 1.00 0.00 C +ATOM 48 CA HIS A 48 238.448 247.302 256.792 1.00 0.00 C +ATOM 49 CA SER A 49 236.975 247.087 253.285 1.00 0.00 C +ATOM 50 CA PHE A 50 235.446 247.394 249.808 1.00 0.00 C +ATOM 51 CA VAL A 51 235.863 244.169 247.822 1.00 0.00 C +ATOM 52 CA SER A 52 236.273 241.265 250.254 1.00 0.00 C +ATOM 53 CA THR A 53 234.569 238.021 249.211 1.00 0.00 C +ATOM 54 CA VAL A 54 233.056 237.203 245.811 1.00 0.00 C +TER 55 VAL A 54 +END diff --git a/Plants/Q8H0L0/Q8H0L0.dcd b/Plants/Q8H0L0/Q8H0L0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..7bcc1babd7a0155e24131a4e38b01ebc5ace41a2 --- /dev/null +++ b/Plants/Q8H0L0/Q8H0L0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:d0a15fc472023132a28f1ca2f7cfdf953c5d6b51b4d54908dd4340d7ba219ad8 +size 39180276 diff --git a/Plants/Q8H0L0/top.pdb b/Plants/Q8H0L0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..6047c70515eb2e8b61a9cc3ddba67977198c5968 --- /dev/null +++ b/Plants/Q8H0L0/top.pdb @@ -0,0 +1,215 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA VAL A 1 278.970 220.456 293.305 1.00 0.00 C +ATOM 2 CA LEU A 2 281.531 221.455 290.667 1.00 0.00 C +ATOM 3 CA PRO A 3 283.568 219.077 288.496 1.00 0.00 C +ATOM 4 CA THR A 4 283.347 218.855 284.699 1.00 0.00 C +ATOM 5 CA SER A 5 280.816 217.855 282.032 1.00 0.00 C +ATOM 6 CA LEU A 6 277.590 216.899 280.245 1.00 0.00 C +ATOM 7 CA GLN A 7 275.590 216.196 277.079 1.00 0.00 C +ATOM 8 CA GLN A 8 271.936 216.926 277.874 1.00 0.00 C +ATOM 9 CA PRO A 9 270.621 215.074 280.933 1.00 0.00 C +ATOM 10 CA GLY A 10 271.878 213.070 283.919 1.00 0.00 C +ATOM 11 CA GLN A 11 272.635 210.336 286.462 1.00 0.00 C +ATOM 12 CA GLY A 12 273.514 211.769 289.881 1.00 0.00 C +ATOM 13 CA GLN A 13 275.859 212.647 292.752 1.00 0.00 C +ATOM 14 CA GLN A 14 276.968 211.842 296.308 1.00 0.00 C +ATOM 15 CA GLY A 15 275.485 212.195 299.800 1.00 0.00 C +ATOM 16 CA HIS A 16 272.288 211.240 301.638 1.00 0.00 C +ATOM 17 CA TYR A 17 269.659 212.138 304.245 1.00 0.00 C +ATOM 18 CA PRO A 18 267.910 215.351 303.178 1.00 0.00 C +ATOM 19 CA ALA A 19 265.093 217.821 303.868 1.00 0.00 C +ATOM 20 CA SER A 20 265.021 221.627 304.022 1.00 0.00 C +ATOM 21 CA LEU A 21 264.424 224.396 301.474 1.00 0.00 C +ATOM 22 CA GLN A 22 266.627 226.310 299.023 1.00 0.00 C +ATOM 23 CA GLN A 23 264.804 228.222 296.278 1.00 0.00 C +ATOM 24 CA PRO A 24 263.561 226.680 293.023 1.00 0.00 C +ATOM 25 CA GLY A 25 264.825 229.004 290.280 1.00 0.00 C +ATOM 26 CA GLN A 26 263.863 232.539 289.234 1.00 0.00 C +ATOM 27 CA GLY A 27 261.578 232.250 286.200 1.00 0.00 C +ATOM 28 CA GLN A 28 260.126 230.158 283.366 1.00 0.00 C +ATOM 29 CA PRO A 29 257.352 229.655 280.803 1.00 0.00 C +ATOM 30 CA GLY A 30 253.667 230.100 279.944 1.00 0.00 C +ATOM 31 CA GLN A 31 251.105 229.280 282.642 1.00 0.00 C +ATOM 32 CA ARG A 32 247.332 229.693 282.319 1.00 0.00 C +ATOM 33 CA GLN A 33 244.696 232.078 283.690 1.00 0.00 C +ATOM 34 CA GLN A 34 240.889 231.977 283.792 1.00 0.00 C +ATOM 35 CA PRO A 35 238.056 229.989 282.200 1.00 0.00 C +ATOM 36 CA GLY A 36 235.201 232.358 281.334 1.00 0.00 C +ATOM 37 CA GLN A 37 233.188 230.474 278.704 1.00 0.00 C +ATOM 38 CA GLY A 38 234.688 229.125 275.471 1.00 0.00 C +ATOM 39 CA GLN A 39 238.077 227.443 275.919 1.00 0.00 C +ATOM 40 CA HIS A 40 239.815 226.968 272.561 1.00 0.00 C +ATOM 41 CA PRO A 41 240.824 229.784 270.202 1.00 0.00 C +ATOM 42 CA GLU A 42 239.278 233.255 269.924 1.00 0.00 C +ATOM 43 CA GLN A 43 242.090 235.571 268.807 1.00 0.00 C +ATOM 44 CA GLY A 44 240.858 238.769 267.143 1.00 0.00 C +ATOM 45 CA LYS A 45 243.005 239.625 264.114 1.00 0.00 C +ATOM 46 CA GLN A 46 246.292 241.142 262.927 1.00 0.00 C +ATOM 47 CA PRO A 47 250.070 241.204 263.418 1.00 0.00 C +ATOM 48 CA GLY A 48 251.831 240.614 260.092 1.00 0.00 C +ATOM 49 CA GLN A 49 251.572 243.528 257.651 1.00 0.00 C +ATOM 50 CA GLY A 50 248.253 243.769 255.796 1.00 0.00 C +ATOM 51 CA GLN A 51 245.849 240.957 256.707 1.00 0.00 C +ATOM 52 CA GLN A 52 245.299 237.257 255.984 1.00 0.00 C +ATOM 53 CA GLY A 53 247.225 234.007 255.484 1.00 0.00 C +ATOM 54 CA TYR A 54 248.991 230.682 254.901 1.00 0.00 C +ATOM 55 CA TYR A 55 247.083 227.932 253.080 1.00 0.00 C +ATOM 56 CA PRO A 56 245.878 228.058 249.468 1.00 0.00 C +ATOM 57 CA THR A 57 246.180 230.177 246.316 1.00 0.00 C +ATOM 58 CA SER A 58 248.660 232.446 244.521 1.00 0.00 C +ATOM 59 CA PRO A 59 252.303 231.829 245.451 1.00 0.00 C +ATOM 60 CA GLN A 60 255.096 234.148 244.298 1.00 0.00 C +ATOM 61 CA GLN A 61 255.150 237.902 244.948 1.00 0.00 C +ATOM 62 CA PRO A 62 257.549 239.258 247.579 1.00 0.00 C +ATOM 63 CA GLY A 63 258.531 238.320 251.139 1.00 0.00 C +ATOM 64 CA GLN A 64 260.203 235.633 253.261 1.00 0.00 C +ATOM 65 CA GLY A 65 261.737 232.755 251.291 1.00 0.00 C +ATOM 66 CA GLN A 66 263.516 229.996 253.225 1.00 0.00 C +ATOM 67 CA GLN A 67 267.175 229.088 252.671 1.00 0.00 C +ATOM 68 CA LEU A 68 270.703 229.150 254.108 1.00 0.00 C +ATOM 69 CA GLY A 69 274.106 227.983 255.363 1.00 0.00 C +ATOM 70 CA GLN A 70 276.424 228.565 252.396 1.00 0.00 C +ATOM 71 CA GLY A 71 278.356 231.269 250.533 1.00 0.00 C +ATOM 72 CA GLN A 72 280.828 232.497 247.907 1.00 0.00 C +ATOM 73 CA GLN A 73 282.881 231.145 244.996 1.00 0.00 C +ATOM 74 CA GLY A 74 285.506 233.804 244.249 1.00 0.00 C +ATOM 75 CA TYR A 75 288.567 233.303 242.037 1.00 0.00 C +ATOM 76 CA TYR A 76 290.946 230.433 241.251 1.00 0.00 C +ATOM 77 CA PRO A 77 294.414 229.264 240.193 1.00 0.00 C +ATOM 78 CA THR A 78 294.195 227.032 237.113 1.00 0.00 C +ATOM 79 CA SER A 79 291.795 225.885 234.385 1.00 0.00 C +ATOM 80 CA PRO A 80 288.236 225.986 235.742 1.00 0.00 C +ATOM 81 CA GLN A 81 284.583 226.116 234.667 1.00 0.00 C +ATOM 82 CA GLN A 82 281.104 224.576 234.464 1.00 0.00 C +ATOM 83 CA PRO A 83 277.509 225.677 233.847 1.00 0.00 C +ATOM 84 CA GLY A 84 274.656 227.937 234.971 1.00 0.00 C +ATOM 85 CA GLN A 85 271.846 226.180 236.851 1.00 0.00 C +ATOM 86 CA GLY A 86 270.309 222.855 235.806 1.00 0.00 C +ATOM 87 CA GLN A 87 269.975 219.163 234.925 1.00 0.00 C +ATOM 88 CA GLN A 88 268.564 217.294 231.920 1.00 0.00 C +ATOM 89 CA PRO A 89 269.056 214.235 229.703 1.00 0.00 C +ATOM 90 CA GLY A 90 268.663 214.969 225.985 1.00 0.00 C +ATOM 91 CA GLN A 91 266.129 217.580 224.854 1.00 0.00 C +ATOM 92 CA GLY A 92 266.314 221.251 223.852 1.00 0.00 C +ATOM 93 CA GLN A 93 265.049 223.771 226.414 1.00 0.00 C +ATOM 94 CA GLN A 94 263.443 225.467 229.424 1.00 0.00 C +ATOM 95 CA GLY A 95 265.141 226.693 232.607 1.00 0.00 C +ATOM 96 CA HIS A 96 263.371 229.175 234.892 1.00 0.00 C +ATOM 97 CA CYS A 97 263.657 228.675 238.659 1.00 0.00 C +ATOM 98 CA PRO A 98 260.254 228.686 240.372 1.00 0.00 C +ATOM 99 CA THR A 99 260.228 230.411 243.769 1.00 0.00 C +ATOM 100 CA SER A 100 263.504 231.918 244.999 1.00 0.00 C +ATOM 101 CA PRO A 101 265.022 235.061 243.473 1.00 0.00 C +ATOM 102 CA GLN A 102 264.433 237.405 240.528 1.00 0.00 C +ATOM 103 CA GLN A 103 261.941 239.964 241.855 1.00 0.00 C +ATOM 104 CA SER A 104 262.817 241.458 245.248 1.00 0.00 C +ATOM 105 CA GLY A 105 265.829 239.909 246.994 1.00 0.00 C +ATOM 106 CA GLN A 106 267.067 242.075 249.873 1.00 0.00 C +ATOM 107 CA ALA A 107 265.335 245.028 251.546 1.00 0.00 C +ATOM 108 CA GLN A 108 267.596 247.999 252.301 1.00 0.00 C +ATOM 109 CA GLN A 109 266.575 251.591 253.060 1.00 0.00 C +ATOM 110 CA PRO A 110 263.007 252.784 252.460 1.00 0.00 C +ATOM 111 CA GLY A 111 260.834 254.413 249.788 1.00 0.00 C +ATOM 112 CA GLN A 112 258.809 257.088 247.983 1.00 0.00 C +ATOM 113 CA GLY A 113 256.747 260.062 246.790 1.00 0.00 C +ATOM 114 CA GLN A 114 256.936 262.976 244.343 1.00 0.00 C +ATOM 115 CA GLN A 115 259.812 264.814 242.649 1.00 0.00 C +ATOM 116 CA ILE A 116 262.383 267.429 243.683 1.00 0.00 C +ATOM 117 CA GLY A 117 265.273 268.685 241.541 1.00 0.00 C +ATOM 118 CA GLN A 118 266.937 265.642 239.964 1.00 0.00 C +ATOM 119 CA VAL A 119 270.648 266.389 239.537 1.00 0.00 C +ATOM 120 CA GLN A 120 273.321 268.332 241.433 1.00 0.00 C +ATOM 121 CA GLN A 121 271.875 271.258 243.399 1.00 0.00 C +ATOM 122 CA PRO A 122 270.733 270.379 246.926 1.00 0.00 C +ATOM 123 CA GLY A 123 271.850 273.186 249.248 1.00 0.00 C +ATOM 124 CA GLN A 124 275.075 274.787 250.492 1.00 0.00 C +ATOM 125 CA GLY A 125 275.984 275.192 254.170 1.00 0.00 C +ATOM 126 CA GLN A 126 274.667 276.833 257.346 1.00 0.00 C +ATOM 127 CA GLN A 127 274.736 280.566 256.585 1.00 0.00 C +ATOM 128 CA GLY A 128 271.174 281.553 255.659 1.00 0.00 C +ATOM 129 CA TYR A 129 268.849 284.386 254.618 1.00 0.00 C +ATOM 130 CA TYR A 130 268.087 287.290 256.963 1.00 0.00 C +ATOM 131 CA PRO A 131 264.366 288.049 257.265 1.00 0.00 C +ATOM 132 CA THR A 132 262.887 289.512 254.073 1.00 0.00 C +ATOM 133 CA SER A 133 260.516 290.034 251.137 1.00 0.00 C +ATOM 134 CA VAL A 134 259.816 289.360 247.453 1.00 0.00 C +ATOM 135 CA GLN A 135 258.737 289.031 243.814 1.00 0.00 C +ATOM 136 CA GLN A 136 255.232 289.277 242.341 1.00 0.00 C +ATOM 137 CA PRO A 137 251.936 287.498 243.040 1.00 0.00 C +ATOM 138 CA GLY A 138 248.542 285.780 243.264 1.00 0.00 C +ATOM 139 CA GLN A 139 246.973 286.635 246.629 1.00 0.00 C +ATOM 140 CA GLY A 140 243.662 288.510 246.449 1.00 0.00 C +ATOM 141 CA GLN A 141 242.697 291.848 248.013 1.00 0.00 C +ATOM 142 CA GLN A 142 241.041 295.247 247.545 1.00 0.00 C +ATOM 143 CA SER A 143 240.389 296.385 243.968 1.00 0.00 C +ATOM 144 CA GLY A 144 240.076 293.942 241.060 1.00 0.00 C +ATOM 145 CA GLN A 145 238.053 291.088 239.551 1.00 0.00 C +ATOM 146 CA GLY A 146 240.270 288.102 238.721 1.00 0.00 C +ATOM 147 CA GLN A 147 240.801 284.445 237.793 1.00 0.00 C +ATOM 148 CA GLN A 148 239.049 283.515 234.540 1.00 0.00 C +ATOM 149 CA SER A 149 238.232 279.797 234.384 1.00 0.00 C +ATOM 150 CA GLY A 150 236.074 278.708 231.439 1.00 0.00 C +ATOM 151 CA GLN A 151 236.385 275.009 230.579 1.00 0.00 C +ATOM 152 CA GLY A 152 236.259 271.317 231.510 1.00 0.00 C +ATOM 153 CA HIS A 153 239.869 270.215 232.026 1.00 0.00 C +ATOM 154 CA GLN A 154 240.826 270.233 235.714 1.00 0.00 C +ATOM 155 CA PRO A 155 239.921 267.404 238.100 1.00 0.00 C +ATOM 156 CA GLY A 156 242.836 266.503 240.382 1.00 0.00 C +ATOM 157 CA GLN A 157 243.669 262.882 241.227 1.00 0.00 C +ATOM 158 CA GLY A 158 240.556 260.687 241.329 1.00 0.00 C +ATOM 159 CA GLN A 159 236.926 261.775 241.719 1.00 0.00 C +ATOM 160 CA GLN A 160 233.307 262.363 240.685 1.00 0.00 C +ATOM 161 CA SER A 161 229.550 261.825 241.021 1.00 0.00 C +ATOM 162 CA GLY A 162 226.244 262.783 242.654 1.00 0.00 C +ATOM 163 CA GLN A 163 224.312 265.823 241.411 1.00 0.00 C +ATOM 164 CA GLU A 164 222.874 269.350 241.354 1.00 0.00 C +ATOM 165 CA GLN A 165 222.748 272.024 238.643 1.00 0.00 C +ATOM 166 CA GLN A 166 225.064 272.837 235.729 1.00 0.00 C +ATOM 167 CA GLY A 167 228.223 273.409 233.676 1.00 0.00 C +ATOM 168 CA TYR A 168 231.374 271.818 235.109 1.00 0.00 C +ATOM 169 CA ASP A 169 231.204 268.607 237.153 1.00 0.00 C +ATOM 170 CA SER A 170 232.125 268.709 240.848 1.00 0.00 C +ATOM 171 CA PRO A 171 230.523 271.747 242.497 1.00 0.00 C +ATOM 172 CA TYR A 172 227.241 272.464 244.293 1.00 0.00 C +ATOM 173 CA HIS A 173 225.102 270.622 246.852 1.00 0.00 C +ATOM 174 CA VAL A 174 222.501 269.627 249.453 1.00 0.00 C +ATOM 175 CA SER A 175 218.831 269.552 248.434 1.00 0.00 C +ATOM 176 CA ALA A 176 215.495 270.442 246.822 1.00 0.00 C +ATOM 177 CA GLU A 177 212.254 271.995 245.558 1.00 0.00 C +ATOM 178 CA GLN A 178 212.836 275.308 243.768 1.00 0.00 C +ATOM 179 CA GLN A 179 214.604 276.820 240.750 1.00 0.00 C +ATOM 180 CA ALA A 180 218.179 276.974 239.443 1.00 0.00 C +ATOM 181 CA ALA A 181 218.440 278.908 236.171 1.00 0.00 C +ATOM 182 CA SER A 182 219.496 279.459 232.552 1.00 0.00 C +ATOM 183 CA PRO A 183 219.785 276.225 230.558 1.00 0.00 C +ATOM 184 CA MET A 184 222.804 275.375 228.396 1.00 0.00 C +ATOM 185 CA VAL A 185 224.091 271.827 227.873 1.00 0.00 C +ATOM 186 CA ALA A 186 224.656 271.181 224.161 1.00 0.00 C +ATOM 187 CA LYS A 187 226.438 269.683 221.145 1.00 0.00 C +ATOM 188 CA ALA A 188 225.872 271.530 217.861 1.00 0.00 C +ATOM 189 CA GLN A 189 224.131 274.905 217.555 1.00 0.00 C +ATOM 190 CA GLN A 190 222.759 276.239 220.849 1.00 0.00 C +ATOM 191 CA PRO A 191 219.545 276.729 222.835 1.00 0.00 C +ATOM 192 CA ALA A 192 216.391 275.885 220.870 1.00 0.00 C +ATOM 193 CA THR A 193 214.452 275.803 217.592 1.00 0.00 C +ATOM 194 CA GLN A 194 210.952 277.033 218.461 1.00 0.00 C +ATOM 195 CA LEU A 195 207.933 278.841 217.002 1.00 0.00 C +ATOM 196 CA PRO A 196 205.133 276.339 216.357 1.00 0.00 C +ATOM 197 CA THR A 197 203.805 273.682 218.742 1.00 0.00 C +ATOM 198 CA VAL A 198 201.652 270.780 219.952 1.00 0.00 C +ATOM 199 CA CYS A 199 201.784 268.407 222.929 1.00 0.00 C +ATOM 200 CA ARG A 200 202.753 269.646 226.400 1.00 0.00 C +ATOM 201 CA MET A 201 205.977 268.607 228.143 1.00 0.00 C +ATOM 202 CA GLU A 202 209.217 268.118 226.198 1.00 0.00 C +ATOM 203 CA GLY A 203 210.587 265.105 224.310 1.00 0.00 C +ATOM 204 CA GLY A 204 209.411 262.656 221.640 1.00 0.00 C +ATOM 205 CA ASP A 205 207.184 259.623 222.236 1.00 0.00 C +ATOM 206 CA ALA A 206 207.764 257.676 225.459 1.00 0.00 C +ATOM 207 CA LEU A 207 209.016 256.337 228.800 1.00 0.00 C +ATOM 208 CA SER A 208 206.794 254.815 231.495 1.00 0.00 C +ATOM 209 CA ALA A 209 204.138 252.879 229.568 1.00 0.00 C +ATOM 210 CA SER A 210 204.308 249.087 229.896 1.00 0.00 C +ATOM 211 CA GLN A 211 202.230 246.018 229.013 1.00 0.00 C +TER 212 GLN A 211 +END diff --git a/Plants/Q8H0M3/Q8H0M3.dcd b/Plants/Q8H0M3/Q8H0M3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..948fc5b8f54dbc1afa63535abec44341b26e0f59 --- /dev/null +++ b/Plants/Q8H0M3/Q8H0M3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:a5a0f0c9471a3881cc46ec902662dc95e245c6f468715c5589c90c9eaeab33a8 +size 12200276 diff --git a/Plants/Q8H0M3/top.pdb b/Plants/Q8H0M3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..e76bcaa5ef5d16605db30e9ede7d58d88d405718 --- /dev/null +++ b/Plants/Q8H0M3/top.pdb @@ -0,0 +1,99 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 287.459 220.348 314.706 1.00 0.00 C +ATOM 2 CA ALA A 2 285.114 223.349 314.594 1.00 0.00 C +ATOM 3 CA GLU A 3 283.484 225.059 317.583 1.00 0.00 C +ATOM 4 CA GLU A 4 285.190 227.249 320.192 1.00 0.00 C +ATOM 5 CA GLN A 5 285.300 230.875 319.028 1.00 0.00 C +ATOM 6 CA GLN A 6 284.096 233.705 316.779 1.00 0.00 C +ATOM 7 CA ASP A 7 282.893 232.831 313.271 1.00 0.00 C +ATOM 8 CA ARG A 8 280.684 235.291 311.377 1.00 0.00 C +ATOM 9 CA GLY A 9 277.384 236.049 309.631 1.00 0.00 C +ATOM 10 CA MET A 10 277.362 239.631 308.335 1.00 0.00 C +ATOM 11 CA PHE A 11 275.740 240.533 305.008 1.00 0.00 C +ATOM 12 CA GLY A 12 276.481 243.772 303.143 1.00 0.00 C +ATOM 13 CA LEU A 13 276.839 247.563 303.039 1.00 0.00 C +ATOM 14 CA LEU A 14 278.501 250.893 302.220 1.00 0.00 C +ATOM 15 CA GLY A 15 282.201 250.175 301.662 1.00 0.00 C +ATOM 16 CA LYS A 16 285.513 250.991 299.965 1.00 0.00 C +ATOM 17 CA LYS A 17 289.151 249.975 299.468 1.00 0.00 C +ATOM 18 CA LYS A 18 289.658 246.204 299.659 1.00 0.00 C +ATOM 19 CA GLU A 19 288.430 242.721 298.723 1.00 0.00 C +ATOM 20 CA ASP A 20 286.938 239.239 299.128 1.00 0.00 C +ATOM 21 CA GLU A 21 286.918 236.504 296.476 1.00 0.00 C +ATOM 22 CA GLY A 22 287.823 237.756 292.993 1.00 0.00 C +ATOM 23 CA LYS A 23 286.354 236.438 289.734 1.00 0.00 C +ATOM 24 CA GLN A 24 285.472 237.843 286.304 1.00 0.00 C +ATOM 25 CA CYS A 25 283.109 239.656 283.928 1.00 0.00 C +ATOM 26 CA ASP A 26 279.591 240.843 284.780 1.00 0.00 C +ATOM 27 CA GLN A 27 275.832 241.403 285.052 1.00 0.00 C +ATOM 28 CA THR A 28 272.051 241.186 284.633 1.00 0.00 C +ATOM 29 CA GLU A 29 268.969 240.025 282.718 1.00 0.00 C +ATOM 30 CA GLY A 30 265.764 239.281 280.796 1.00 0.00 C +ATOM 31 CA GLY A 31 262.003 239.851 281.016 1.00 0.00 C +ATOM 32 CA ARG A 32 261.046 243.183 279.435 1.00 0.00 C +ATOM 33 CA CYS A 33 258.024 242.765 277.152 1.00 0.00 C +ATOM 34 CA GLU A 34 254.652 243.260 275.449 1.00 0.00 C +ATOM 35 CA GLU A 35 253.252 243.145 271.908 1.00 0.00 C +ATOM 36 CA GLY A 36 253.043 242.990 268.106 1.00 0.00 C +ATOM 37 CA LYS A 37 253.716 244.707 264.772 1.00 0.00 C +ATOM 38 CA LYS A 38 251.968 247.069 262.348 1.00 0.00 C +ATOM 39 CA PRO A 39 248.557 248.281 261.158 1.00 0.00 C +ATOM 40 CA GLY A 40 247.707 246.395 257.958 1.00 0.00 C +ATOM 41 CA MET A 41 244.657 247.326 255.875 1.00 0.00 C +ATOM 42 CA VAL A 42 242.604 245.279 253.403 1.00 0.00 C +ATOM 43 CA ASP A 43 240.507 243.682 250.651 1.00 0.00 C +ATOM 44 CA LYS A 44 237.917 242.183 248.293 1.00 0.00 C +ATOM 45 CA VAL A 45 235.018 241.246 246.005 1.00 0.00 C +ATOM 46 CA LYS A 46 234.010 243.750 243.317 1.00 0.00 C +ATOM 47 CA GLU A 47 232.371 245.936 240.661 1.00 0.00 C +ATOM 48 CA LYS A 48 230.388 248.294 238.420 1.00 0.00 C +ATOM 49 CA ILE A 49 227.691 250.222 236.542 1.00 0.00 C +ATOM 50 CA PRO A 50 228.355 250.681 232.818 1.00 0.00 C +ATOM 51 CA GLY A 51 229.451 250.927 229.178 1.00 0.00 C +ATOM 52 CA GLN A 52 232.224 248.621 227.947 1.00 0.00 C +ATOM 53 CA GLN A 53 234.327 247.487 224.980 1.00 0.00 C +ATOM 54 CA GLN A 54 232.783 248.410 221.621 1.00 0.00 C +ATOM 55 CA LYS A 55 229.224 249.756 221.434 1.00 0.00 C +ATOM 56 CA LEU A 56 226.460 250.670 218.976 1.00 0.00 C +ATOM 57 CA PRO A 57 224.764 251.041 215.585 1.00 0.00 C +ATOM 58 CA GLY A 58 225.256 248.075 213.245 1.00 0.00 C +ATOM 59 CA ASP A 59 224.229 244.834 214.964 1.00 0.00 C +ATOM 60 CA GLY A 60 224.029 242.853 218.213 1.00 0.00 C +ATOM 61 CA LYS A 61 225.627 242.748 221.670 1.00 0.00 C +ATOM 62 CA GLN A 62 224.597 239.906 223.989 1.00 0.00 C +ATOM 63 CA CYS A 63 221.045 238.782 223.188 1.00 0.00 C +ATOM 64 CA CYS A 64 219.066 239.345 226.395 1.00 0.00 C +ATOM 65 CA GLY A 65 219.468 240.270 230.069 1.00 0.00 C +ATOM 66 CA GLN A 66 221.870 243.178 230.604 1.00 0.00 C +ATOM 67 CA PRO A 67 224.592 245.844 230.553 1.00 0.00 C +ATOM 68 CA GLY A 68 223.627 248.335 227.836 1.00 0.00 C +ATOM 69 CA GLY A 69 224.135 251.523 225.813 1.00 0.00 C +ATOM 70 CA GLU A 70 223.213 255.193 226.259 1.00 0.00 C +ATOM 71 CA GLU A 71 225.676 257.661 224.725 1.00 0.00 C +ATOM 72 CA GLU A 72 227.867 256.330 221.906 1.00 0.00 C +ATOM 73 CA LYS A 73 228.748 258.503 218.903 1.00 0.00 C +ATOM 74 CA LYS A 74 229.609 259.036 215.230 1.00 0.00 C +ATOM 75 CA PRO A 75 230.060 261.982 212.857 1.00 0.00 C +ATOM 76 CA GLY A 76 227.181 264.324 213.717 1.00 0.00 C +ATOM 77 CA MET A 77 223.485 264.039 212.835 1.00 0.00 C +ATOM 78 CA VAL A 78 223.214 260.915 210.672 1.00 0.00 C +ATOM 79 CA ASP A 79 223.995 262.099 207.136 1.00 0.00 C +ATOM 80 CA LYS A 80 227.747 261.616 206.684 1.00 0.00 C +ATOM 81 CA ILE A 81 231.307 262.966 206.536 1.00 0.00 C +ATOM 82 CA LYS A 82 234.358 264.609 204.952 1.00 0.00 C +ATOM 83 CA GLN A 83 233.582 268.289 204.343 1.00 0.00 C +ATOM 84 CA LYS A 84 234.246 271.619 202.615 1.00 0.00 C +ATOM 85 CA LEU A 85 234.924 270.720 198.975 1.00 0.00 C +ATOM 86 CA PRO A 86 237.490 273.267 197.772 1.00 0.00 C +ATOM 87 CA GLY A 87 237.083 275.054 194.432 1.00 0.00 C +ATOM 88 CA GLN A 88 240.396 274.825 192.565 1.00 0.00 C +ATOM 89 CA GLN A 89 242.950 277.651 192.651 1.00 0.00 C +ATOM 90 CA ASN A 90 244.663 280.701 194.161 1.00 0.00 C +ATOM 91 CA LYS A 91 248.429 281.249 193.983 1.00 0.00 C +ATOM 92 CA THR A 92 249.756 284.700 193.063 1.00 0.00 C +ATOM 93 CA GLY A 93 250.042 288.086 194.787 1.00 0.00 C +ATOM 94 CA CYS A 94 250.932 291.530 196.151 1.00 0.00 C +ATOM 95 CA ASP A 95 254.484 292.800 195.615 1.00 0.00 C +TER 96 ASP A 95 +END diff --git a/Plants/Q8H0M6/Q8H0M6.dcd b/Plants/Q8H0M6/Q8H0M6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..6ecec5afcfdc511108c481356a3174267dfdfd9e --- /dev/null +++ b/Plants/Q8H0M6/Q8H0M6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:609d8cf2566d4dd5dd6d677417ba433a52bb8ba621a2b953290cafa18d8f0065 +size 11960276 diff --git a/Plants/Q8H0M6/top.pdb b/Plants/Q8H0M6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..5821c269fd24a338a54e260f6b817a04849da7d3 --- /dev/null +++ b/Plants/Q8H0M6/top.pdb @@ -0,0 +1,97 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 260.950 194.157 232.313 1.00 0.00 C +ATOM 2 CA ALA A 2 262.793 197.426 232.972 1.00 0.00 C +ATOM 3 CA GLN A 3 266.491 197.422 232.056 1.00 0.00 C +ATOM 4 CA PRO A 4 268.539 196.533 235.144 1.00 0.00 C +ATOM 5 CA ALA A 5 268.616 196.147 238.934 1.00 0.00 C +ATOM 6 CA HIS A 6 266.744 198.115 241.606 1.00 0.00 C +ATOM 7 CA GLN A 7 264.617 201.021 242.849 1.00 0.00 C +ATOM 8 CA ASP A 8 266.436 202.987 245.559 1.00 0.00 C +ATOM 9 CA ARG A 9 267.824 206.223 247.013 1.00 0.00 C +ATOM 10 CA GLY A 10 270.574 207.200 249.463 1.00 0.00 C +ATOM 11 CA MET A 11 273.300 209.831 249.864 1.00 0.00 C +ATOM 12 CA PHE A 12 274.230 211.881 246.790 1.00 0.00 C +ATOM 13 CA GLY A 13 276.191 210.071 244.071 1.00 0.00 C +ATOM 14 CA LYS A 14 276.920 212.297 241.065 1.00 0.00 C +ATOM 15 CA LYS A 15 276.199 216.037 241.021 1.00 0.00 C +ATOM 16 CA LYS A 16 274.511 219.425 240.581 1.00 0.00 C +ATOM 17 CA GLU A 17 271.517 221.227 239.062 1.00 0.00 C +ATOM 18 CA ASP A 18 269.509 223.442 241.423 1.00 0.00 C +ATOM 19 CA GLU A 19 265.806 223.824 240.613 1.00 0.00 C +ATOM 20 CA GLY A 20 263.079 221.426 241.764 1.00 0.00 C +ATOM 21 CA ARG A 21 261.971 219.940 245.093 1.00 0.00 C +ATOM 22 CA GLN A 22 258.911 219.632 247.342 1.00 0.00 C +ATOM 23 CA CYS A 23 255.901 219.961 245.029 1.00 0.00 C +ATOM 24 CA ASP A 24 252.892 219.688 242.707 1.00 0.00 C +ATOM 25 CA GLN A 25 250.344 222.463 243.278 1.00 0.00 C +ATOM 26 CA THR A 26 248.575 224.401 246.039 1.00 0.00 C +ATOM 27 CA GLU A 27 249.297 224.403 249.780 1.00 0.00 C +ATOM 28 CA GLY A 28 248.966 227.493 251.985 1.00 0.00 C +ATOM 29 CA GLY A 29 248.995 230.421 254.422 1.00 0.00 C +ATOM 30 CA ARG A 30 245.468 231.829 254.726 1.00 0.00 C +ATOM 31 CA CYS A 31 244.132 235.246 253.700 1.00 0.00 C +ATOM 32 CA GLU A 32 240.512 235.765 254.769 1.00 0.00 C +ATOM 33 CA GLU A 33 238.502 238.198 252.635 1.00 0.00 C +ATOM 34 CA GLY A 34 234.918 239.275 253.351 1.00 0.00 C +ATOM 35 CA LYS A 35 232.145 241.079 251.461 1.00 0.00 C +ATOM 36 CA LYS A 36 233.251 244.377 249.907 1.00 0.00 C +ATOM 37 CA PRO A 37 234.499 245.840 246.618 1.00 0.00 C +ATOM 38 CA GLY A 38 237.274 248.435 246.330 1.00 0.00 C +ATOM 39 CA MET A 39 237.418 251.596 248.451 1.00 0.00 C +ATOM 40 CA VAL A 40 239.595 254.027 250.418 1.00 0.00 C +ATOM 41 CA ASP A 41 242.907 255.072 248.851 1.00 0.00 C +ATOM 42 CA LYS A 42 245.232 253.814 246.108 1.00 0.00 C +ATOM 43 CA ILE A 43 245.692 253.252 242.368 1.00 0.00 C +ATOM 44 CA LYS A 44 243.674 253.695 239.167 1.00 0.00 C +ATOM 45 CA GLU A 45 244.214 251.702 235.965 1.00 0.00 C +ATOM 46 CA LYS A 46 240.942 251.659 234.014 1.00 0.00 C +ATOM 47 CA ILE A 47 237.921 249.442 233.326 1.00 0.00 C +ATOM 48 CA PRO A 48 235.293 247.120 234.816 1.00 0.00 C +ATOM 49 CA GLY A 49 234.117 247.708 238.391 1.00 0.00 C +ATOM 50 CA GLN A 50 233.939 250.278 241.198 1.00 0.00 C +ATOM 51 CA GLN A 51 235.740 253.623 240.921 1.00 0.00 C +ATOM 52 CA GLN A 52 234.601 256.558 238.774 1.00 0.00 C +ATOM 53 CA LYS A 53 234.848 259.322 236.164 1.00 0.00 C +ATOM 54 CA LEU A 54 237.508 261.722 234.866 1.00 0.00 C +ATOM 55 CA PRO A 55 241.297 262.116 234.921 1.00 0.00 C +ATOM 56 CA GLY A 56 244.345 264.398 234.783 1.00 0.00 C +ATOM 57 CA ASP A 57 247.303 264.242 237.180 1.00 0.00 C +ATOM 58 CA GLY A 58 249.574 264.369 240.237 1.00 0.00 C +ATOM 59 CA LYS A 59 251.643 266.384 242.722 1.00 0.00 C +ATOM 60 CA GLN A 60 252.719 269.599 244.459 1.00 0.00 C +ATOM 61 CA CYS A 61 250.192 272.262 245.476 1.00 0.00 C +ATOM 62 CA GLY A 62 248.006 275.334 244.922 1.00 0.00 C +ATOM 63 CA GLY A 63 244.211 275.634 244.774 1.00 0.00 C +ATOM 64 CA GLN A 64 241.803 275.987 247.706 1.00 0.00 C +ATOM 65 CA PRO A 65 241.511 277.567 251.160 1.00 0.00 C +ATOM 66 CA GLY A 66 238.856 280.276 251.523 1.00 0.00 C +ATOM 67 CA ARG A 67 236.897 281.022 254.704 1.00 0.00 C +ATOM 68 CA GLU A 68 235.149 277.993 256.216 1.00 0.00 C +ATOM 69 CA GLU A 69 232.336 276.546 254.093 1.00 0.00 C +ATOM 70 CA GLU A 70 231.511 272.989 253.007 1.00 0.00 C +ATOM 71 CA LYS A 71 234.321 270.428 253.262 1.00 0.00 C +ATOM 72 CA LYS A 72 237.733 269.103 254.317 1.00 0.00 C +ATOM 73 CA PRO A 73 239.055 269.904 257.799 1.00 0.00 C +ATOM 74 CA GLY A 74 242.603 269.924 259.188 1.00 0.00 C +ATOM 75 CA MET A 75 245.048 270.442 262.064 1.00 0.00 C +ATOM 76 CA VAL A 76 247.904 270.914 264.541 1.00 0.00 C +ATOM 77 CA ASP A 77 247.259 270.583 268.281 1.00 0.00 C +ATOM 78 CA LYS A 78 249.203 271.221 271.495 1.00 0.00 C +ATOM 79 CA ILE A 79 252.780 270.911 272.770 1.00 0.00 C +ATOM 80 CA LYS A 80 253.704 273.405 275.498 1.00 0.00 C +ATOM 81 CA GLN A 81 255.098 276.848 276.345 1.00 0.00 C +ATOM 82 CA LYS A 82 257.062 279.757 274.863 1.00 0.00 C +ATOM 83 CA LEU A 83 255.892 283.352 274.386 1.00 0.00 C +ATOM 84 CA PRO A 84 256.288 287.005 273.379 1.00 0.00 C +ATOM 85 CA GLY A 85 254.178 290.176 273.453 1.00 0.00 C +ATOM 86 CA GLN A 86 251.376 291.370 271.163 1.00 0.00 C +ATOM 87 CA GLN A 87 250.052 294.935 270.933 1.00 0.00 C +ATOM 88 CA ASN A 88 252.049 298.124 271.531 1.00 0.00 C +ATOM 89 CA LYS A 89 250.505 301.492 270.642 1.00 0.00 C +ATOM 90 CA ASN A 90 251.525 303.064 267.324 1.00 0.00 C +ATOM 91 CA ASP A 91 252.866 301.550 264.095 1.00 0.00 C +ATOM 92 CA VAL A 92 251.895 297.869 263.958 1.00 0.00 C +ATOM 93 CA GLU A 93 249.211 295.177 263.698 1.00 0.00 C +TER 94 GLU A 93 +END diff --git a/Plants/Q8H0M8/Q8H0M8.dcd b/Plants/Q8H0M8/Q8H0M8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..b78c18c4841fe91d5b35807939a142470e410604 --- /dev/null +++ b/Plants/Q8H0M8/Q8H0M8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c32a81ff0b5a8280b2c167607b2efb1b8703052f64e004196be767f964938274 +size 13880276 diff --git a/Plants/Q8H0M8/top.pdb b/Plants/Q8H0M8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..d05bf23c2b5af67b7808e462021f3ea93bb21cd5 --- /dev/null +++ b/Plants/Q8H0M8/top.pdb @@ -0,0 +1,113 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA GLY A 1 245.232 223.531 229.903 1.00 0.00 C +ATOM 2 CA HIS A 2 246.290 227.042 230.936 1.00 0.00 C +ATOM 3 CA GLY A 3 248.558 228.198 228.102 1.00 0.00 C +ATOM 4 CA HIS A 4 250.979 227.485 225.247 1.00 0.00 C +ATOM 5 CA GLU A 5 254.747 226.922 225.229 1.00 0.00 C +ATOM 6 CA GLY A 6 257.111 228.758 227.586 1.00 0.00 C +ATOM 7 CA GLN A 7 259.663 231.107 229.162 1.00 0.00 C +ATOM 8 CA PHE A 8 261.716 233.301 231.505 1.00 0.00 C +ATOM 9 CA ALA A 9 259.222 235.282 233.596 1.00 0.00 C +ATOM 10 CA ARG A 10 260.645 237.209 236.559 1.00 0.00 C +ATOM 11 CA GLU A 11 257.964 238.502 238.938 1.00 0.00 C +ATOM 12 CA GLU A 12 256.413 235.373 240.462 1.00 0.00 C +ATOM 13 CA ALA A 13 257.027 234.885 244.190 1.00 0.00 C +ATOM 14 CA GLU A 14 260.584 235.612 245.346 1.00 0.00 C +ATOM 15 CA GLN A 15 262.280 238.953 244.655 1.00 0.00 C +ATOM 16 CA GLN A 16 264.601 241.865 245.463 1.00 0.00 C +ATOM 17 CA LYS A 17 264.931 245.106 247.439 1.00 0.00 C +ATOM 18 CA HIS A 18 266.463 248.076 245.610 1.00 0.00 C +ATOM 19 CA THR A 19 268.645 251.196 245.461 1.00 0.00 C +ATOM 20 CA GLY A 20 272.343 250.283 245.371 1.00 0.00 C +ATOM 21 CA LYS A 21 272.754 247.321 247.732 1.00 0.00 C +ATOM 22 CA LEU A 22 273.831 247.636 251.373 1.00 0.00 C +ATOM 23 CA HIS A 23 273.684 244.215 253.043 1.00 0.00 C +ATOM 24 CA ARG A 24 270.650 243.438 255.213 1.00 0.00 C +ATOM 25 CA SER A 25 266.965 244.125 255.896 1.00 0.00 C +ATOM 26 CA ASN A 26 265.080 244.983 259.094 1.00 0.00 C +ATOM 27 CA SER A 27 263.553 248.326 260.100 1.00 0.00 C +ATOM 28 CA SER A 28 261.713 249.231 263.311 1.00 0.00 C +ATOM 29 CA SER A 29 258.999 246.574 263.617 1.00 0.00 C +ATOM 30 CA SER A 30 257.137 243.757 265.382 1.00 0.00 C +ATOM 31 CA SER A 31 258.838 240.410 264.734 1.00 0.00 C +ATOM 32 CA SER A 32 256.349 238.410 262.656 1.00 0.00 C +ATOM 33 CA SER A 33 253.630 236.189 264.137 1.00 0.00 C +ATOM 34 CA SER A 34 250.112 235.014 263.265 1.00 0.00 C +ATOM 35 CA ASP A 35 247.598 236.019 260.586 1.00 0.00 C +ATOM 36 CA GLU A 36 247.195 233.087 258.186 1.00 0.00 C +ATOM 37 CA GLU A 37 244.422 232.419 255.659 1.00 0.00 C +ATOM 38 CA GLU A 38 240.921 231.221 254.753 1.00 0.00 C +ATOM 39 CA GLU A 39 238.140 233.352 256.251 1.00 0.00 C +ATOM 40 CA GLY A 40 239.478 235.729 258.911 1.00 0.00 C +ATOM 41 CA ARG A 41 239.354 239.530 258.685 1.00 0.00 C +ATOM 42 CA LYS A 42 241.352 241.217 261.456 1.00 0.00 C +ATOM 43 CA LYS A 43 241.104 243.500 264.496 1.00 0.00 C +ATOM 44 CA LYS A 44 238.455 245.800 265.982 1.00 0.00 C +ATOM 45 CA GLU A 45 234.742 245.470 266.768 1.00 0.00 C +ATOM 46 CA GLY A 46 231.170 244.791 267.908 1.00 0.00 C +ATOM 47 CA GLY A 47 227.743 245.379 266.350 1.00 0.00 C +ATOM 48 CA ARG A 48 224.867 247.477 267.707 1.00 0.00 C +ATOM 49 CA LYS A 49 225.365 250.463 270.021 1.00 0.00 C +ATOM 50 CA LYS A 50 224.226 253.693 268.352 1.00 0.00 C +ATOM 51 CA LYS A 51 224.440 256.631 265.935 1.00 0.00 C +ATOM 52 CA GLY A 52 223.858 259.570 263.582 1.00 0.00 C +ATOM 53 CA SER A 53 221.218 261.745 265.259 1.00 0.00 C +ATOM 54 CA LYS A 54 221.406 265.551 265.232 1.00 0.00 C +ATOM 55 CA ASP A 55 220.394 269.174 264.627 1.00 0.00 C +ATOM 56 CA LYS A 56 216.587 269.225 264.491 1.00 0.00 C +ATOM 57 CA THR A 57 215.059 269.884 261.063 1.00 0.00 C +ATOM 58 CA LYS A 58 216.995 268.891 257.936 1.00 0.00 C +ATOM 59 CA GLU A 59 220.634 268.392 256.923 1.00 0.00 C +ATOM 60 CA LYS A 60 223.051 265.502 257.494 1.00 0.00 C +ATOM 61 CA LEU A 61 222.303 261.778 257.787 1.00 0.00 C +ATOM 62 CA PRO A 62 222.089 257.979 257.982 1.00 0.00 C +ATOM 63 CA GLY A 63 222.362 255.424 255.168 1.00 0.00 C +ATOM 64 CA ASP A 64 224.167 255.799 251.834 1.00 0.00 C +ATOM 65 CA GLY A 65 222.658 256.564 248.420 1.00 0.00 C +ATOM 66 CA LYS A 66 219.915 258.342 246.463 1.00 0.00 C +ATOM 67 CA GLN A 67 218.820 258.353 242.814 1.00 0.00 C +ATOM 68 CA TYR A 68 218.187 258.064 239.068 1.00 0.00 C +ATOM 69 CA PRO A 69 216.629 256.481 235.973 1.00 0.00 C +ATOM 70 CA GLY A 70 213.389 255.252 234.389 1.00 0.00 C +ATOM 71 CA GLU A 71 214.181 251.892 232.776 1.00 0.00 C +ATOM 72 CA HIS A 72 216.656 249.172 233.772 1.00 0.00 C +ATOM 73 CA GLU A 73 218.999 248.756 236.748 1.00 0.00 C +ATOM 74 CA LYS A 74 219.596 249.298 240.472 1.00 0.00 C +ATOM 75 CA GLN A 75 223.144 248.227 241.353 1.00 0.00 C +ATOM 76 CA TYR A 76 224.807 250.488 243.929 1.00 0.00 C +ATOM 77 CA SER A 77 227.823 252.814 244.036 1.00 0.00 C +ATOM 78 CA ARG A 78 231.514 253.549 243.440 1.00 0.00 C +ATOM 79 CA GLN A 79 234.407 256.003 243.093 1.00 0.00 C +ATOM 80 CA HIS A 80 237.758 255.040 244.629 1.00 0.00 C +ATOM 81 CA GLY A 81 241.499 254.421 245.004 1.00 0.00 C +ATOM 82 CA GLY A 82 243.783 251.603 246.168 1.00 0.00 C +ATOM 83 CA GLU A 83 247.505 252.061 246.847 1.00 0.00 C +ATOM 84 CA GLU A 84 250.759 252.520 248.774 1.00 0.00 C +ATOM 85 CA GLU A 85 252.963 255.611 248.454 1.00 0.00 C +ATOM 86 CA LYS A 86 255.841 257.911 247.483 1.00 0.00 C +ATOM 87 CA LYS A 87 257.407 260.664 245.365 1.00 0.00 C +ATOM 88 CA ALA A 88 259.321 263.096 243.143 1.00 0.00 C +ATOM 89 CA GLY A 89 260.661 261.066 240.210 1.00 0.00 C +ATOM 90 CA MET A 90 264.445 261.324 240.568 1.00 0.00 C +ATOM 91 CA LEU A 91 267.995 260.083 241.181 1.00 0.00 C +ATOM 92 CA ASP A 92 271.584 260.086 239.903 1.00 0.00 C +ATOM 93 CA LYS A 93 274.849 261.279 241.463 1.00 0.00 C +ATOM 94 CA ILE A 94 278.284 261.688 239.866 1.00 0.00 C +ATOM 95 CA LYS A 95 281.602 261.997 241.714 1.00 0.00 C +ATOM 96 CA ALA A 96 284.937 261.304 243.420 1.00 0.00 C +ATOM 97 CA LYS A 97 286.580 258.213 244.924 1.00 0.00 C +ATOM 98 CA LEU A 98 285.944 255.950 247.923 1.00 0.00 C +ATOM 99 CA PRO A 99 289.256 255.400 249.722 1.00 0.00 C +ATOM 100 CA GLY A 100 292.020 257.112 247.736 1.00 0.00 C +ATOM 101 CA GLN A 101 293.645 260.559 247.739 1.00 0.00 C +ATOM 102 CA HIS A 102 292.274 263.914 248.914 1.00 0.00 C +ATOM 103 CA ASN A 103 292.822 266.916 251.195 1.00 0.00 C +ATOM 104 CA LYS A 104 293.058 266.500 254.975 1.00 0.00 C +ATOM 105 CA ASN A 105 290.477 264.305 256.718 1.00 0.00 C +ATOM 106 CA ASP A 106 287.693 262.283 258.353 1.00 0.00 C +ATOM 107 CA GLY A 107 284.412 260.389 258.754 1.00 0.00 C +ATOM 108 CA GLU A 108 284.210 256.710 257.782 1.00 0.00 C +ATOM 109 CA GLN A 109 286.286 253.731 256.629 1.00 0.00 C +TER 110 GLN A 109 +END diff --git a/Plants/Q8H1U3/Q8H1U3.dcd b/Plants/Q8H1U3/Q8H1U3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..b9a0c92429ed4a6846d63c39345c24499c86bc5a --- /dev/null +++ b/Plants/Q8H1U3/Q8H1U3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:7c3835a723e8fc3c99b123ba59456e49e8d1e441fa78d01fe6764c37a296e12b +size 8600276 diff --git a/Plants/Q8H1U3/top.pdb b/Plants/Q8H1U3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..9cb740e08a45bf7b1786918f8b05c04b476516d0 --- /dev/null +++ b/Plants/Q8H1U3/top.pdb @@ -0,0 +1,69 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 249.254 266.535 204.224 1.00 0.00 C +ATOM 2 CA LEU A 2 250.961 269.051 206.520 1.00 0.00 C +ATOM 3 CA ARG A 3 251.787 272.381 208.177 1.00 0.00 C +ATOM 4 CA ARG A 4 252.493 273.946 211.579 1.00 0.00 C +ATOM 5 CA LYS A 5 255.545 272.572 213.398 1.00 0.00 C +ATOM 6 CA PRO A 6 258.873 270.735 213.660 1.00 0.00 C +ATOM 7 CA THR A 7 261.642 269.795 216.102 1.00 0.00 C +ATOM 8 CA LYS A 8 260.715 266.618 217.991 1.00 0.00 C +ATOM 9 CA ILE A 9 260.258 263.265 216.240 1.00 0.00 C +ATOM 10 CA GLN A 10 257.292 260.976 216.931 1.00 0.00 C +ATOM 11 CA LEU A 11 254.077 261.291 218.951 1.00 0.00 C +ATOM 12 CA LYS A 12 252.737 259.225 221.858 1.00 0.00 C +ATOM 13 CA ILE A 13 254.576 256.901 224.253 1.00 0.00 C +ATOM 14 CA GLU A 14 253.997 255.923 227.889 1.00 0.00 C +ATOM 15 CA ASP A 15 254.377 252.562 229.644 1.00 0.00 C +ATOM 16 CA ARG A 16 256.913 250.445 231.542 1.00 0.00 C +ATOM 17 CA GLU A 17 258.203 251.228 235.041 1.00 0.00 C +ATOM 18 CA GLU A 18 255.714 252.747 237.493 1.00 0.00 C +ATOM 19 CA LEU A 19 253.084 251.736 240.058 1.00 0.00 C +ATOM 20 CA GLU A 20 252.013 249.253 242.742 1.00 0.00 C +ATOM 21 CA GLN A 21 248.558 250.470 243.794 1.00 0.00 C +ATOM 22 CA SER A 22 246.112 253.389 243.881 1.00 0.00 C +ATOM 23 CA ARG A 23 243.176 252.499 246.141 1.00 0.00 C +ATOM 24 CA LYS A 24 240.711 254.424 248.316 1.00 0.00 C +ATOM 25 CA SER A 25 236.907 254.238 248.245 1.00 0.00 C +ATOM 26 CA GLN A 26 233.199 253.582 248.827 1.00 0.00 C +ATOM 27 CA PRO A 27 229.512 253.279 249.737 1.00 0.00 C +ATOM 28 CA SER A 28 227.442 250.298 250.900 1.00 0.00 C +ATOM 29 CA THR A 29 227.411 246.507 250.526 1.00 0.00 C +ATOM 30 CA THR A 30 229.173 244.054 252.849 1.00 0.00 C +ATOM 31 CA THR A 31 231.102 241.773 255.214 1.00 0.00 C +ATOM 32 CA THR A 32 232.289 242.125 258.816 1.00 0.00 C +ATOM 33 CA THR A 33 231.109 242.278 262.436 1.00 0.00 C +ATOM 34 CA ALA A 34 229.021 245.115 263.887 1.00 0.00 C +ATOM 35 CA PRO A 35 227.203 248.291 262.824 1.00 0.00 C +ATOM 36 CA SER A 36 228.256 251.885 263.526 1.00 0.00 C +ATOM 37 CA SER A 37 231.989 252.636 263.396 1.00 0.00 C +ATOM 38 CA SER A 38 234.592 253.159 260.664 1.00 0.00 C +ATOM 39 CA SER A 39 235.954 250.945 257.878 1.00 0.00 C +ATOM 40 CA ALA A 40 238.604 248.254 258.376 1.00 0.00 C +ATOM 41 CA ALA A 41 242.358 247.697 258.720 1.00 0.00 C +ATOM 42 CA SER A 42 245.957 246.792 259.579 1.00 0.00 C +ATOM 43 CA SER A 43 248.819 245.274 257.573 1.00 0.00 C +ATOM 44 CA LEU A 44 249.432 247.460 254.513 1.00 0.00 C +ATOM 45 CA HIS A 45 252.516 249.527 253.658 1.00 0.00 C +ATOM 46 CA HIS A 46 255.350 248.928 256.133 1.00 0.00 C +ATOM 47 CA LEU A 47 258.559 249.624 258.065 1.00 0.00 C +ATOM 48 CA ILE A 48 259.142 249.158 261.802 1.00 0.00 C +ATOM 49 CA ASP A 49 262.829 248.650 262.613 1.00 0.00 C +ATOM 50 CA PRO A 50 264.949 249.442 265.678 1.00 0.00 C +ATOM 51 CA LYS A 51 263.637 247.969 268.938 1.00 0.00 C +ATOM 52 CA HIS A 52 262.545 244.818 270.779 1.00 0.00 C +ATOM 53 CA LYS A 53 262.059 243.729 274.398 1.00 0.00 C +ATOM 54 CA ASN A 54 259.205 245.142 276.490 1.00 0.00 C +ATOM 55 CA PRO A 55 255.699 243.693 276.843 1.00 0.00 C +ATOM 56 CA SER A 56 255.515 240.511 274.755 1.00 0.00 C +ATOM 57 CA SER A 57 254.213 237.294 276.326 1.00 0.00 C +ATOM 58 CA LYS A 58 254.022 235.541 279.704 1.00 0.00 C +ATOM 59 CA SER A 59 257.128 233.787 281.042 1.00 0.00 C +ATOM 60 CA ASP A 60 260.046 231.935 279.439 1.00 0.00 C +ATOM 61 CA ARG A 61 263.670 232.886 278.747 1.00 0.00 C +ATOM 62 CA ILE A 62 265.809 231.471 275.930 1.00 0.00 C +ATOM 63 CA GLY A 63 268.270 229.978 273.433 1.00 0.00 C +ATOM 64 CA LEU A 64 269.385 226.355 273.817 1.00 0.00 C +ATOM 65 CA SER A 65 272.058 225.955 276.503 1.00 0.00 C +TER 66 SER A 65 +END diff --git a/Plants/Q8H2Q4/Q8H2Q4.dcd b/Plants/Q8H2Q4/Q8H2Q4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..b68902713f50ecba85904a2827e8dcfc28913b88 --- /dev/null +++ b/Plants/Q8H2Q4/Q8H2Q4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f7a4afa85db2639c4c9de2faaee5ca8b0cc801d12758a4aaadbd916f1a1aa1d7 +size 11360276 diff --git a/Plants/Q8H2Q4/top.pdb b/Plants/Q8H2Q4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..e8ed4970b9bc18cd4584af854cbea165520ac1dc --- /dev/null +++ b/Plants/Q8H2Q4/top.pdb @@ -0,0 +1,92 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 229.866 252.594 252.305 1.00 0.00 C +ATOM 2 CA ILE A 2 229.369 248.818 252.212 1.00 0.00 C +ATOM 3 CA GLU A 3 231.275 245.570 252.794 1.00 0.00 C +ATOM 4 CA ARG A 4 234.765 244.348 253.710 1.00 0.00 C +ATOM 5 CA ALA A 5 235.519 242.348 256.864 1.00 0.00 C +ATOM 6 CA GLU A 6 234.664 240.535 260.104 1.00 0.00 C +ATOM 7 CA VAL A 7 236.584 239.938 263.341 1.00 0.00 C +ATOM 8 CA ARG A 8 237.146 241.462 266.787 1.00 0.00 C +ATOM 9 CA GLY A 9 237.055 244.584 268.968 1.00 0.00 C +ATOM 10 CA ALA A 10 239.286 247.084 270.783 1.00 0.00 C +ATOM 11 CA GLY A 11 241.297 249.498 268.627 1.00 0.00 C +ATOM 12 CA ALA A 12 238.839 252.149 267.424 1.00 0.00 C +ATOM 13 CA ARG A 13 235.098 251.982 266.720 1.00 0.00 C +ATOM 14 CA ARG A 14 231.308 251.592 266.770 1.00 0.00 C +ATOM 15 CA ALA A 15 227.792 250.556 267.807 1.00 0.00 C +ATOM 16 CA ALA A 16 225.661 248.409 265.491 1.00 0.00 C +ATOM 17 CA THR A 17 226.121 249.388 261.838 1.00 0.00 C +ATOM 18 CA ALA A 18 229.110 248.611 259.606 1.00 0.00 C +ATOM 19 CA ASP A 19 232.862 249.129 259.194 1.00 0.00 C +ATOM 20 CA THR A 20 234.540 252.423 258.272 1.00 0.00 C +ATOM 21 CA ARG A 21 236.576 255.136 256.537 1.00 0.00 C +ATOM 22 CA ARG A 22 239.390 253.519 254.541 1.00 0.00 C +ATOM 23 CA ALA A 23 242.539 251.431 255.032 1.00 0.00 C +ATOM 24 CA ALA A 24 243.056 247.765 254.132 1.00 0.00 C +ATOM 25 CA ALA A 25 242.058 244.897 251.831 1.00 0.00 C +ATOM 26 CA GLY A 26 242.372 241.382 253.265 1.00 0.00 C +ATOM 27 CA VAL A 27 243.761 238.694 250.950 1.00 0.00 C +ATOM 28 CA ARG A 28 243.376 239.442 247.234 1.00 0.00 C +ATOM 29 CA ARG A 29 241.986 239.281 243.690 1.00 0.00 C +ATOM 30 CA ALA A 30 242.767 241.854 240.991 1.00 0.00 C +ATOM 31 CA ALA A 31 245.771 241.063 238.786 1.00 0.00 C +ATOM 32 CA ALA A 32 246.339 239.991 235.174 1.00 0.00 C +ATOM 33 CA GLY A 33 246.453 240.094 231.367 1.00 0.00 C +ATOM 34 CA ALA A 34 245.839 243.474 229.719 1.00 0.00 C +ATOM 35 CA GLN A 35 246.858 247.137 229.480 1.00 0.00 C +ATOM 36 CA ARG A 36 246.238 250.272 231.555 1.00 0.00 C +ATOM 37 CA LEU A 37 247.610 249.951 235.095 1.00 0.00 C +ATOM 38 CA ARG A 38 247.654 253.186 237.107 1.00 0.00 C +ATOM 39 CA PRO A 39 244.537 254.624 238.759 1.00 0.00 C +ATOM 40 CA ALA A 40 243.663 254.658 242.467 1.00 0.00 C +ATOM 41 CA GLY A 41 241.750 252.007 244.424 1.00 0.00 C +ATOM 42 CA PRO A 42 238.025 251.556 243.764 1.00 0.00 C +ATOM 43 CA SER A 43 236.403 254.651 245.282 1.00 0.00 C +ATOM 44 CA HIS A 44 237.741 257.600 243.274 1.00 0.00 C +ATOM 45 CA GLU A 45 238.027 259.730 240.128 1.00 0.00 C +ATOM 46 CA GLU A 46 240.300 262.788 240.108 1.00 0.00 C +ATOM 47 CA GLY A 47 243.258 263.493 237.813 1.00 0.00 C +ATOM 48 CA SER A 48 246.598 264.272 236.153 1.00 0.00 C +ATOM 49 CA ARG A 49 249.850 265.535 237.683 1.00 0.00 C +ATOM 50 CA GLY A 50 252.098 267.264 240.227 1.00 0.00 C +ATOM 51 CA GLY A 51 255.324 265.344 240.878 1.00 0.00 C +ATOM 52 CA ALA A 52 258.917 266.314 241.693 1.00 0.00 C +ATOM 53 CA SER A 53 259.905 267.107 245.286 1.00 0.00 C +ATOM 54 CA GLY A 54 257.676 266.738 248.354 1.00 0.00 C +ATOM 55 CA ARG A 55 255.941 263.349 248.208 1.00 0.00 C +ATOM 56 CA ALA A 56 254.434 260.308 246.475 1.00 0.00 C +ATOM 57 CA PRO A 57 253.856 257.974 243.520 1.00 0.00 C +ATOM 58 CA ALA A 58 251.873 254.864 242.566 1.00 0.00 C +ATOM 59 CA ALA A 59 251.713 251.086 243.034 1.00 0.00 C +ATOM 60 CA GLU A 60 248.074 249.956 243.009 1.00 0.00 C +ATOM 61 CA ALA A 61 247.029 249.674 246.662 1.00 0.00 C +ATOM 62 CA VAL A 62 249.376 248.062 249.193 1.00 0.00 C +ATOM 63 CA GLY A 63 248.926 249.751 252.579 1.00 0.00 C +ATOM 64 CA GLY A 64 249.841 248.918 256.182 1.00 0.00 C +ATOM 65 CA ALA A 65 252.428 246.684 257.865 1.00 0.00 C +ATOM 66 CA PHE A 66 253.621 243.637 259.818 1.00 0.00 C +ATOM 67 CA PRO A 67 257.336 242.818 259.611 1.00 0.00 C +ATOM 68 CA ARG A 68 261.050 243.409 260.219 1.00 0.00 C +ATOM 69 CA ARG A 69 264.579 243.831 261.592 1.00 0.00 C +ATOM 70 CA ARG A 70 266.805 244.269 258.532 1.00 0.00 C +ATOM 71 CA ARG A 71 267.420 247.368 256.403 1.00 0.00 C +ATOM 72 CA SER A 72 267.234 246.959 252.620 1.00 0.00 C +ATOM 73 CA PRO A 73 268.186 245.713 249.147 1.00 0.00 C +ATOM 74 CA ARG A 74 266.244 243.186 247.059 1.00 0.00 C +ATOM 75 CA GLN A 75 267.481 239.821 245.769 1.00 0.00 C +ATOM 76 CA LEU A 76 270.587 237.766 246.574 1.00 0.00 C +ATOM 77 CA GLY A 77 273.885 239.620 247.019 1.00 0.00 C +ATOM 78 CA GLY A 78 276.499 239.965 244.269 1.00 0.00 C +ATOM 79 CA ARG A 79 275.506 241.682 241.015 1.00 0.00 C +ATOM 80 CA PRO A 80 276.347 245.398 240.970 1.00 0.00 C +ATOM 81 CA ALA A 81 277.946 246.545 244.232 1.00 0.00 C +ATOM 82 CA ARG A 82 278.866 248.248 247.514 1.00 0.00 C +ATOM 83 CA ARG A 83 279.501 251.706 248.983 1.00 0.00 C +ATOM 84 CA ARG A 84 278.127 253.197 252.208 1.00 0.00 C +ATOM 85 CA THR A 85 279.353 254.305 255.642 1.00 0.00 C +ATOM 86 CA ALA A 86 278.995 257.921 256.786 1.00 0.00 C +ATOM 87 CA GLY A 87 275.344 258.803 257.425 1.00 0.00 C +ATOM 88 CA ALA A 88 272.726 259.945 254.903 1.00 0.00 C +TER 89 ALA A 88 +END diff --git a/Plants/Q8H303/Q8H303.dcd b/Plants/Q8H303/Q8H303.dcd new file mode 100644 index 0000000000000000000000000000000000000000..1057416e2eaa764fbcd07a1cdb89359a15104fd8 --- /dev/null +++ b/Plants/Q8H303/Q8H303.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:02f097c93e5ffb060e16025a10a8a9fcf62febfe5563a841221769b580007f1b +size 22760276 diff --git a/Plants/Q8H303/top.pdb b/Plants/Q8H303/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..7ef50566ab2550efc77e11cc39659a6a1d79c984 --- /dev/null +++ b/Plants/Q8H303/top.pdb @@ -0,0 +1,187 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 226.417 269.604 245.583 1.00 0.00 C +ATOM 2 CA THR A 2 223.169 270.467 243.788 1.00 0.00 C +ATOM 3 CA SER A 3 220.058 272.604 244.311 1.00 0.00 C +ATOM 4 CA ALA A 4 217.247 270.934 246.266 1.00 0.00 C +ATOM 5 CA VAL A 5 214.218 269.207 244.731 1.00 0.00 C +ATOM 6 CA THR A 6 212.447 266.091 246.025 1.00 0.00 C +ATOM 7 CA SER A 7 212.569 262.395 245.109 1.00 0.00 C +ATOM 8 CA PRO A 8 211.351 259.033 246.425 1.00 0.00 C +ATOM 9 CA PRO A 9 210.620 257.820 249.962 1.00 0.00 C +ATOM 10 CA ALA A 10 208.410 257.946 253.063 1.00 0.00 C +ATOM 11 CA ALA A 11 206.795 258.006 256.513 1.00 0.00 C +ATOM 12 CA ALA A 12 208.692 256.922 259.635 1.00 0.00 C +ATOM 13 CA ARG A 13 212.098 255.360 258.945 1.00 0.00 C +ATOM 14 CA ALA A 14 215.514 254.792 257.356 1.00 0.00 C +ATOM 15 CA ARG A 15 216.818 251.399 258.496 1.00 0.00 C +ATOM 16 CA LYS A 16 217.728 248.345 256.408 1.00 0.00 C +ATOM 17 CA LEU A 17 221.291 248.720 255.111 1.00 0.00 C +ATOM 18 CA ALA A 18 225.001 249.386 255.670 1.00 0.00 C +ATOM 19 CA GLY A 19 226.452 252.345 253.758 1.00 0.00 C +ATOM 20 CA GLU A 20 226.578 255.953 252.542 1.00 0.00 C +ATOM 21 CA GLN A 21 226.402 258.218 255.601 1.00 0.00 C +ATOM 22 CA ARG A 22 225.473 261.911 255.700 1.00 0.00 C +ATOM 23 CA ARG A 23 222.229 263.896 255.469 1.00 0.00 C +ATOM 24 CA GLU A 24 218.760 264.610 254.067 1.00 0.00 C +ATOM 25 CA ASP A 25 216.533 262.974 251.444 1.00 0.00 C +ATOM 26 CA ALA A 26 217.563 259.600 250.005 1.00 0.00 C +ATOM 27 CA ASN A 27 220.405 257.063 249.952 1.00 0.00 C +ATOM 28 CA GLY A 28 219.809 254.772 246.967 1.00 0.00 C +ATOM 29 CA GLY A 29 219.779 253.577 243.349 1.00 0.00 C +ATOM 30 CA HIS A 30 221.296 255.809 240.660 1.00 0.00 C +ATOM 31 CA GLN A 31 224.536 255.475 238.684 1.00 0.00 C +ATOM 32 CA HIS A 32 226.881 256.272 235.788 1.00 0.00 C +ATOM 33 CA ARG A 33 229.904 254.318 234.540 1.00 0.00 C +ATOM 34 CA TRP A 34 230.283 250.630 233.662 1.00 0.00 C +ATOM 35 CA ARG A 35 230.610 248.006 230.919 1.00 0.00 C +ATOM 36 CA ARG A 36 233.253 245.799 229.289 1.00 0.00 C +ATOM 37 CA GLY A 37 236.164 243.452 230.020 1.00 0.00 C +ATOM 38 CA GLY A 38 235.131 240.091 231.487 1.00 0.00 C +ATOM 39 CA ARG A 39 237.650 237.890 233.310 1.00 0.00 C +ATOM 40 CA GLY A 40 240.086 234.983 233.674 1.00 0.00 C +ATOM 41 CA ARG A 41 243.171 235.360 231.469 1.00 0.00 C +ATOM 42 CA ARG A 42 243.388 233.580 228.108 1.00 0.00 C +ATOM 43 CA ARG A 43 241.442 230.312 227.886 1.00 0.00 C +ATOM 44 CA ASP A 44 238.104 228.504 228.209 1.00 0.00 C +ATOM 45 CA GLY A 45 234.752 230.062 227.286 1.00 0.00 C +ATOM 46 CA ASP A 46 232.611 232.792 225.713 1.00 0.00 C +ATOM 47 CA HIS A 47 230.608 235.630 224.147 1.00 0.00 C +ATOM 48 CA ASP A 48 233.007 238.589 224.124 1.00 0.00 C +ATOM 49 CA GLY A 49 232.353 242.336 223.893 1.00 0.00 C +ATOM 50 CA GLY A 50 230.148 245.442 223.900 1.00 0.00 C +ATOM 51 CA LEU A 51 229.432 248.386 221.589 1.00 0.00 C +ATOM 52 CA PRO A 52 229.387 249.417 217.922 1.00 0.00 C +ATOM 53 CA GLU A 53 231.853 249.774 215.040 1.00 0.00 C +ATOM 54 CA ARG A 54 235.613 249.203 214.807 1.00 0.00 C +ATOM 55 CA ARG A 55 237.446 245.920 214.189 1.00 0.00 C +ATOM 56 CA ARG A 56 239.994 244.634 211.666 1.00 0.00 C +ATOM 57 CA ARG A 57 242.960 245.646 209.498 1.00 0.00 C +ATOM 58 CA LEU A 58 243.308 243.023 206.757 1.00 0.00 C +ATOM 59 CA GLU A 59 243.471 239.279 207.442 1.00 0.00 C +ATOM 60 CA ARG A 60 246.594 237.218 206.725 1.00 0.00 C +ATOM 61 CA ARG A 61 249.301 234.703 207.655 1.00 0.00 C +ATOM 62 CA ARG A 62 251.533 231.622 207.441 1.00 0.00 C +ATOM 63 CA ARG A 63 255.167 230.694 208.107 1.00 0.00 C +ATOM 64 CA THR A 64 258.086 228.683 206.708 1.00 0.00 C +ATOM 65 CA ALA A 65 259.833 226.153 204.459 1.00 0.00 C +ATOM 66 CA GLY A 66 261.542 226.333 201.058 1.00 0.00 C +ATOM 67 CA ALA A 67 264.764 227.787 199.637 1.00 0.00 C +ATOM 68 CA ALA A 68 268.440 227.720 200.638 1.00 0.00 C +ATOM 69 CA ALA A 69 270.745 230.582 199.632 1.00 0.00 C +ATOM 70 CA SER A 70 269.371 234.033 200.482 1.00 0.00 C +ATOM 71 CA THR A 71 268.253 234.030 204.124 1.00 0.00 C +ATOM 72 CA ALA A 72 265.283 235.445 206.045 1.00 0.00 C +ATOM 73 CA ALA A 73 262.015 235.465 208.004 1.00 0.00 C +ATOM 74 CA ARG A 74 258.688 237.255 208.494 1.00 0.00 C +ATOM 75 CA GLY A 75 256.038 236.779 211.190 1.00 0.00 C +ATOM 76 CA LEU A 76 254.271 237.580 214.469 1.00 0.00 C +ATOM 77 CA THR A 77 256.586 239.729 216.599 1.00 0.00 C +ATOM 78 CA ARG A 78 257.773 243.285 215.916 1.00 0.00 C +ATOM 79 CA LEU A 79 257.915 246.948 216.955 1.00 0.00 C +ATOM 80 CA ARG A 80 260.275 247.195 219.935 1.00 0.00 C +ATOM 81 CA LEU A 81 262.736 248.247 222.647 1.00 0.00 C +ATOM 82 CA TYR A 82 264.600 251.190 224.192 1.00 0.00 C +ATOM 83 CA ARG A 83 263.774 254.636 222.793 1.00 0.00 C +ATOM 84 CA ARG A 84 262.795 258.309 222.537 1.00 0.00 C +ATOM 85 CA ARG A 85 262.427 258.981 218.805 1.00 0.00 C +ATOM 86 CA GLU A 86 263.211 256.812 215.772 1.00 0.00 C +ATOM 87 CA THR A 87 263.415 254.236 212.972 1.00 0.00 C +ATOM 88 CA LYS A 88 260.596 251.673 212.921 1.00 0.00 C +ATOM 89 CA ALA A 89 256.806 251.729 212.539 1.00 0.00 C +ATOM 90 CA ARG A 90 254.258 254.378 211.538 1.00 0.00 C +ATOM 91 CA VAL A 91 250.675 253.611 212.582 1.00 0.00 C +ATOM 92 CA ALA A 92 249.036 255.927 215.124 1.00 0.00 C +ATOM 93 CA THR A 93 246.742 254.052 217.519 1.00 0.00 C +ATOM 94 CA GLY A 94 245.513 251.573 220.138 1.00 0.00 C +ATOM 95 CA SER A 95 244.237 251.787 223.722 1.00 0.00 C +ATOM 96 CA GLY A 96 246.525 251.920 226.766 1.00 0.00 C +ATOM 97 CA GLY A 97 250.198 250.927 226.582 1.00 0.00 C +ATOM 98 CA LEU A 98 252.970 248.315 226.484 1.00 0.00 C +ATOM 99 CA GLY A 99 251.705 245.211 224.671 1.00 0.00 C +ATOM 100 CA ASP A 100 251.032 241.530 225.388 1.00 0.00 C +ATOM 101 CA PRO A 101 253.944 239.771 227.104 1.00 0.00 C +ATOM 102 CA PHE A 102 256.784 241.844 228.571 1.00 0.00 C +ATOM 103 CA LYS A 103 260.089 242.182 230.438 1.00 0.00 C +ATOM 104 CA GLY A 104 259.321 243.879 233.762 1.00 0.00 C +ATOM 105 CA VAL A 105 256.047 245.478 234.876 1.00 0.00 C +ATOM 106 CA GLY A 106 256.007 248.412 237.307 1.00 0.00 C +ATOM 107 CA ARG A 107 252.684 250.185 236.729 1.00 0.00 C +ATOM 108 CA LEU A 108 249.171 251.652 236.600 1.00 0.00 C +ATOM 109 CA ARG A 109 249.197 254.336 239.304 1.00 0.00 C +ATOM 110 CA ARG A 110 246.826 257.180 240.202 1.00 0.00 C +ATOM 111 CA ARG A 111 243.778 258.244 238.179 1.00 0.00 C +ATOM 112 CA PRO A 112 240.620 257.885 240.280 1.00 0.00 C +ATOM 113 CA THR A 113 237.780 255.519 239.356 1.00 0.00 C +ATOM 114 CA ALA A 114 235.207 254.691 242.041 1.00 0.00 C +ATOM 115 CA THR A 115 233.512 253.762 245.324 1.00 0.00 C +ATOM 116 CA GLY A 116 233.715 249.992 245.838 1.00 0.00 C +ATOM 117 CA ASP A 117 237.181 249.011 244.599 1.00 0.00 C +ATOM 118 CA GLY A 118 240.919 248.377 244.221 1.00 0.00 C +ATOM 119 CA GLU A 119 244.107 250.320 243.463 1.00 0.00 C +ATOM 120 CA GLY A 120 247.166 248.783 245.136 1.00 0.00 C +ATOM 121 CA LYS A 121 247.735 245.123 246.025 1.00 0.00 C +ATOM 122 CA LEU A 122 246.771 243.911 249.506 1.00 0.00 C +ATOM 123 CA ARG A 123 245.478 246.979 251.359 1.00 0.00 C +ATOM 124 CA LEU A 124 247.075 247.452 254.785 1.00 0.00 C +ATOM 125 CA GLY A 125 249.077 247.551 258.025 1.00 0.00 C +ATOM 126 CA GLY A 126 247.569 245.579 260.916 1.00 0.00 C +ATOM 127 CA LYS A 127 245.033 246.048 263.720 1.00 0.00 C +ATOM 128 CA ARG A 128 243.135 247.204 266.814 1.00 0.00 C +ATOM 129 CA PRO A 129 244.784 248.912 269.794 1.00 0.00 C +ATOM 130 CA ILE A 130 244.663 252.686 270.306 1.00 0.00 C +ATOM 131 CA ARG A 131 242.855 255.733 271.708 1.00 0.00 C +ATOM 132 CA ILE A 132 244.113 258.666 269.627 1.00 0.00 C +ATOM 133 CA GLU A 133 243.213 262.352 269.278 1.00 0.00 C +ATOM 134 CA LEU A 134 243.998 265.266 271.603 1.00 0.00 C +ATOM 135 CA GLU A 135 246.608 264.301 274.206 1.00 0.00 C +ATOM 136 CA SER A 136 247.200 260.551 274.526 1.00 0.00 C +ATOM 137 CA THR A 137 246.529 258.181 277.433 1.00 0.00 C +ATOM 138 CA ASP A 138 246.787 256.270 280.719 1.00 0.00 C +ATOM 139 CA PHE A 139 248.148 253.284 282.655 1.00 0.00 C +ATOM 140 CA GLN A 140 251.056 252.559 285.008 1.00 0.00 C +ATOM 141 CA SER A 141 254.050 250.652 286.391 1.00 0.00 C +ATOM 142 CA ASP A 142 256.919 252.641 287.917 1.00 0.00 C +ATOM 143 CA LEU A 143 259.947 253.494 285.767 1.00 0.00 C +ATOM 144 CA GLU A 144 263.294 252.822 287.459 1.00 0.00 C +ATOM 145 CA ASP A 145 266.330 250.521 287.360 1.00 0.00 C +ATOM 146 CA ASP A 146 268.734 248.153 289.127 1.00 0.00 C +ATOM 147 CA SER A 147 272.474 248.808 289.445 1.00 0.00 C +ATOM 148 CA LYS A 148 273.240 252.527 289.753 1.00 0.00 C +ATOM 149 CA ARG A 149 274.880 255.060 287.427 1.00 0.00 C +ATOM 150 CA GLU A 150 275.287 258.597 288.785 1.00 0.00 C +ATOM 151 CA LYS A 151 274.504 259.371 292.432 1.00 0.00 C +ATOM 152 CA VAL A 152 272.298 260.246 295.413 1.00 0.00 C +ATOM 153 CA GLU A 153 269.613 261.076 297.985 1.00 0.00 C +ATOM 154 CA GLU A 154 268.905 258.677 300.859 1.00 0.00 C +ATOM 155 CA ILE A 155 268.216 254.930 300.879 1.00 0.00 C +ATOM 156 CA SER A 156 268.080 251.426 299.390 1.00 0.00 C +ATOM 157 CA GLY A 157 271.611 250.002 299.535 1.00 0.00 C +ATOM 158 CA ASN A 158 273.318 246.638 300.068 1.00 0.00 C +ATOM 159 CA ILE A 159 276.435 246.316 297.901 1.00 0.00 C +ATOM 160 CA SER A 160 278.810 249.014 296.639 1.00 0.00 C +ATOM 161 CA PRO A 161 278.070 252.550 295.427 1.00 0.00 C +ATOM 162 CA GLN A 162 278.583 256.219 296.315 1.00 0.00 C +ATOM 163 CA LEU A 163 281.314 258.728 297.188 1.00 0.00 C +ATOM 164 CA ILE A 164 283.222 262.018 297.416 1.00 0.00 C +ATOM 165 CA SER A 165 286.022 264.046 299.015 1.00 0.00 C +ATOM 166 CA PRO A 166 287.653 267.124 300.561 1.00 0.00 C +ATOM 167 CA GLU A 167 290.972 268.374 299.169 1.00 0.00 C +ATOM 168 CA LYS A 168 294.017 267.581 301.317 1.00 0.00 C +ATOM 169 CA GLU A 169 293.247 264.580 303.535 1.00 0.00 C +ATOM 170 CA ARG A 170 292.533 261.120 302.109 1.00 0.00 C +ATOM 171 CA ARG A 171 294.751 258.771 300.090 1.00 0.00 C +ATOM 172 CA GLY A 172 295.909 255.218 299.346 1.00 0.00 C +ATOM 173 CA ARG A 173 295.876 252.082 301.510 1.00 0.00 C +ATOM 174 CA ILE A 174 293.098 249.755 300.333 1.00 0.00 C +ATOM 175 CA TRP A 175 290.029 249.349 302.554 1.00 0.00 C +ATOM 176 CA LYS A 176 288.432 246.094 301.383 1.00 0.00 C +ATOM 177 CA GLU A 177 284.739 245.187 301.609 1.00 0.00 C +ATOM 178 CA THR A 178 282.893 246.250 304.768 1.00 0.00 C +ATOM 179 CA THR A 179 279.309 246.597 306.015 1.00 0.00 C +ATOM 180 CA ALA A 180 279.535 245.908 309.755 1.00 0.00 C +ATOM 181 CA ARG A 181 278.235 242.995 311.839 1.00 0.00 C +ATOM 182 CA LEU A 182 280.884 240.544 313.060 1.00 0.00 C +ATOM 183 CA GLY A 183 282.858 238.980 315.919 1.00 0.00 C +TER 184 GLY A 183 +END diff --git a/Plants/Q8H307/Q8H307.dcd b/Plants/Q8H307/Q8H307.dcd new file mode 100644 index 0000000000000000000000000000000000000000..e3c14ba6ae44fcde690d76d712ada4da2e74a830 --- /dev/null +++ b/Plants/Q8H307/Q8H307.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c2f7817ff5e6a56cb458f6b204870b55658e89a809a237443d311829ebc29ccf +size 15560276 diff --git a/Plants/Q8H307/top.pdb b/Plants/Q8H307/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..1f03b0fb8ea3d7fc3d3d2e25bdedb8a69751a49b --- /dev/null +++ b/Plants/Q8H307/top.pdb @@ -0,0 +1,127 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 228.780 262.929 264.992 1.00 0.00 C +ATOM 2 CA THR A 2 231.992 264.637 263.862 1.00 0.00 C +ATOM 3 CA SER A 3 231.688 268.075 262.247 1.00 0.00 C +ATOM 4 CA PRO A 4 231.924 267.740 258.459 1.00 0.00 C +ATOM 5 CA ARG A 5 233.159 264.836 256.324 1.00 0.00 C +ATOM 6 CA GLY A 6 234.241 261.184 256.378 1.00 0.00 C +ATOM 7 CA ILE A 7 236.659 258.621 254.928 1.00 0.00 C +ATOM 8 CA GLY A 8 239.041 256.919 252.490 1.00 0.00 C +ATOM 9 CA GLY A 9 242.770 257.455 253.062 1.00 0.00 C +ATOM 10 CA ALA A 10 244.618 257.680 249.737 1.00 0.00 C +ATOM 11 CA ASP A 11 244.123 259.594 246.481 1.00 0.00 C +ATOM 12 CA GLU A 12 242.274 257.645 243.779 1.00 0.00 C +ATOM 13 CA ARG A 13 239.580 259.415 241.748 1.00 0.00 C +ATOM 14 CA ALA A 14 236.127 259.450 243.357 1.00 0.00 C +ATOM 15 CA PRO A 15 233.674 256.568 242.915 1.00 0.00 C +ATOM 16 CA PRO A 16 230.462 256.243 244.939 1.00 0.00 C +ATOM 17 CA VAL A 17 229.326 254.630 248.198 1.00 0.00 C +ATOM 18 CA GLY A 18 225.577 254.140 247.728 1.00 0.00 C +ATOM 19 CA GLY A 19 223.929 256.354 245.102 1.00 0.00 C +ATOM 20 CA SER A 20 220.184 256.693 245.710 1.00 0.00 C +ATOM 21 CA LYS A 21 218.486 256.394 249.108 1.00 0.00 C +ATOM 22 CA GLU A 22 219.056 256.534 252.873 1.00 0.00 C +ATOM 23 CA VAL A 23 216.938 255.751 255.941 1.00 0.00 C +ATOM 24 CA GLY A 24 215.226 254.425 259.076 1.00 0.00 C +ATOM 25 CA ALA A 25 215.282 250.793 260.227 1.00 0.00 C +ATOM 26 CA ARG A 26 217.797 248.954 258.033 1.00 0.00 C +ATOM 27 CA TRP A 27 217.597 246.514 255.114 1.00 0.00 C +ATOM 28 CA THR A 28 217.287 248.190 251.706 1.00 0.00 C +ATOM 29 CA GLN A 29 217.166 247.153 248.042 1.00 0.00 C +ATOM 30 CA SER A 30 218.396 243.846 246.604 1.00 0.00 C +ATOM 31 CA THR A 31 221.985 244.384 245.445 1.00 0.00 C +ATOM 32 CA ARG A 32 225.522 243.056 245.941 1.00 0.00 C +ATOM 33 CA ALA A 33 227.697 245.338 243.802 1.00 0.00 C +ATOM 34 CA LEU A 34 230.482 247.451 242.287 1.00 0.00 C +ATOM 35 CA PRO A 35 233.754 247.776 240.363 1.00 0.00 C +ATOM 36 CA VAL A 36 236.758 250.016 239.673 1.00 0.00 C +ATOM 37 CA GLY A 37 240.484 250.493 240.308 1.00 0.00 C +ATOM 38 CA ALA A 38 243.633 248.378 239.954 1.00 0.00 C +ATOM 39 CA PRO A 39 246.430 249.491 242.290 1.00 0.00 C +ATOM 40 CA ARG A 40 246.103 250.290 246.001 1.00 0.00 C +ATOM 41 CA GLY A 41 244.792 247.478 248.212 1.00 0.00 C +ATOM 42 CA SER A 42 242.385 245.848 250.674 1.00 0.00 C +ATOM 43 CA HIS A 43 242.172 246.170 254.465 1.00 0.00 C +ATOM 44 CA VAL A 44 242.386 249.658 255.983 1.00 0.00 C +ATOM 45 CA VAL A 45 242.752 250.480 259.685 1.00 0.00 C +ATOM 46 CA ALA A 46 242.232 251.753 263.239 1.00 0.00 C +ATOM 47 CA THR A 47 243.129 255.421 263.744 1.00 0.00 C +ATOM 48 CA ALA A 48 242.034 258.997 264.472 1.00 0.00 C +ATOM 49 CA ASP A 49 240.948 261.101 261.487 1.00 0.00 C +ATOM 50 CA GLY A 50 237.926 263.416 261.341 1.00 0.00 C +ATOM 51 CA GLU A 51 238.803 265.918 258.604 1.00 0.00 C +ATOM 52 CA ASP A 52 241.788 266.839 256.423 1.00 0.00 C +ATOM 53 CA GLU A 53 245.154 266.998 254.646 1.00 0.00 C +ATOM 54 CA VAL A 54 248.444 268.744 255.450 1.00 0.00 C +ATOM 55 CA ALA A 55 251.258 268.709 252.881 1.00 0.00 C +ATOM 56 CA PRO A 56 251.464 266.593 249.720 1.00 0.00 C +ATOM 57 CA THR A 57 251.018 264.262 246.739 1.00 0.00 C +ATOM 58 CA TRP A 58 248.322 264.467 244.054 1.00 0.00 C +ATOM 59 CA ARG A 59 248.465 266.611 240.908 1.00 0.00 C +ATOM 60 CA HIS A 60 250.988 269.443 241.262 1.00 0.00 C +ATOM 61 CA ARG A 61 250.461 272.290 243.739 1.00 0.00 C +ATOM 62 CA GLY A 62 253.260 272.073 246.314 1.00 0.00 C +ATOM 63 CA SER A 63 256.987 271.418 246.761 1.00 0.00 C +ATOM 64 CA ASN A 64 258.108 269.120 243.936 1.00 0.00 C +ATOM 65 CA ALA A 65 257.068 265.457 244.060 1.00 0.00 C +ATOM 66 CA GLY A 66 258.424 261.896 244.117 1.00 0.00 C +ATOM 67 CA ARG A 67 260.618 258.790 244.348 1.00 0.00 C +ATOM 68 CA HIS A 68 259.140 256.098 242.093 1.00 0.00 C +ATOM 69 CA GLY A 69 257.129 252.897 242.570 1.00 0.00 C +ATOM 70 CA GLU A 70 255.041 251.340 245.351 1.00 0.00 C +ATOM 71 CA GLY A 71 255.384 247.592 245.944 1.00 0.00 C +ATOM 72 CA HIS A 72 252.098 245.725 245.462 1.00 0.00 C +ATOM 73 CA VAL A 73 249.435 243.003 245.349 1.00 0.00 C +ATOM 74 CA ASP A 74 250.378 239.326 245.023 1.00 0.00 C +ATOM 75 CA GLY A 75 253.263 237.196 243.737 1.00 0.00 C +ATOM 76 CA PRO A 76 256.382 235.616 245.251 1.00 0.00 C +ATOM 77 CA ASN A 77 257.018 236.860 248.796 1.00 0.00 C +ATOM 78 CA PRO A 78 256.455 234.417 251.664 1.00 0.00 C +ATOM 79 CA PRO A 79 258.142 234.381 255.080 1.00 0.00 C +ATOM 80 CA GLY A 80 257.872 237.884 256.555 1.00 0.00 C +ATOM 81 CA VAL A 81 260.577 240.564 256.679 1.00 0.00 C +ATOM 82 CA ASN A 82 264.271 241.287 257.268 1.00 0.00 C +ATOM 83 CA ARG A 83 267.562 239.367 257.235 1.00 0.00 C +ATOM 84 CA ALA A 84 268.104 238.473 253.571 1.00 0.00 C +ATOM 85 CA VAL A 85 268.237 235.366 251.370 1.00 0.00 C +ATOM 86 CA THR A 86 267.256 234.574 247.775 1.00 0.00 C +ATOM 87 CA GLY A 87 264.248 232.927 246.115 1.00 0.00 C +ATOM 88 CA GLU A 88 262.556 229.584 245.424 1.00 0.00 C +ATOM 89 CA ARG A 89 264.953 226.851 244.285 1.00 0.00 C +ATOM 90 CA GLU A 90 267.814 226.087 241.888 1.00 0.00 C +ATOM 91 CA PRO A 91 271.132 224.351 241.185 1.00 0.00 C +ATOM 92 CA ALA A 92 274.473 224.676 242.986 1.00 0.00 C +ATOM 93 CA HIS A 93 275.246 223.491 246.524 1.00 0.00 C +ATOM 94 CA ARG A 94 278.959 223.742 247.343 1.00 0.00 C +ATOM 95 CA PRO A 95 280.488 226.653 249.268 1.00 0.00 C +ATOM 96 CA ALA A 96 277.977 228.179 251.693 1.00 0.00 C +ATOM 97 CA GLY A 97 274.281 228.156 252.617 1.00 0.00 C +ATOM 98 CA GLU A 98 271.073 229.431 251.005 1.00 0.00 C +ATOM 99 CA ARG A 99 270.440 229.083 247.264 1.00 0.00 C +ATOM 100 CA TRP A 100 271.923 230.049 243.890 1.00 0.00 C +ATOM 101 CA ARG A 101 270.242 233.249 242.687 1.00 0.00 C +ATOM 102 CA ALA A 102 269.090 235.244 239.652 1.00 0.00 C +ATOM 103 CA ALA A 103 270.265 236.253 236.171 1.00 0.00 C +ATOM 104 CA ARG A 104 272.034 239.623 235.993 1.00 0.00 C +ATOM 105 CA TRP A 105 274.311 241.221 238.596 1.00 0.00 C +ATOM 106 CA SER A 106 277.106 242.925 240.545 1.00 0.00 C +ATOM 107 CA PRO A 107 277.049 246.694 239.986 1.00 0.00 C +ATOM 108 CA THR A 108 274.603 249.238 241.421 1.00 0.00 C +ATOM 109 CA ALA A 109 271.381 247.947 242.991 1.00 0.00 C +ATOM 110 CA THR A 110 268.486 248.885 245.284 1.00 0.00 C +ATOM 111 CA THR A 111 264.835 247.943 245.827 1.00 0.00 C +ATOM 112 CA GLY A 112 262.214 250.410 247.076 1.00 0.00 C +ATOM 113 CA ALA A 113 259.478 250.032 249.700 1.00 0.00 C +ATOM 114 CA ALA A 114 259.785 252.765 252.337 1.00 0.00 C +ATOM 115 CA ALA A 115 263.392 253.770 253.038 1.00 0.00 C +ATOM 116 CA GLN A 116 264.255 257.175 254.515 1.00 0.00 C +ATOM 117 CA PRO A 117 264.299 257.491 258.312 1.00 0.00 C +ATOM 118 CA GLY A 118 261.793 258.936 260.791 1.00 0.00 C +ATOM 119 CA GLY A 119 260.786 258.689 264.457 1.00 0.00 C +ATOM 120 CA SER A 120 262.300 259.793 267.775 1.00 0.00 C +ATOM 121 CA GLY A 121 262.530 257.998 271.128 1.00 0.00 C +ATOM 122 CA GLY A 122 261.636 258.033 274.831 1.00 0.00 C +ATOM 123 CA ARG A 123 261.234 254.475 276.135 1.00 0.00 C +TER 124 ARG A 123 +END diff --git a/Plants/Q8H377/Q8H377.dcd b/Plants/Q8H377/Q8H377.dcd new file mode 100644 index 0000000000000000000000000000000000000000..6ad5e7f9f39a9e89a0d1d246d9c0a1cdae8bc96e --- /dev/null +++ b/Plants/Q8H377/Q8H377.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:56ae4b9bac2114a4a9b4158c847edf9da539e5a852f59a28e884ba33b0f5a61f +size 16040276 diff --git a/Plants/Q8H377/top.pdb b/Plants/Q8H377/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..0f4f4c607dac9c6284b214dfd119a197eee35a16 --- /dev/null +++ b/Plants/Q8H377/top.pdb @@ -0,0 +1,131 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 255.636 234.440 210.336 1.00 0.00 C +ATOM 2 CA GLY A 2 256.878 237.319 208.170 1.00 0.00 C +ATOM 3 CA PRO A 3 257.869 240.172 210.491 1.00 0.00 C +ATOM 4 CA ARG A 4 259.328 242.781 212.855 1.00 0.00 C +ATOM 5 CA ARG A 5 257.060 242.756 215.916 1.00 0.00 C +ATOM 6 CA LEU A 6 255.846 245.127 218.640 1.00 0.00 C +ATOM 7 CA THR A 7 255.396 247.042 221.903 1.00 0.00 C +ATOM 8 CA GLY A 8 257.087 248.582 224.950 1.00 0.00 C +ATOM 9 CA GLU A 9 260.364 248.094 226.832 1.00 0.00 C +ATOM 10 CA GLY A 10 260.658 251.185 229.040 1.00 0.00 C +ATOM 11 CA ASP A 11 259.154 251.865 232.474 1.00 0.00 C +ATOM 12 CA ASP A 12 255.545 252.711 233.354 1.00 0.00 C +ATOM 13 CA ASP A 13 253.292 252.182 230.328 1.00 0.00 C +ATOM 14 CA VAL A 14 249.734 251.613 229.090 1.00 0.00 C +ATOM 15 CA SER A 15 247.804 248.928 230.983 1.00 0.00 C +ATOM 16 CA ASP A 16 246.263 246.068 232.973 1.00 0.00 C +ATOM 17 CA ASP A 17 247.984 243.412 235.094 1.00 0.00 C +ATOM 18 CA VAL A 18 250.621 241.417 233.202 1.00 0.00 C +ATOM 19 CA THR A 19 252.499 238.825 231.136 1.00 0.00 C +ATOM 20 CA ASP A 20 250.894 236.205 228.884 1.00 0.00 C +ATOM 21 CA SER A 21 248.377 233.349 229.040 1.00 0.00 C +ATOM 22 CA GLY A 22 245.491 230.863 229.138 1.00 0.00 C +ATOM 23 CA GLY A 23 241.990 232.365 229.175 1.00 0.00 C +ATOM 24 CA GLY A 24 238.797 233.416 230.969 1.00 0.00 C +ATOM 25 CA SER A 25 236.536 236.286 232.050 1.00 0.00 C +ATOM 26 CA ALA A 26 235.793 238.683 234.916 1.00 0.00 C +ATOM 27 CA GLU A 27 236.375 242.346 234.045 1.00 0.00 C +ATOM 28 CA ARG A 28 236.557 245.664 235.910 1.00 0.00 C +ATOM 29 CA THR A 29 238.103 248.013 238.481 1.00 0.00 C +ATOM 30 CA ALA A 30 241.324 249.929 239.169 1.00 0.00 C +ATOM 31 CA ARG A 31 243.238 252.204 236.787 1.00 0.00 C +ATOM 32 CA ALA A 32 246.200 254.600 236.796 1.00 0.00 C +ATOM 33 CA ALA A 33 246.072 256.200 240.252 1.00 0.00 C +ATOM 34 CA HIS A 34 246.568 259.505 242.080 1.00 0.00 C +ATOM 35 CA ALA A 35 245.493 260.627 245.559 1.00 0.00 C +ATOM 36 CA ARG A 36 242.480 261.031 247.857 1.00 0.00 C +ATOM 37 CA ARG A 37 243.651 259.559 251.170 1.00 0.00 C +ATOM 38 CA ARG A 38 241.498 257.190 253.235 1.00 0.00 C +ATOM 39 CA THR A 39 239.210 256.616 256.227 1.00 0.00 C +ATOM 40 CA THR A 40 237.687 255.904 259.646 1.00 0.00 C +ATOM 41 CA ALA A 41 238.073 252.983 262.062 1.00 0.00 C +ATOM 42 CA ARG A 42 237.181 253.194 265.760 1.00 0.00 C +ATOM 43 CA ARG A 43 239.805 251.057 267.511 1.00 0.00 C +ATOM 44 CA ARG A 44 243.302 249.676 266.895 1.00 0.00 C +ATOM 45 CA LYS A 45 245.441 251.240 264.157 1.00 0.00 C +ATOM 46 CA ARG A 46 244.397 251.421 260.497 1.00 0.00 C +ATOM 47 CA ARG A 47 245.513 249.985 257.149 1.00 0.00 C +ATOM 48 CA THR A 48 246.379 246.310 257.655 1.00 0.00 C +ATOM 49 CA PRO A 49 248.783 244.489 259.983 1.00 0.00 C +ATOM 50 CA THR A 50 252.126 244.264 261.798 1.00 0.00 C +ATOM 51 CA GLY A 51 254.208 247.444 261.526 1.00 0.00 C +ATOM 52 CA ARG A 52 253.604 251.193 261.830 1.00 0.00 C +ATOM 53 CA GLY A 53 251.072 253.759 263.064 1.00 0.00 C +ATOM 54 CA ARG A 54 251.979 257.137 264.575 1.00 0.00 C +ATOM 55 CA ARG A 55 255.267 258.326 263.060 1.00 0.00 C +ATOM 56 CA GLY A 56 257.911 256.182 261.350 1.00 0.00 C +ATOM 57 CA GLU A 57 259.906 253.332 259.796 1.00 0.00 C +ATOM 58 CA LEU A 58 262.576 252.761 257.139 1.00 0.00 C +ATOM 59 CA THR A 59 262.006 253.121 253.389 1.00 0.00 C +ATOM 60 CA GLY A 60 259.407 254.844 251.200 1.00 0.00 C +ATOM 61 CA ASP A 61 259.154 257.515 248.495 1.00 0.00 C +ATOM 62 CA GLN A 62 257.774 261.058 248.729 1.00 0.00 C +ATOM 63 CA ASN A 63 254.325 261.610 250.251 1.00 0.00 C +ATOM 64 CA HIS A 64 252.569 259.944 253.194 1.00 0.00 C +ATOM 65 CA GLY A 65 252.726 258.328 256.641 1.00 0.00 C +ATOM 66 CA GLY A 66 252.154 254.565 256.795 1.00 0.00 C +ATOM 67 CA ARG A 67 254.426 251.736 255.634 1.00 0.00 C +ATOM 68 CA ALA A 68 256.528 248.572 255.335 1.00 0.00 C +ATOM 69 CA THR A 69 258.910 246.520 257.488 1.00 0.00 C +ATOM 70 CA ASP A 70 259.395 243.341 259.532 1.00 0.00 C +ATOM 71 CA GLY A 71 258.937 239.929 257.901 1.00 0.00 C +ATOM 72 CA ALA A 72 257.276 236.500 257.872 1.00 0.00 C +ATOM 73 CA GLY A 73 256.357 232.962 256.797 1.00 0.00 C +ATOM 74 CA ASP A 74 252.655 232.064 256.846 1.00 0.00 C +ATOM 75 CA GLU A 75 250.991 234.743 254.708 1.00 0.00 C +ATOM 76 CA GLU A 76 248.216 235.432 252.190 1.00 0.00 C +ATOM 77 CA GLU A 77 249.461 238.323 250.042 1.00 0.00 C +ATOM 78 CA ALA A 78 249.108 238.678 246.265 1.00 0.00 C +ATOM 79 CA ALA A 79 252.002 239.235 243.851 1.00 0.00 C +ATOM 80 CA ALA A 80 253.870 242.435 244.739 1.00 0.00 C +ATOM 81 CA GLU A 81 254.804 246.102 244.298 1.00 0.00 C +ATOM 82 CA ILE A 82 254.620 248.125 247.521 1.00 0.00 C +ATOM 83 CA GLY A 83 255.114 251.903 247.578 1.00 0.00 C +ATOM 84 CA SER A 84 253.738 254.893 245.659 1.00 0.00 C +ATOM 85 CA THR A 85 252.453 254.456 242.099 1.00 0.00 C +ATOM 86 CA THR A 86 253.890 256.920 239.574 1.00 0.00 C +ATOM 87 CA ALA A 87 255.513 259.945 237.919 1.00 0.00 C +ATOM 88 CA THR A 88 253.594 263.220 238.251 1.00 0.00 C +ATOM 89 CA VAL A 89 252.952 266.971 238.437 1.00 0.00 C +ATOM 90 CA LEU A 90 252.141 268.971 241.577 1.00 0.00 C +ATOM 91 CA ARG A 91 252.864 268.189 245.236 1.00 0.00 C +ATOM 92 CA ARG A 92 250.867 268.513 248.464 1.00 0.00 C +ATOM 93 CA SER A 93 253.039 267.534 251.437 1.00 0.00 C +ATOM 94 CA SER A 94 256.758 267.274 250.650 1.00 0.00 C +ATOM 95 CA ALA A 95 259.380 270.000 251.108 1.00 0.00 C +ATOM 96 CA ALA A 96 259.812 271.734 254.473 1.00 0.00 C +ATOM 97 CA ALA A 97 260.724 270.336 257.897 1.00 0.00 C +ATOM 98 CA LYS A 98 259.953 266.636 258.384 1.00 0.00 C +ATOM 99 CA GLY A 99 256.813 265.089 256.879 1.00 0.00 C +ATOM 100 CA ARG A 100 253.190 265.720 257.874 1.00 0.00 C +ATOM 101 CA THR A 101 251.829 267.016 261.188 1.00 0.00 C +ATOM 102 CA ARG A 102 252.806 264.813 264.139 1.00 0.00 C +ATOM 103 CA THR A 103 249.775 264.519 266.429 1.00 0.00 C +ATOM 104 CA ALA A 104 247.800 264.790 269.676 1.00 0.00 C +ATOM 105 CA THR A 105 246.109 263.685 272.906 1.00 0.00 C +ATOM 106 CA THR A 106 248.483 261.963 275.338 1.00 0.00 C +ATOM 107 CA TRP A 107 252.060 260.695 275.669 1.00 0.00 C +ATOM 108 CA ARG A 108 253.079 259.145 272.341 1.00 0.00 C +ATOM 109 CA SER A 109 250.161 257.875 270.247 1.00 0.00 C +ATOM 110 CA ARG A 110 248.432 254.486 270.459 1.00 0.00 C +ATOM 111 CA TRP A 111 248.284 250.956 271.883 1.00 0.00 C +ATOM 112 CA TRP A 112 248.814 247.370 270.710 1.00 0.00 C +ATOM 113 CA GLN A 113 246.748 244.371 269.590 1.00 0.00 C +ATOM 114 CA GLN A 114 244.104 243.394 272.153 1.00 0.00 C +ATOM 115 CA ARG A 115 240.555 244.163 270.999 1.00 0.00 C +ATOM 116 CA PRO A 116 237.739 241.618 271.322 1.00 0.00 C +ATOM 117 CA THR A 117 235.196 239.989 268.999 1.00 0.00 C +ATOM 118 CA THR A 118 236.165 239.332 265.374 1.00 0.00 C +ATOM 119 CA ALA A 119 237.462 241.607 262.607 1.00 0.00 C +ATOM 120 CA ALA A 120 241.261 241.506 262.341 1.00 0.00 C +ATOM 121 CA ALA A 121 243.032 239.422 259.688 1.00 0.00 C +ATOM 122 CA THR A 122 245.041 237.861 256.851 1.00 0.00 C +ATOM 123 CA ALA A 123 245.228 234.086 257.329 1.00 0.00 C +ATOM 124 CA ALA A 124 243.100 232.387 259.995 1.00 0.00 C +ATOM 125 CA ARG A 125 242.678 229.551 262.503 1.00 0.00 C +ATOM 126 CA ARG A 126 245.538 229.580 265.020 1.00 0.00 C +ATOM 127 CA GLY A 127 249.177 230.005 266.068 1.00 0.00 C +TER 128 GLY A 127 +END diff --git a/Plants/Q8H3T1/Q8H3T1.dcd b/Plants/Q8H3T1/Q8H3T1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..e48110d50cda2aec0602a9f3de3a5008bbefa1d0 --- /dev/null +++ b/Plants/Q8H3T1/Q8H3T1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:4e4fe60de33c7043d81d44328d5ba3f6400c6609a160fca50924b8e3683b317d +size 9320276 diff --git a/Plants/Q8H3T1/top.pdb b/Plants/Q8H3T1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..c262955844120d6514352d335aa715de986abc41 --- /dev/null +++ b/Plants/Q8H3T1/top.pdb @@ -0,0 +1,75 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 266.098 289.969 242.515 1.00 0.00 C +ATOM 2 CA THR A 2 265.730 287.149 245.050 1.00 0.00 C +ATOM 3 CA SER A 3 262.302 286.033 246.281 1.00 0.00 C +ATOM 4 CA ALA A 4 259.235 285.004 248.294 1.00 0.00 C +ATOM 5 CA THR A 5 257.198 282.271 249.997 1.00 0.00 C +ATOM 6 CA ARG A 6 254.544 280.442 247.966 1.00 0.00 C +ATOM 7 CA LYS A 7 252.992 277.504 249.831 1.00 0.00 C +ATOM 8 CA SER A 8 252.651 274.935 252.624 1.00 0.00 C +ATOM 9 CA GLY A 9 251.524 271.712 254.315 1.00 0.00 C +ATOM 10 CA GLY A 10 252.340 270.241 257.733 1.00 0.00 C +ATOM 11 CA ASP A 11 252.222 270.789 261.501 1.00 0.00 C +ATOM 12 CA ASP A 12 254.645 268.401 263.218 1.00 0.00 C +ATOM 13 CA ARG A 13 255.824 265.384 265.225 1.00 0.00 C +ATOM 14 CA VAL A 14 254.958 263.161 268.195 1.00 0.00 C +ATOM 15 CA ASN A 15 252.167 261.287 269.988 1.00 0.00 C +ATOM 16 CA GLY A 16 251.747 257.607 269.096 1.00 0.00 C +ATOM 17 CA GLY A 17 251.453 253.878 268.374 1.00 0.00 C +ATOM 18 CA ASP A 18 251.206 250.505 266.619 1.00 0.00 C +ATOM 19 CA GLY A 19 253.620 250.570 263.673 1.00 0.00 C +ATOM 20 CA ALA A 20 254.429 252.044 260.254 1.00 0.00 C +ATOM 21 CA PRO A 21 251.897 250.457 257.890 1.00 0.00 C +ATOM 22 CA ALA A 22 249.078 248.029 257.068 1.00 0.00 C +ATOM 23 CA VAL A 23 245.952 245.866 257.314 1.00 0.00 C +ATOM 24 CA ASP A 24 243.227 244.105 259.311 1.00 0.00 C +ATOM 25 CA SER A 25 241.530 246.158 262.035 1.00 0.00 C +ATOM 26 CA ASP A 26 244.108 248.785 263.019 1.00 0.00 C +ATOM 27 CA GLY A 27 245.578 247.845 266.406 1.00 0.00 C +ATOM 28 CA GLU A 28 245.034 249.707 269.685 1.00 0.00 C +ATOM 29 CA GLU A 29 246.225 251.269 272.949 1.00 0.00 C +ATOM 30 CA ALA A 30 248.457 249.661 275.585 1.00 0.00 C +ATOM 31 CA ASP A 31 248.676 247.525 278.732 1.00 0.00 C +ATOM 32 CA GLU A 32 246.426 245.044 280.548 1.00 0.00 C +ATOM 33 CA ASP A 33 244.671 241.896 279.311 1.00 0.00 C +ATOM 34 CA GLY A 34 244.726 238.087 279.273 1.00 0.00 C +ATOM 35 CA ASN A 35 244.393 236.103 276.038 1.00 0.00 C +ATOM 36 CA GLU A 36 243.234 235.839 272.418 1.00 0.00 C +ATOM 37 CA THR A 37 241.960 232.616 270.836 1.00 0.00 C +ATOM 38 CA ALA A 38 243.436 231.381 267.549 1.00 0.00 C +ATOM 39 CA ILE A 39 246.293 230.476 265.196 1.00 0.00 C +ATOM 40 CA THR A 40 249.041 231.936 262.997 1.00 0.00 C +ATOM 41 CA THR A 41 250.572 230.640 259.758 1.00 0.00 C +ATOM 42 CA ALA A 42 248.584 230.437 256.514 1.00 0.00 C +ATOM 43 CA ALA A 43 246.462 231.588 253.566 1.00 0.00 C +ATOM 44 CA SER A 44 247.607 231.760 249.936 1.00 0.00 C +ATOM 45 CA PRO A 45 248.186 232.868 246.337 1.00 0.00 C +ATOM 46 CA SER A 46 249.343 231.200 243.113 1.00 0.00 C +ATOM 47 CA SER A 47 250.202 230.332 239.503 1.00 0.00 C +ATOM 48 CA ASP A 48 251.597 231.825 236.288 1.00 0.00 C +ATOM 49 CA ASP A 49 254.997 233.425 235.662 1.00 0.00 C +ATOM 50 CA ASP A 50 256.395 234.717 232.361 1.00 0.00 C +ATOM 51 CA PRO A 51 258.751 237.709 232.465 1.00 0.00 C +ATOM 52 CA SER A 52 261.569 239.210 234.544 1.00 0.00 C +ATOM 53 CA ASP A 53 261.631 243.019 234.471 1.00 0.00 C +ATOM 54 CA GLY A 54 258.392 244.789 235.416 1.00 0.00 C +ATOM 55 CA GLY A 55 255.670 242.124 235.394 1.00 0.00 C +ATOM 56 CA ALA A 56 252.213 243.694 235.074 1.00 0.00 C +ATOM 57 CA ARG A 57 251.092 243.361 231.448 1.00 0.00 C +ATOM 58 CA LEU A 58 251.123 240.545 228.882 1.00 0.00 C +ATOM 59 CA GLU A 59 251.158 240.083 225.100 1.00 0.00 C +ATOM 60 CA ARG A 60 249.846 243.042 223.091 1.00 0.00 C +ATOM 61 CA ARG A 61 250.381 246.787 222.634 1.00 0.00 C +ATOM 62 CA ARG A 62 253.114 248.563 220.661 1.00 0.00 C +ATOM 63 CA ARG A 63 251.620 251.960 219.797 1.00 0.00 C +ATOM 64 CA ARG A 64 248.057 252.254 218.480 1.00 0.00 C +ATOM 65 CA ARG A 65 245.162 251.416 220.811 1.00 0.00 C +ATOM 66 CA ARG A 66 241.523 251.525 221.932 1.00 0.00 C +ATOM 67 CA GLU A 67 240.335 248.239 223.453 1.00 0.00 C +ATOM 68 CA ALA A 68 238.894 248.641 226.957 1.00 0.00 C +ATOM 69 CA ALA A 69 237.866 252.232 227.708 1.00 0.00 C +ATOM 70 CA ARG A 70 234.813 254.014 226.286 1.00 0.00 C +ATOM 71 CA ARG A 71 232.020 256.328 227.451 1.00 0.00 C +TER 72 ARG A 71 +END diff --git a/Plants/Q8H3T6/Q8H3T6.dcd b/Plants/Q8H3T6/Q8H3T6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..fa7f9c0377a69c8face4e0ff3e1c9cfcff6831f7 --- /dev/null +++ b/Plants/Q8H3T6/Q8H3T6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:47e3638e5c8a27939d296714aff5b3b38c9c718041366020c99c56845beacc1e +size 21920276 diff --git a/Plants/Q8H3T6/top.pdb b/Plants/Q8H3T6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..4a3fd3690a1ed3a304fb2082f4bd1abfa4d189e6 --- /dev/null +++ b/Plants/Q8H3T6/top.pdb @@ -0,0 +1,180 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 228.686 259.326 310.776 1.00 0.00 C +ATOM 2 CA ASP A 2 226.871 262.671 310.606 1.00 0.00 C +ATOM 3 CA ASP A 3 228.408 266.155 310.468 1.00 0.00 C +ATOM 4 CA GLY A 4 229.166 269.192 308.295 1.00 0.00 C +ATOM 5 CA GLY A 5 229.010 271.572 305.324 1.00 0.00 C +ATOM 6 CA THR A 6 225.994 272.290 303.109 1.00 0.00 C +ATOM 7 CA ARG A 7 225.029 272.177 299.425 1.00 0.00 C +ATOM 8 CA GLY A 8 222.956 269.510 297.663 1.00 0.00 C +ATOM 9 CA GLY A 9 219.957 267.544 298.949 1.00 0.00 C +ATOM 10 CA TRP A 10 217.600 265.363 296.898 1.00 0.00 C +ATOM 11 CA GLY A 11 215.123 262.501 296.463 1.00 0.00 C +ATOM 12 CA GLY A 12 212.670 263.505 293.726 1.00 0.00 C +ATOM 13 CA GLN A 13 209.295 263.487 291.960 1.00 0.00 C +ATOM 14 CA GLY A 14 209.749 265.635 288.846 1.00 0.00 C +ATOM 15 CA ARG A 15 212.041 268.202 287.211 1.00 0.00 C +ATOM 16 CA GLN A 16 214.938 270.230 288.628 1.00 0.00 C +ATOM 17 CA LEU A 17 215.944 273.459 290.383 1.00 0.00 C +ATOM 18 CA ARG A 18 213.480 275.995 291.801 1.00 0.00 C +ATOM 19 CA ARG A 19 209.806 275.103 291.330 1.00 0.00 C +ATOM 20 CA LYS A 20 208.123 271.917 292.567 1.00 0.00 C +ATOM 21 CA ARG A 21 205.272 269.674 291.402 1.00 0.00 C +ATOM 22 CA ALA A 22 203.056 267.662 289.045 1.00 0.00 C +ATOM 23 CA THR A 23 201.109 264.535 290.021 1.00 0.00 C +ATOM 24 CA THR A 24 200.486 261.072 288.559 1.00 0.00 C +ATOM 25 CA VAL A 25 201.311 257.432 289.324 1.00 0.00 C +ATOM 26 CA ALA A 26 202.530 253.893 288.616 1.00 0.00 C +ATOM 27 CA ASP A 27 204.289 253.272 285.294 1.00 0.00 C +ATOM 28 CA ALA A 28 205.686 252.850 281.774 1.00 0.00 C +ATOM 29 CA ALA A 29 206.266 249.550 279.961 1.00 0.00 C +ATOM 30 CA ASP A 30 203.334 248.327 277.858 1.00 0.00 C +ATOM 31 CA GLU A 31 199.885 246.845 277.209 1.00 0.00 C +ATOM 32 CA GLY A 32 197.471 244.336 275.660 1.00 0.00 C +ATOM 33 CA ALA A 33 197.224 241.126 273.623 1.00 0.00 C +ATOM 34 CA SER A 34 197.121 239.230 270.319 1.00 0.00 C +ATOM 35 CA GLU A 35 199.480 236.256 269.999 1.00 0.00 C +ATOM 36 CA THR A 36 201.562 234.501 272.664 1.00 0.00 C +ATOM 37 CA SER A 37 199.698 231.241 273.306 1.00 0.00 C +ATOM 38 CA ALA A 38 202.032 228.344 274.127 1.00 0.00 C +ATOM 39 CA GLU A 39 203.734 225.520 272.219 1.00 0.00 C +ATOM 40 CA ASP A 40 202.523 224.142 268.879 1.00 0.00 C +ATOM 41 CA GLU A 41 201.755 220.791 267.236 1.00 0.00 C +ATOM 42 CA VAL A 42 203.510 217.576 268.284 1.00 0.00 C +ATOM 43 CA GLY A 43 205.566 215.280 270.524 1.00 0.00 C +ATOM 44 CA GLY A 44 206.322 211.966 272.245 1.00 0.00 C +ATOM 45 CA PRO A 45 208.530 210.279 274.852 1.00 0.00 C +ATOM 46 CA GLY A 46 210.476 208.993 277.864 1.00 0.00 C +ATOM 47 CA ALA A 47 214.026 208.744 279.223 1.00 0.00 C +ATOM 48 CA THR A 48 217.213 206.691 278.846 1.00 0.00 C +ATOM 49 CA MET A 49 219.698 204.602 280.841 1.00 0.00 C +ATOM 50 CA ASP A 50 223.236 204.122 279.510 1.00 0.00 C +ATOM 51 CA TYR A 51 223.800 201.288 277.026 1.00 0.00 C +ATOM 52 CA ALA A 52 227.260 201.846 275.533 1.00 0.00 C +ATOM 53 CA ALA A 53 229.452 199.144 273.979 1.00 0.00 C +ATOM 54 CA ALA A 54 231.714 197.443 276.530 1.00 0.00 C +ATOM 55 CA ALA A 55 232.685 196.362 280.052 1.00 0.00 C +ATOM 56 CA ASN A 56 231.464 198.728 282.777 1.00 0.00 C +ATOM 57 CA ALA A 57 229.037 200.835 284.822 1.00 0.00 C +ATOM 58 CA VAL A 58 229.135 202.771 288.102 1.00 0.00 C +ATOM 59 CA ASP A 59 225.951 203.785 289.932 1.00 0.00 C +ATOM 60 CA GLY A 60 222.580 205.142 288.787 1.00 0.00 C +ATOM 61 CA ASP A 61 223.196 207.452 285.821 1.00 0.00 C +ATOM 62 CA SER A 62 224.246 209.829 283.034 1.00 0.00 C +ATOM 63 CA GLU A 63 227.478 211.526 281.943 1.00 0.00 C +ATOM 64 CA ALA A 64 227.785 211.963 278.171 1.00 0.00 C +ATOM 65 CA SER A 65 226.692 213.580 274.898 1.00 0.00 C +ATOM 66 CA GLU A 66 226.270 217.366 274.894 1.00 0.00 C +ATOM 67 CA ALA A 67 224.841 220.013 277.232 1.00 0.00 C +ATOM 68 CA MET A 68 221.467 221.655 276.569 1.00 0.00 C +ATOM 69 CA ALA A 69 220.865 223.974 273.607 1.00 0.00 C +ATOM 70 CA GLY A 70 223.790 224.191 271.175 1.00 0.00 C +ATOM 71 CA GLU A 71 223.490 226.870 268.482 1.00 0.00 C +ATOM 72 CA GLY A 72 225.210 229.604 266.462 1.00 0.00 C +ATOM 73 CA SER A 73 224.595 233.208 267.536 1.00 0.00 C +ATOM 74 CA GLY A 74 226.647 236.164 268.787 1.00 0.00 C +ATOM 75 CA GLY A 75 230.164 236.107 267.321 1.00 0.00 C +ATOM 76 CA ASP A 76 233.169 234.837 265.354 1.00 0.00 C +ATOM 77 CA ARG A 77 236.732 233.755 264.545 1.00 0.00 C +ATOM 78 CA SER A 78 238.421 231.231 266.845 1.00 0.00 C +ATOM 79 CA SER A 79 239.431 227.812 265.501 1.00 0.00 C +ATOM 80 CA ARG A 80 238.315 227.861 261.858 1.00 0.00 C +ATOM 81 CA TRP A 81 239.315 229.876 258.783 1.00 0.00 C +ATOM 82 CA ARG A 82 238.582 232.307 255.943 1.00 0.00 C +ATOM 83 CA GLN A 83 236.518 230.775 253.130 1.00 0.00 C +ATOM 84 CA LEU A 84 236.186 233.049 250.092 1.00 0.00 C +ATOM 85 CA SER A 85 236.176 236.564 248.622 1.00 0.00 C +ATOM 86 CA ARG A 86 233.501 239.266 248.372 1.00 0.00 C +ATOM 87 CA GLN A 87 230.844 241.943 248.910 1.00 0.00 C +ATOM 88 CA MET A 88 231.603 244.926 246.665 1.00 0.00 C +ATOM 89 CA GLN A 89 232.899 248.143 245.087 1.00 0.00 C +ATOM 90 CA SER A 90 234.306 249.846 241.983 1.00 0.00 C +ATOM 91 CA THR A 91 236.613 252.351 240.276 1.00 0.00 C +ATOM 92 CA MET A 92 235.978 254.230 237.022 1.00 0.00 C +ATOM 93 CA ASN A 93 238.467 254.933 234.224 1.00 0.00 C +ATOM 94 CA ALA A 94 242.250 255.328 234.451 1.00 0.00 C +ATOM 95 CA VAL A 95 244.294 255.864 237.621 1.00 0.00 C +ATOM 96 CA THR A 96 243.365 255.701 241.313 1.00 0.00 C +ATOM 97 CA ALA A 97 246.060 254.652 243.793 1.00 0.00 C +ATOM 98 CA ASP A 98 248.548 252.078 245.098 1.00 0.00 C +ATOM 99 CA GLU A 99 251.429 253.919 246.779 1.00 0.00 C +ATOM 100 CA ASP A 100 252.537 256.479 244.184 1.00 0.00 C +ATOM 101 CA GLY A 101 255.428 258.851 243.458 1.00 0.00 C +ATOM 102 CA GLY A 102 258.873 260.290 242.697 1.00 0.00 C +ATOM 103 CA ASN A 103 262.631 260.267 242.072 1.00 0.00 C +ATOM 104 CA GLY A 104 265.291 260.397 244.796 1.00 0.00 C +ATOM 105 CA ASN A 105 268.211 261.311 247.066 1.00 0.00 C +ATOM 106 CA ASN A 106 269.989 264.642 247.579 1.00 0.00 C +ATOM 107 CA HIS A 107 271.768 267.920 246.801 1.00 0.00 C +ATOM 108 CA CYS A 108 271.421 271.188 244.875 1.00 0.00 C +ATOM 109 CA GLY A 109 270.652 270.923 241.153 1.00 0.00 C +ATOM 110 CA ARG A 110 272.208 273.942 239.425 1.00 0.00 C +ATOM 111 CA GLY A 111 272.871 277.100 241.450 1.00 0.00 C +ATOM 112 CA ARG A 112 274.105 280.334 243.044 1.00 0.00 C +ATOM 113 CA ARG A 113 276.956 282.794 242.467 1.00 0.00 C +ATOM 114 CA ARG A 114 279.519 285.262 243.828 1.00 0.00 C +ATOM 115 CA ARG A 115 280.619 287.982 246.259 1.00 0.00 C +ATOM 116 CA SER A 116 283.758 290.141 246.228 1.00 0.00 C +ATOM 117 CA ARG A 117 287.519 290.286 245.632 1.00 0.00 C +ATOM 118 CA ARG A 118 291.248 289.842 246.274 1.00 0.00 C +ATOM 119 CA THR A 119 293.957 287.180 246.570 1.00 0.00 C +ATOM 120 CA ARG A 120 297.030 284.929 246.487 1.00 0.00 C +ATOM 121 CA ALA A 121 300.434 283.218 246.567 1.00 0.00 C +ATOM 122 CA ALA A 122 301.526 280.969 243.693 1.00 0.00 C +ATOM 123 CA ALA A 123 299.255 280.556 240.662 1.00 0.00 C +ATOM 124 CA THR A 124 298.353 283.643 238.619 1.00 0.00 C +ATOM 125 CA VAL A 125 295.856 283.981 235.761 1.00 0.00 C +ATOM 126 CA THR A 126 295.002 280.396 234.794 1.00 0.00 C +ATOM 127 CA THR A 127 293.252 278.661 231.888 1.00 0.00 C +ATOM 128 CA ASP A 128 295.235 279.094 228.664 1.00 0.00 C +ATOM 129 CA ALA A 129 294.560 276.228 226.246 1.00 0.00 C +ATOM 130 CA SER A 130 292.593 273.498 228.034 1.00 0.00 C +ATOM 131 CA GLY A 131 291.967 270.333 230.061 1.00 0.00 C +ATOM 132 CA ARG A 132 294.871 267.955 230.716 1.00 0.00 C +ATOM 133 CA VAL A 133 297.701 266.011 229.064 1.00 0.00 C +ATOM 134 CA ARG A 134 300.046 266.187 226.067 1.00 0.00 C +ATOM 135 CA ARG A 135 299.752 263.483 223.399 1.00 0.00 C +ATOM 136 CA ARG A 136 296.809 261.226 222.526 1.00 0.00 C +ATOM 137 CA GLN A 137 296.538 260.910 218.739 1.00 0.00 C +ATOM 138 CA PRO A 138 297.252 257.911 216.500 1.00 0.00 C +ATOM 139 CA TRP A 139 298.094 254.570 218.125 1.00 0.00 C +ATOM 140 CA ARG A 140 298.957 250.923 217.437 1.00 0.00 C +ATOM 141 CA MET A 141 296.917 247.705 217.404 1.00 0.00 C +ATOM 142 CA ARG A 142 295.156 244.663 215.935 1.00 0.00 C +ATOM 143 CA ALA A 143 293.805 243.367 212.616 1.00 0.00 C +ATOM 144 CA ALA A 144 293.036 244.144 208.966 1.00 0.00 C +ATOM 145 CA VAL A 145 292.199 241.159 206.753 1.00 0.00 C +ATOM 146 CA THR A 146 291.405 242.660 203.342 1.00 0.00 C +ATOM 147 CA VAL A 147 288.437 244.043 201.394 1.00 0.00 C +ATOM 148 CA MET A 148 286.563 246.595 199.274 1.00 0.00 C +ATOM 149 CA ALA A 149 282.815 245.990 199.597 1.00 0.00 C +ATOM 150 CA ASP A 150 280.951 248.646 201.595 1.00 0.00 C +ATOM 151 CA ALA A 151 280.879 251.491 204.127 1.00 0.00 C +ATOM 152 CA GLY A 152 281.623 253.324 207.384 1.00 0.00 C +ATOM 153 CA SER A 153 280.739 256.222 209.693 1.00 0.00 C +ATOM 154 CA GLY A 154 282.004 259.589 208.437 1.00 0.00 C +ATOM 155 CA SER A 155 284.448 259.918 205.533 1.00 0.00 C +ATOM 156 CA GLY A 156 286.955 262.733 206.087 1.00 0.00 C +ATOM 157 CA HIS A 157 287.649 266.477 206.223 1.00 0.00 C +ATOM 158 CA ASP A 158 291.148 267.724 207.069 1.00 0.00 C +ATOM 159 CA GLY A 159 293.596 265.046 208.233 1.00 0.00 C +ATOM 160 CA ASP A 160 295.428 262.885 205.685 1.00 0.00 C +ATOM 161 CA GLY A 161 298.797 261.853 204.237 1.00 0.00 C +ATOM 162 CA SER A 162 298.918 258.671 202.146 1.00 0.00 C +ATOM 163 CA HIS A 163 298.019 256.798 198.952 1.00 0.00 C +ATOM 164 CA SER A 164 296.575 257.824 195.578 1.00 0.00 C +ATOM 165 CA GLY A 165 295.398 260.799 193.509 1.00 0.00 C +ATOM 166 CA ARG A 166 295.991 261.025 189.753 1.00 0.00 C +ATOM 167 CA GLY A 167 294.654 263.060 186.822 1.00 0.00 C +ATOM 168 CA ARG A 168 293.138 264.542 183.657 1.00 0.00 C +ATOM 169 CA GLY A 169 290.605 265.965 181.192 1.00 0.00 C +ATOM 170 CA GLN A 170 288.035 266.854 178.524 1.00 0.00 C +ATOM 171 CA ARG A 171 287.529 266.664 174.752 1.00 0.00 C +ATOM 172 CA GLN A 172 284.954 265.239 172.333 1.00 0.00 C +ATOM 173 CA SER A 173 281.384 265.506 171.027 1.00 0.00 C +ATOM 174 CA GLY A 174 278.453 264.012 169.107 1.00 0.00 C +ATOM 175 CA GLY A 175 278.592 260.590 167.438 1.00 0.00 C +ATOM 176 CA ALA A 176 276.499 257.628 166.270 1.00 0.00 C +TER 177 ALA A 176 +END diff --git a/Plants/Q8H3X0/Q8H3X0.dcd b/Plants/Q8H3X0/Q8H3X0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..eb50909a1a559ee189d0f61cb8e9a37dc51f6fdf --- /dev/null +++ b/Plants/Q8H3X0/Q8H3X0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:59071115900f6c7bcf5f0dc263a5943f9c500ef5c253883bac1caab304ad3a9a +size 14960276 diff --git a/Plants/Q8H3X0/top.pdb b/Plants/Q8H3X0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..b13a604c9b5d1afef94e0553517fb59c7e69304b --- /dev/null +++ b/Plants/Q8H3X0/top.pdb @@ -0,0 +1,122 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 224.768 261.869 290.770 1.00 0.00 C +ATOM 2 CA SER A 2 226.227 265.388 290.818 1.00 0.00 C +ATOM 3 CA ARG A 3 227.018 268.606 288.938 1.00 0.00 C +ATOM 4 CA PRO A 4 230.062 270.881 288.658 1.00 0.00 C +ATOM 5 CA VAL A 5 231.777 274.277 288.853 1.00 0.00 C +ATOM 6 CA GLY A 6 234.960 274.588 290.924 1.00 0.00 C +ATOM 7 CA PRO A 7 237.642 271.980 291.644 1.00 0.00 C +ATOM 8 CA THR A 8 238.777 268.630 290.227 1.00 0.00 C +ATOM 9 CA THR A 9 237.891 268.793 286.525 1.00 0.00 C +ATOM 10 CA THR A 10 240.567 269.709 283.972 1.00 0.00 C +ATOM 11 CA ARG A 11 241.375 266.848 281.589 1.00 0.00 C +ATOM 12 CA ARG A 12 241.316 263.280 282.923 1.00 0.00 C +ATOM 13 CA ALA A 13 240.895 259.699 284.155 1.00 0.00 C +ATOM 14 CA SER A 14 238.862 258.260 287.038 1.00 0.00 C +ATOM 15 CA ASP A 15 236.689 255.570 288.638 1.00 0.00 C +ATOM 16 CA LYS A 16 237.953 252.003 289.075 1.00 0.00 C +ATOM 17 CA ILE A 17 241.239 252.051 291.003 1.00 0.00 C +ATOM 18 CA ARG A 18 241.496 250.429 294.440 1.00 0.00 C +ATOM 19 CA ARG A 19 242.984 247.861 296.830 1.00 0.00 C +ATOM 20 CA GLU A 20 243.024 244.257 295.594 1.00 0.00 C +ATOM 21 CA GLY A 21 241.673 240.696 295.669 1.00 0.00 C +ATOM 22 CA ARG A 22 238.420 238.970 294.693 1.00 0.00 C +ATOM 23 CA GLN A 23 237.463 236.704 291.783 1.00 0.00 C +ATOM 24 CA ARG A 24 239.056 238.334 288.730 1.00 0.00 C +ATOM 25 CA GLN A 25 239.306 235.738 285.952 1.00 0.00 C +ATOM 26 CA GLY A 26 236.476 234.867 283.555 1.00 0.00 C +ATOM 27 CA ASP A 27 236.000 231.269 282.397 1.00 0.00 C +ATOM 28 CA GLY A 28 235.816 229.678 278.939 1.00 0.00 C +ATOM 29 CA GLY A 29 238.173 230.922 276.217 1.00 0.00 C +ATOM 30 CA GLY A 30 236.743 234.318 275.250 1.00 0.00 C +ATOM 31 CA GLU A 31 238.379 236.898 277.527 1.00 0.00 C +ATOM 32 CA ALA A 32 239.476 240.040 279.383 1.00 0.00 C +ATOM 33 CA MET A 33 241.827 243.001 279.857 1.00 0.00 C +ATOM 34 CA ALA A 34 242.757 245.254 276.929 1.00 0.00 C +ATOM 35 CA ARG A 35 245.018 247.299 274.644 1.00 0.00 C +ATOM 36 CA SER A 36 243.252 250.607 273.969 1.00 0.00 C +ATOM 37 CA TRP A 37 244.306 251.992 270.579 1.00 0.00 C +ATOM 38 CA ARG A 38 243.047 253.764 267.450 1.00 0.00 C +ATOM 39 CA ARG A 39 240.506 256.331 266.238 1.00 0.00 C +ATOM 40 CA GLY A 40 238.903 258.331 263.419 1.00 0.00 C +ATOM 41 CA GLY A 41 238.628 258.368 259.619 1.00 0.00 C +ATOM 42 CA GLY A 42 239.692 258.782 255.984 1.00 0.00 C +ATOM 43 CA GLY A 43 241.407 259.493 252.657 1.00 0.00 C +ATOM 44 CA GLY A 44 241.429 256.726 250.039 1.00 0.00 C +ATOM 45 CA ARG A 45 238.916 254.058 251.080 1.00 0.00 C +ATOM 46 CA ARG A 46 235.830 254.404 248.872 1.00 0.00 C +ATOM 47 CA GLY A 47 232.621 253.392 247.084 1.00 0.00 C +ATOM 48 CA GLY A 48 232.148 250.638 244.494 1.00 0.00 C +ATOM 49 CA GLY A 49 235.595 250.053 242.980 1.00 0.00 C +ATOM 50 CA SER A 50 236.711 246.670 244.331 1.00 0.00 C +ATOM 51 CA LYS A 51 235.280 244.585 247.181 1.00 0.00 C +ATOM 52 CA TRP A 52 232.728 242.137 248.599 1.00 0.00 C +ATOM 53 CA ARG A 53 232.762 238.349 249.002 1.00 0.00 C +ATOM 54 CA SER A 54 235.084 235.776 247.419 1.00 0.00 C +ATOM 55 CA SER A 55 234.002 235.508 243.776 1.00 0.00 C +ATOM 56 CA ARG A 56 232.698 237.906 241.118 1.00 0.00 C +ATOM 57 CA ALA A 57 233.336 239.661 237.797 1.00 0.00 C +ATOM 58 CA SER A 58 235.210 241.451 235.004 1.00 0.00 C +ATOM 59 CA ALA A 59 238.323 243.190 233.660 1.00 0.00 C +ATOM 60 CA ALA A 60 238.584 246.683 235.158 1.00 0.00 C +ATOM 61 CA ALA A 61 237.207 249.608 233.141 1.00 0.00 C +ATOM 62 CA THR A 62 239.193 252.433 231.532 1.00 0.00 C +ATOM 63 CA SER A 63 242.555 251.552 229.971 1.00 0.00 C +ATOM 64 CA PRO A 64 243.788 252.366 226.459 1.00 0.00 C +ATOM 65 CA PRO A 65 243.751 256.173 226.300 1.00 0.00 C +ATOM 66 CA PRO A 66 244.470 257.103 222.676 1.00 0.00 C +ATOM 67 CA ASP A 67 245.915 259.161 219.814 1.00 0.00 C +ATOM 68 CA PRO A 68 248.354 260.455 217.189 1.00 0.00 C +ATOM 69 CA ALA A 69 250.925 257.787 216.301 1.00 0.00 C +ATOM 70 CA GLY A 70 253.756 256.914 213.905 1.00 0.00 C +ATOM 71 CA GLY A 71 255.599 259.130 211.413 1.00 0.00 C +ATOM 72 CA GLU A 72 258.085 261.366 213.241 1.00 0.00 C +ATOM 73 CA ALA A 73 259.700 260.910 216.661 1.00 0.00 C +ATOM 74 CA THR A 74 259.573 258.684 219.751 1.00 0.00 C +ATOM 75 CA ALA A 75 262.465 258.416 222.217 1.00 0.00 C +ATOM 76 CA ALA A 76 263.865 254.892 221.846 1.00 0.00 C +ATOM 77 CA VAL A 77 267.674 254.938 221.902 1.00 0.00 C +ATOM 78 CA GLU A 78 271.477 254.859 222.113 1.00 0.00 C +ATOM 79 CA PRO A 79 274.029 255.769 224.792 1.00 0.00 C +ATOM 80 CA SER A 80 277.256 253.878 225.518 1.00 0.00 C +ATOM 81 CA PRO A 81 278.454 250.367 224.647 1.00 0.00 C +ATOM 82 CA PRO A 82 275.853 248.735 222.392 1.00 0.00 C +ATOM 83 CA PRO A 83 274.227 245.318 221.951 1.00 0.00 C +ATOM 84 CA ASP A 84 274.186 242.541 224.558 1.00 0.00 C +ATOM 85 CA PRO A 85 273.382 239.389 222.575 1.00 0.00 C +ATOM 86 CA ALA A 86 276.180 236.872 221.981 1.00 0.00 C +ATOM 87 CA ALA A 87 279.560 236.010 223.514 1.00 0.00 C +ATOM 88 CA ALA A 88 280.703 237.963 226.579 1.00 0.00 C +ATOM 89 CA THR A 89 277.462 238.780 228.408 1.00 0.00 C +ATOM 90 CA ILE A 90 275.381 240.608 231.024 1.00 0.00 C +ATOM 91 CA SER A 91 273.977 243.482 233.094 1.00 0.00 C +ATOM 92 CA PHE A 92 274.323 246.202 235.740 1.00 0.00 C +ATOM 93 CA ALA A 93 273.198 245.266 239.258 1.00 0.00 C +ATOM 94 CA CYS A 94 270.986 247.507 241.404 1.00 0.00 C +ATOM 95 CA GLY A 95 267.575 248.912 242.354 1.00 0.00 C +ATOM 96 CA ASN A 96 267.455 252.511 243.597 1.00 0.00 C +ATOM 97 CA ASP A 97 265.432 255.624 244.455 1.00 0.00 C +ATOM 98 CA GLY A 98 261.684 255.218 243.909 1.00 0.00 C +ATOM 99 CA GLY A 99 258.672 256.104 246.068 1.00 0.00 C +ATOM 100 CA GLY A 100 254.901 255.590 246.242 1.00 0.00 C +ATOM 101 CA LEU A 101 252.245 253.240 244.852 1.00 0.00 C +ATOM 102 CA PRO A 102 254.221 250.659 242.863 1.00 0.00 C +ATOM 103 CA THR A 103 255.863 251.163 239.463 1.00 0.00 C +ATOM 104 CA GLY A 104 258.530 248.487 238.975 1.00 0.00 C +ATOM 105 CA ASP A 105 261.601 250.329 237.675 1.00 0.00 C +ATOM 106 CA GLY A 106 261.128 253.705 235.975 1.00 0.00 C +ATOM 107 CA GLU A 107 260.146 255.232 232.625 1.00 0.00 C +ATOM 108 CA HIS A 108 262.530 254.178 229.846 1.00 0.00 C +ATOM 109 CA PRO A 109 263.101 250.418 230.085 1.00 0.00 C +ATOM 110 CA GLN A 110 261.880 246.913 229.227 1.00 0.00 C +ATOM 111 CA PRO A 111 263.837 243.730 229.972 1.00 0.00 C +ATOM 112 CA SER A 112 263.256 241.232 227.154 1.00 0.00 C +ATOM 113 CA ARG A 113 264.562 239.058 224.311 1.00 0.00 C +ATOM 114 CA SER A 114 264.348 236.867 221.201 1.00 0.00 C +ATOM 115 CA LEU A 115 266.804 236.545 218.306 1.00 0.00 C +ATOM 116 CA VAL A 116 265.659 235.614 214.793 1.00 0.00 C +ATOM 117 CA ALA A 117 267.061 237.975 212.153 1.00 0.00 C +ATOM 118 CA ALA A 118 266.895 237.443 208.384 1.00 0.00 C +TER 119 ALA A 118 +END diff --git a/Plants/Q8H3X6/Q8H3X6.dcd b/Plants/Q8H3X6/Q8H3X6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..8cc8f049b711aef2fe3c487c3240ba7ceeccd06b --- /dev/null +++ b/Plants/Q8H3X6/Q8H3X6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:614caceda8d9dca467c52e1f7e14dfba4612504e28e118cf24a47e3cec71479c +size 17960276 diff --git a/Plants/Q8H3X6/top.pdb b/Plants/Q8H3X6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..59a655cb92a0aade2805615f822e8bcdaa23c20a --- /dev/null +++ b/Plants/Q8H3X6/top.pdb @@ -0,0 +1,147 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 249.784 215.040 253.164 1.00 0.00 C +ATOM 2 CA THR A 2 248.691 217.575 250.538 1.00 0.00 C +ATOM 3 CA ALA A 3 247.092 220.745 249.154 1.00 0.00 C +ATOM 4 CA GLY A 4 245.011 223.078 251.332 1.00 0.00 C +ATOM 5 CA ARG A 5 241.839 221.836 253.039 1.00 0.00 C +ATOM 6 CA PHE A 6 238.752 221.823 250.807 1.00 0.00 C +ATOM 7 CA GLY A 7 235.714 224.067 251.310 1.00 0.00 C +ATOM 8 CA ALA A 8 235.536 226.963 253.780 1.00 0.00 C +ATOM 9 CA ALA A 9 232.117 227.128 255.454 1.00 0.00 C +ATOM 10 CA ARG A 10 228.422 227.109 254.527 1.00 0.00 C +ATOM 11 CA ARG A 11 226.536 224.058 253.242 1.00 0.00 C +ATOM 12 CA HIS A 12 226.888 223.257 249.534 1.00 0.00 C +ATOM 13 CA GLY A 13 230.409 224.028 248.299 1.00 0.00 C +ATOM 14 CA ARG A 14 232.022 223.401 244.905 1.00 0.00 C +ATOM 15 CA GLN A 15 235.401 224.076 243.278 1.00 0.00 C +ATOM 16 CA ALA A 16 238.209 224.909 240.842 1.00 0.00 C +ATOM 17 CA ARG A 17 241.793 225.966 240.096 1.00 0.00 C +ATOM 18 CA ALA A 18 244.005 229.006 239.483 1.00 0.00 C +ATOM 19 CA GLY A 19 246.170 230.361 236.655 1.00 0.00 C +ATOM 20 CA ALA A 20 246.857 233.629 234.822 1.00 0.00 C +ATOM 21 CA ALA A 21 247.760 236.197 232.156 1.00 0.00 C +ATOM 22 CA GLU A 22 250.670 237.208 229.914 1.00 0.00 C +ATOM 23 CA GLY A 23 252.929 234.437 228.598 1.00 0.00 C +ATOM 24 CA ASP A 24 255.594 233.374 226.091 1.00 0.00 C +ATOM 25 CA GLY A 25 259.000 234.130 227.620 1.00 0.00 C +ATOM 26 CA GLY A 26 261.541 236.448 229.259 1.00 0.00 C +ATOM 27 CA GLY A 27 260.137 239.982 229.037 1.00 0.00 C +ATOM 28 CA ASP A 28 260.249 243.331 230.852 1.00 0.00 C +ATOM 29 CA GLN A 29 262.140 245.679 228.522 1.00 0.00 C +ATOM 30 CA ALA A 30 262.132 247.194 225.026 1.00 0.00 C +ATOM 31 CA VAL A 31 262.621 250.832 224.007 1.00 0.00 C +ATOM 32 CA GLY A 32 261.322 251.003 220.430 1.00 0.00 C +ATOM 33 CA HIS A 33 263.489 248.787 218.214 1.00 0.00 C +ATOM 34 CA HIS A 34 263.237 245.036 217.598 1.00 0.00 C +ATOM 35 CA GLY A 35 266.027 243.243 219.473 1.00 0.00 C +ATOM 36 CA THR A 36 268.449 245.999 220.501 1.00 0.00 C +ATOM 37 CA ARG A 37 270.294 248.506 222.697 1.00 0.00 C +ATOM 38 CA ALA A 38 272.647 248.087 225.665 1.00 0.00 C +ATOM 39 CA ARG A 39 271.806 246.988 229.215 1.00 0.00 C +ATOM 40 CA ASP A 40 268.582 248.534 230.530 1.00 0.00 C +ATOM 41 CA ALA A 41 265.589 250.849 230.978 1.00 0.00 C +ATOM 42 CA THR A 42 264.023 254.119 232.149 1.00 0.00 C +ATOM 43 CA GLY A 43 260.782 256.114 232.320 1.00 0.00 C +ATOM 44 CA GLY A 44 257.214 256.373 231.010 1.00 0.00 C +ATOM 45 CA ALA A 45 256.051 253.164 229.317 1.00 0.00 C +ATOM 46 CA ALA A 46 256.564 249.460 228.586 1.00 0.00 C +ATOM 47 CA ALA A 47 254.076 247.997 226.098 1.00 0.00 C +ATOM 48 CA ALA A 48 250.802 247.686 224.176 1.00 0.00 C +ATOM 49 CA GLY A 49 248.059 246.467 226.523 1.00 0.00 C +ATOM 50 CA GLN A 50 245.129 248.874 226.889 1.00 0.00 C +ATOM 51 CA ARG A 51 242.183 249.055 229.298 1.00 0.00 C +ATOM 52 CA ASP A 52 238.929 251.037 229.244 1.00 0.00 C +ATOM 53 CA ARG A 53 238.171 252.395 225.766 1.00 0.00 C +ATOM 54 CA VAL A 54 238.098 255.998 224.529 1.00 0.00 C +ATOM 55 CA THR A 55 237.823 258.102 227.694 1.00 0.00 C +ATOM 56 CA ARG A 56 239.790 257.979 230.954 1.00 0.00 C +ATOM 57 CA THR A 57 242.039 259.047 233.838 1.00 0.00 C +ATOM 58 CA ALA A 58 240.461 259.558 237.268 1.00 0.00 C +ATOM 59 CA ARG A 59 240.860 261.181 240.691 1.00 0.00 C +ATOM 60 CA THR A 60 243.156 260.964 243.725 1.00 0.00 C +ATOM 61 CA ALA A 61 245.613 263.867 243.501 1.00 0.00 C +ATOM 62 CA ARG A 62 248.653 265.699 242.114 1.00 0.00 C +ATOM 63 CA HIS A 63 252.022 265.840 240.342 1.00 0.00 C +ATOM 64 CA GLY A 64 254.145 267.403 237.591 1.00 0.00 C +ATOM 65 CA ARG A 65 257.039 269.753 236.805 1.00 0.00 C +ATOM 66 CA GLN A 66 260.214 271.859 236.869 1.00 0.00 C +ATOM 67 CA PRO A 67 263.994 272.019 236.418 1.00 0.00 C +ATOM 68 CA ARG A 68 266.341 269.908 238.552 1.00 0.00 C +ATOM 69 CA GLY A 69 268.994 267.403 237.457 1.00 0.00 C +ATOM 70 CA ARG A 70 270.458 265.311 234.629 1.00 0.00 C +ATOM 71 CA ALA A 71 272.464 262.326 233.372 1.00 0.00 C +ATOM 72 CA ARG A 72 275.130 260.048 234.861 1.00 0.00 C +ATOM 73 CA ALA A 73 274.534 257.232 237.358 1.00 0.00 C +ATOM 74 CA ASN A 74 274.492 257.564 241.153 1.00 0.00 C +ATOM 75 CA ASP A 75 272.480 257.007 244.340 1.00 0.00 C +ATOM 76 CA ALA A 76 273.423 257.697 247.966 1.00 0.00 C +ATOM 77 CA ARG A 77 273.191 260.616 250.404 1.00 0.00 C +ATOM 78 CA GLY A 78 269.513 260.992 251.324 1.00 0.00 C +ATOM 79 CA ALA A 79 266.488 259.232 249.817 1.00 0.00 C +ATOM 80 CA ALA A 80 264.972 255.745 250.063 1.00 0.00 C +ATOM 81 CA ALA A 81 261.572 255.687 248.344 1.00 0.00 C +ATOM 82 CA ARG A 82 258.717 258.088 247.571 1.00 0.00 C +ATOM 83 CA GLU A 83 259.231 261.709 246.501 1.00 0.00 C +ATOM 84 CA ARG A 84 260.272 264.082 243.708 1.00 0.00 C +ATOM 85 CA ARG A 85 262.069 267.402 243.194 1.00 0.00 C +ATOM 86 CA GLY A 86 262.064 270.711 245.084 1.00 0.00 C +ATOM 87 CA GLU A 87 261.819 274.068 246.868 1.00 0.00 C +ATOM 88 CA LEU A 88 264.413 274.511 249.624 1.00 0.00 C +ATOM 89 CA GLY A 89 267.686 274.618 251.571 1.00 0.00 C +ATOM 90 CA SER A 90 269.444 273.776 254.845 1.00 0.00 C +ATOM 91 CA ALA A 91 269.234 270.591 256.926 1.00 0.00 C +ATOM 92 CA PRO A 92 267.194 268.058 254.941 1.00 0.00 C +ATOM 93 CA ALA A 93 263.517 268.174 253.951 1.00 0.00 C +ATOM 94 CA LEU A 94 261.071 265.460 255.033 1.00 0.00 C +ATOM 95 CA ALA A 95 258.966 262.352 254.385 1.00 0.00 C +ATOM 96 CA HIS A 96 258.075 259.208 256.344 1.00 0.00 C +ATOM 97 CA ALA A 97 257.217 255.612 257.266 1.00 0.00 C +ATOM 98 CA ALA A 98 254.545 253.341 255.777 1.00 0.00 C +ATOM 99 CA ARG A 99 253.321 254.296 252.298 1.00 0.00 C +ATOM 100 CA GLY A 100 250.126 252.475 251.299 1.00 0.00 C +ATOM 101 CA GLN A 101 248.980 248.982 252.300 1.00 0.00 C +ATOM 102 CA SER A 102 249.626 246.116 254.725 1.00 0.00 C +ATOM 103 CA GLY A 103 251.450 244.434 257.617 1.00 0.00 C +ATOM 104 CA ALA A 104 250.036 241.050 258.650 1.00 0.00 C +ATOM 105 CA GLU A 105 250.167 240.050 262.324 1.00 0.00 C +ATOM 106 CA GLY A 106 250.087 241.138 265.974 1.00 0.00 C +ATOM 107 CA GLU A 107 248.374 238.448 268.058 1.00 0.00 C +ATOM 108 CA ARG A 108 248.974 234.950 266.672 1.00 0.00 C +ATOM 109 CA ALA A 109 249.574 232.597 263.736 1.00 0.00 C +ATOM 110 CA ARG A 110 248.169 232.390 260.201 1.00 0.00 C +ATOM 111 CA GLU A 111 245.730 234.828 258.581 1.00 0.00 C +ATOM 112 CA LYS A 112 244.736 237.157 255.735 1.00 0.00 C +ATOM 113 CA GLU A 113 244.689 240.933 255.224 1.00 0.00 C +ATOM 114 CA SER A 114 242.019 242.425 257.496 1.00 0.00 C +ATOM 115 CA GLU A 115 240.916 245.915 258.553 1.00 0.00 C +ATOM 116 CA ARG A 116 240.500 246.336 262.317 1.00 0.00 C +ATOM 117 CA ARG A 117 237.577 248.605 263.224 1.00 0.00 C +ATOM 118 CA GLU A 118 237.062 252.030 264.812 1.00 0.00 C +ATOM 119 CA GLY A 119 237.772 255.405 266.431 1.00 0.00 C +ATOM 120 CA GLY A 120 241.542 255.848 266.105 1.00 0.00 C +ATOM 121 CA GLY A 121 244.947 254.189 265.692 1.00 0.00 C +ATOM 122 CA ASP A 122 246.020 251.364 268.011 1.00 0.00 C +ATOM 123 CA GLY A 123 244.215 249.083 270.472 1.00 0.00 C +ATOM 124 CA PRO A 124 241.966 249.277 273.541 1.00 0.00 C +ATOM 125 CA ARG A 125 240.225 248.635 276.869 1.00 0.00 C +ATOM 126 CA GLU A 126 238.160 249.603 279.921 1.00 0.00 C +ATOM 127 CA ILE A 127 234.361 249.791 280.137 1.00 0.00 C +ATOM 128 CA ARG A 128 232.164 251.174 282.925 1.00 0.00 C +ATOM 129 CA PRO A 129 230.158 254.035 281.405 1.00 0.00 C +ATOM 130 CA ILE A 130 227.804 255.557 278.825 1.00 0.00 C +ATOM 131 CA ASP A 131 225.169 258.294 279.110 1.00 0.00 C +ATOM 132 CA PRO A 132 225.160 260.653 282.102 1.00 0.00 C +ATOM 133 CA GLY A 133 223.086 258.905 284.777 1.00 0.00 C +ATOM 134 CA GLY A 134 223.387 259.197 288.564 1.00 0.00 C +ATOM 135 CA GLY A 135 226.174 258.768 291.126 1.00 0.00 C +ATOM 136 CA LYS A 136 228.588 259.701 293.922 1.00 0.00 C +ATOM 137 CA ILE A 137 232.102 260.471 295.177 1.00 0.00 C +ATOM 138 CA ASP A 138 234.267 262.776 297.302 1.00 0.00 C +ATOM 139 CA PHE A 139 233.617 262.934 301.053 1.00 0.00 C +ATOM 140 CA CYS A 140 230.721 262.026 303.356 1.00 0.00 C +ATOM 141 CA GLY A 141 229.216 264.822 305.460 1.00 0.00 C +ATOM 142 CA GLY A 142 228.113 265.125 309.094 1.00 0.00 C +ATOM 143 CA ILE A 143 226.018 262.776 311.241 1.00 0.00 C +TER 144 ILE A 143 +END diff --git a/Plants/Q8H411/Q8H411.dcd b/Plants/Q8H411/Q8H411.dcd new file mode 100644 index 0000000000000000000000000000000000000000..58d70f6349659a246799948169c4ba45b2e4cb32 --- /dev/null +++ b/Plants/Q8H411/Q8H411.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:619525a44c357ff554b6592e15375c9a1afe7741c879454fdf420f25711ab30b +size 16280276 diff --git a/Plants/Q8H411/top.pdb b/Plants/Q8H411/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..932c5cff2f7ade148f414390db909c6ea806dd19 --- /dev/null +++ b/Plants/Q8H411/top.pdb @@ -0,0 +1,133 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 292.996 244.775 240.685 1.00 0.00 C +ATOM 2 CA HIS A 2 289.342 245.744 240.209 1.00 0.00 C +ATOM 3 CA GLN A 3 286.828 246.535 242.960 1.00 0.00 C +ATOM 4 CA HIS A 4 283.306 247.542 241.910 1.00 0.00 C +ATOM 5 CA LYS A 5 279.738 246.227 242.147 1.00 0.00 C +ATOM 6 CA SER A 6 278.155 243.071 243.580 1.00 0.00 C +ATOM 7 CA THR A 7 280.499 241.842 246.321 1.00 0.00 C +ATOM 8 CA GLY A 8 281.315 238.455 247.865 1.00 0.00 C +ATOM 9 CA ALA A 9 280.538 234.759 247.370 1.00 0.00 C +ATOM 10 CA GLY A 10 281.748 232.206 244.813 1.00 0.00 C +ATOM 11 CA ALA A 11 283.592 231.610 241.533 1.00 0.00 C +ATOM 12 CA ILE A 12 285.460 231.683 238.213 1.00 0.00 C +ATOM 13 CA ARG A 13 282.874 232.443 235.519 1.00 0.00 C +ATOM 14 CA PRO A 14 281.586 236.028 235.609 1.00 0.00 C +ATOM 15 CA HIS A 15 277.806 235.745 235.228 1.00 0.00 C +ATOM 16 CA LEU A 16 275.864 232.488 234.865 1.00 0.00 C +ATOM 17 CA SER A 17 272.137 232.732 234.109 1.00 0.00 C +ATOM 18 CA SER A 18 271.497 232.994 230.362 1.00 0.00 C +ATOM 19 CA ARG A 19 269.086 235.475 228.767 1.00 0.00 C +ATOM 20 CA LEU A 20 266.372 237.124 230.874 1.00 0.00 C +ATOM 21 CA SER A 21 264.577 234.523 233.002 1.00 0.00 C +ATOM 22 CA GLY A 22 264.234 231.249 234.920 1.00 0.00 C +ATOM 23 CA SER A 23 265.225 229.624 238.221 1.00 0.00 C +ATOM 24 CA GLU A 24 265.752 226.079 239.514 1.00 0.00 C +ATOM 25 CA GLY A 25 268.420 223.896 241.137 1.00 0.00 C +ATOM 26 CA VAL A 26 268.874 221.731 244.239 1.00 0.00 C +ATOM 27 CA GLY A 27 272.494 220.890 245.077 1.00 0.00 C +ATOM 28 CA ALA A 28 274.597 219.241 247.793 1.00 0.00 C +ATOM 29 CA ALA A 29 277.476 220.884 249.672 1.00 0.00 C +ATOM 30 CA SER A 30 280.481 223.093 250.448 1.00 0.00 C +ATOM 31 CA GLY A 31 282.383 221.191 253.146 1.00 0.00 C +ATOM 32 CA GLY A 32 283.821 223.754 255.571 1.00 0.00 C +ATOM 33 CA VAL A 33 283.286 227.400 256.539 1.00 0.00 C +ATOM 34 CA GLU A 34 280.309 229.686 255.885 1.00 0.00 C +ATOM 35 CA GLN A 35 279.686 229.839 252.130 1.00 0.00 C +ATOM 36 CA GLY A 36 276.327 228.116 251.613 1.00 0.00 C +ATOM 37 CA ARG A 37 273.378 228.499 249.232 1.00 0.00 C +ATOM 38 CA LEU A 38 270.335 229.041 247.003 1.00 0.00 C +ATOM 39 CA ARG A 39 268.810 232.524 246.768 1.00 0.00 C +ATOM 40 CA ARG A 40 267.316 233.133 250.220 1.00 0.00 C +ATOM 41 CA GLY A 41 264.413 231.087 251.598 1.00 0.00 C +ATOM 42 CA VAL A 42 265.896 229.034 254.445 1.00 0.00 C +ATOM 43 CA GLY A 43 264.991 230.620 257.788 1.00 0.00 C +ATOM 44 CA GLN A 44 262.425 228.903 260.021 1.00 0.00 C +ATOM 45 CA HIS A 45 262.237 231.027 263.178 1.00 0.00 C +ATOM 46 CA ARG A 46 264.602 232.707 265.648 1.00 0.00 C +ATOM 47 CA PRO A 47 267.768 234.698 264.920 1.00 0.00 C +ATOM 48 CA ALA A 48 271.024 235.806 263.281 1.00 0.00 C +ATOM 49 CA TRP A 49 272.147 236.614 259.731 1.00 0.00 C +ATOM 50 CA GLY A 50 269.748 237.519 256.913 1.00 0.00 C +ATOM 51 CA GLY A 51 268.500 241.100 256.544 1.00 0.00 C +ATOM 52 CA ARG A 52 265.772 242.316 254.179 1.00 0.00 C +ATOM 53 CA TRP A 53 266.643 245.702 252.664 1.00 0.00 C +ATOM 54 CA GLY A 54 269.579 248.030 251.978 1.00 0.00 C +ATOM 55 CA ASP A 55 270.053 248.991 248.321 1.00 0.00 C +ATOM 56 CA GLY A 56 269.991 246.294 245.631 1.00 0.00 C +ATOM 57 CA ARG A 57 268.063 243.019 245.366 1.00 0.00 C +ATOM 58 CA ARG A 58 264.922 240.995 246.111 1.00 0.00 C +ATOM 59 CA ALA A 59 262.558 241.021 249.099 1.00 0.00 C +ATOM 60 CA ALA A 60 259.579 238.650 249.247 1.00 0.00 C +ATOM 61 CA TRP A 61 256.120 239.966 248.343 1.00 0.00 C +ATOM 62 CA GLY A 62 253.664 239.426 245.481 1.00 0.00 C +ATOM 63 CA GLY A 63 250.299 239.464 243.695 1.00 0.00 C +ATOM 64 CA VAL A 64 247.082 240.004 245.664 1.00 0.00 C +ATOM 65 CA GLY A 65 246.719 242.217 248.745 1.00 0.00 C +ATOM 66 CA TRP A 66 249.700 244.493 249.418 1.00 0.00 C +ATOM 67 CA ARG A 67 252.434 247.146 249.471 1.00 0.00 C +ATOM 68 CA GLY A 68 256.163 246.644 248.872 1.00 0.00 C +ATOM 69 CA GLY A 69 258.440 248.586 246.514 1.00 0.00 C +ATOM 70 CA GLY A 70 257.119 252.157 246.653 1.00 0.00 C +ATOM 71 CA ARG A 71 254.247 253.994 244.953 1.00 0.00 C +ATOM 72 CA ARG A 72 254.488 254.628 241.203 1.00 0.00 C +ATOM 73 CA GLY A 73 251.543 256.066 239.260 1.00 0.00 C +ATOM 74 CA ASP A 74 249.713 258.849 241.110 1.00 0.00 C +ATOM 75 CA GLY A 75 247.954 261.312 238.796 1.00 0.00 C +ATOM 76 CA ARG A 76 244.274 261.616 239.735 1.00 0.00 C +ATOM 77 CA ARG A 77 242.345 263.936 242.061 1.00 0.00 C +ATOM 78 CA SER A 78 239.057 263.147 243.817 1.00 0.00 C +ATOM 79 CA ARG A 79 236.134 262.143 241.588 1.00 0.00 C +ATOM 80 CA ALA A 80 232.773 261.887 243.363 1.00 0.00 C +ATOM 81 CA ALA A 81 230.943 258.560 243.053 1.00 0.00 C +ATOM 82 CA PRO A 82 227.725 257.336 241.420 1.00 0.00 C +ATOM 83 CA GLY A 83 225.834 259.618 239.026 1.00 0.00 C +ATOM 84 CA ASP A 84 222.740 260.874 240.859 1.00 0.00 C +ATOM 85 CA ALA A 85 221.717 263.539 243.383 1.00 0.00 C +ATOM 86 CA ALA A 86 219.969 266.876 242.817 1.00 0.00 C +ATOM 87 CA ARG A 87 216.410 268.150 243.296 1.00 0.00 C +ATOM 88 CA ASP A 88 213.490 267.166 241.056 1.00 0.00 C +ATOM 89 CA GLY A 89 213.547 263.357 241.066 1.00 0.00 C +ATOM 90 CA GLY A 90 213.223 260.133 243.071 1.00 0.00 C +ATOM 91 CA SER A 91 211.946 256.817 244.445 1.00 0.00 C +ATOM 92 CA THR A 92 209.582 254.486 242.576 1.00 0.00 C +ATOM 93 CA GLY A 93 205.905 253.522 242.322 1.00 0.00 C +ATOM 94 CA GLY A 94 202.868 255.793 241.957 1.00 0.00 C +ATOM 95 CA GLY A 95 202.011 258.628 239.560 1.00 0.00 C +ATOM 96 CA ALA A 96 202.655 262.178 240.784 1.00 0.00 C +ATOM 97 CA ASN A 97 204.044 263.147 244.197 1.00 0.00 C +ATOM 98 CA PRO A 98 205.200 261.744 247.545 1.00 0.00 C +ATOM 99 CA SER A 99 205.062 263.437 250.956 1.00 0.00 C +ATOM 100 CA ALA A 100 206.284 266.858 252.105 1.00 0.00 C +ATOM 101 CA ALA A 101 209.556 266.538 254.029 1.00 0.00 C +ATOM 102 CA SER A 102 208.729 267.380 257.652 1.00 0.00 C +ATOM 103 CA ASN A 103 211.085 266.665 260.559 1.00 0.00 C +ATOM 104 CA ARG A 104 210.498 265.461 264.126 1.00 0.00 C +ATOM 105 CA GLU A 105 213.355 263.091 264.987 1.00 0.00 C +ATOM 106 CA TRP A 106 216.872 264.207 265.935 1.00 0.00 C +ATOM 107 CA PRO A 107 219.415 262.801 268.400 1.00 0.00 C +ATOM 108 CA GLY A 108 220.152 259.067 268.224 1.00 0.00 C +ATOM 109 CA ALA A 109 221.904 257.468 271.206 1.00 0.00 C +ATOM 110 CA ARG A 110 225.119 258.961 272.602 1.00 0.00 C +ATOM 111 CA SER A 111 227.034 262.191 271.957 1.00 0.00 C +ATOM 112 CA ARG A 112 224.786 265.267 271.970 1.00 0.00 C +ATOM 113 CA GLU A 113 226.219 268.795 271.835 1.00 0.00 C +ATOM 114 CA LYS A 114 224.033 271.732 270.783 1.00 0.00 C +ATOM 115 CA GLY A 115 225.713 274.054 268.272 1.00 0.00 C +ATOM 116 CA ASN A 116 226.438 274.148 264.533 1.00 0.00 C +ATOM 117 CA GLY A 117 228.919 276.028 262.337 1.00 0.00 C +ATOM 118 CA LYS A 118 229.978 279.624 263.018 1.00 0.00 C +ATOM 119 CA GLU A 119 231.954 282.658 264.204 1.00 0.00 C +ATOM 120 CA ARG A 120 233.155 285.445 266.508 1.00 0.00 C +ATOM 121 CA LYS A 121 236.307 287.181 265.257 1.00 0.00 C +ATOM 122 CA LYS A 122 238.499 288.503 262.435 1.00 0.00 C +ATOM 123 CA GLU A 123 240.000 288.074 258.959 1.00 0.00 C +ATOM 124 CA ARG A 124 240.276 285.343 256.318 1.00 0.00 C +ATOM 125 CA ILE A 125 241.351 281.807 255.390 1.00 0.00 C +ATOM 126 CA VAL A 126 243.464 280.448 258.254 1.00 0.00 C +ATOM 127 CA PHE A 127 244.827 280.750 261.799 1.00 0.00 C +ATOM 128 CA PHE A 128 245.064 283.367 264.558 1.00 0.00 C +ATOM 129 CA SER A 129 244.447 285.046 267.922 1.00 0.00 C +TER 130 SER A 129 +END diff --git a/Plants/Q8H442/Q8H442.dcd b/Plants/Q8H442/Q8H442.dcd new file mode 100644 index 0000000000000000000000000000000000000000..fabd515817c8fe7bdc55c5ab67071569b775a387 --- /dev/null +++ b/Plants/Q8H442/Q8H442.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:9149e17ee8a791fd592ab4eb122d8e2137cf72c4fae4a44b90613b90b9ff0028 +size 9320276 diff --git a/Plants/Q8H442/top.pdb b/Plants/Q8H442/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..07df713fc517893e2759fba14529b95e159184a2 --- /dev/null +++ b/Plants/Q8H442/top.pdb @@ -0,0 +1,75 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 285.082 268.208 240.179 1.00 0.00 C +ATOM 2 CA TYR A 2 286.405 270.835 237.758 1.00 0.00 C +ATOM 3 CA ARG A 3 284.842 271.943 234.464 1.00 0.00 C +ATOM 4 CA SER A 4 281.096 271.628 233.841 1.00 0.00 C +ATOM 5 CA ASN A 5 277.609 272.945 233.055 1.00 0.00 C +ATOM 6 CA SER A 6 276.882 276.619 232.353 1.00 0.00 C +ATOM 7 CA SER A 7 273.495 277.339 230.765 1.00 0.00 C +ATOM 8 CA GLY A 8 270.125 277.478 228.992 1.00 0.00 C +ATOM 9 CA GLY A 9 266.854 277.697 227.050 1.00 0.00 C +ATOM 10 CA GLY A 10 263.209 276.612 227.275 1.00 0.00 C +ATOM 11 CA ARG A 11 261.814 276.256 230.803 1.00 0.00 C +ATOM 12 CA SER A 12 262.299 274.082 233.893 1.00 0.00 C +ATOM 13 CA ARG A 13 264.357 274.703 237.039 1.00 0.00 C +ATOM 14 CA GLY A 14 268.114 275.330 236.969 1.00 0.00 C +ATOM 15 CA HIS A 15 270.240 277.926 238.774 1.00 0.00 C +ATOM 16 CA GLY A 16 271.033 277.602 242.487 1.00 0.00 C +ATOM 17 CA PHE A 17 272.509 276.705 245.883 1.00 0.00 C +ATOM 18 CA ASP A 18 271.811 277.211 249.594 1.00 0.00 C +ATOM 19 CA ASP A 19 268.662 278.471 251.330 1.00 0.00 C +ATOM 20 CA ASP A 20 265.269 280.168 250.978 1.00 0.00 C +ATOM 21 CA ASP A 21 262.996 279.236 248.065 1.00 0.00 C +ATOM 22 CA PHE A 22 261.358 275.807 248.342 1.00 0.00 C +ATOM 23 CA VAL A 23 260.178 272.198 248.033 1.00 0.00 C +ATOM 24 CA SER A 24 258.142 269.787 245.898 1.00 0.00 C +ATOM 25 CA ALA A 25 258.891 266.189 244.893 1.00 0.00 C +ATOM 26 CA MET A 26 259.554 263.717 247.715 1.00 0.00 C +ATOM 27 CA ALA A 27 262.112 263.357 250.516 1.00 0.00 C +ATOM 28 CA SER A 28 260.614 260.934 253.046 1.00 0.00 C +ATOM 29 CA PRO A 29 258.583 258.519 250.912 1.00 0.00 C +ATOM 30 CA GLN A 30 256.704 255.261 251.523 1.00 0.00 C +ATOM 31 CA GLN A 31 255.971 252.747 248.756 1.00 0.00 C +ATOM 32 CA ILE A 32 256.118 250.201 245.925 1.00 0.00 C +ATOM 33 CA LEU A 33 258.919 247.700 245.282 1.00 0.00 C +ATOM 34 CA LEU A 34 257.538 244.251 246.124 1.00 0.00 C +ATOM 35 CA HIS A 35 254.371 242.148 246.382 1.00 0.00 C +ATOM 36 CA SER A 36 251.550 239.928 245.106 1.00 0.00 C +ATOM 37 CA VAL A 37 248.284 239.383 246.992 1.00 0.00 C +ATOM 38 CA LYS A 38 246.503 240.998 249.948 1.00 0.00 C +ATOM 39 CA GLU A 39 244.915 240.076 253.286 1.00 0.00 C +ATOM 40 CA THR A 40 243.970 241.700 256.600 1.00 0.00 C +ATOM 41 CA SER A 41 241.926 241.630 259.814 1.00 0.00 C +ATOM 42 CA GLY A 42 241.999 243.186 263.291 1.00 0.00 C +ATOM 43 CA ASN A 43 239.353 244.662 265.601 1.00 0.00 C +ATOM 44 CA ASP A 44 238.188 243.291 268.960 1.00 0.00 C +ATOM 45 CA GLU A 45 239.094 239.742 270.010 1.00 0.00 C +ATOM 46 CA GLU A 46 240.004 237.357 267.182 1.00 0.00 C +ATOM 47 CA ASN A 47 239.448 236.757 263.461 1.00 0.00 C +ATOM 48 CA GLY A 48 236.645 236.914 260.885 1.00 0.00 C +ATOM 49 CA SER A 49 233.056 236.146 261.906 1.00 0.00 C +ATOM 50 CA SER A 50 229.995 234.818 263.746 1.00 0.00 C +ATOM 51 CA SER A 51 229.680 233.743 267.387 1.00 0.00 C +ATOM 52 CA GLY A 52 226.631 233.011 269.551 1.00 0.00 C +ATOM 53 CA GLY A 53 225.961 230.813 272.590 1.00 0.00 C +ATOM 54 CA ALA A 54 225.438 227.079 272.044 1.00 0.00 C +ATOM 55 CA GLN A 55 223.982 225.471 268.911 1.00 0.00 C +ATOM 56 CA ASP A 56 226.854 224.577 266.573 1.00 0.00 C +ATOM 57 CA HIS A 57 230.190 222.920 265.773 1.00 0.00 C +ATOM 58 CA TRP A 58 232.409 223.295 262.699 1.00 0.00 C +ATOM 59 CA ILE A 59 236.089 223.517 261.735 1.00 0.00 C +ATOM 60 CA ARG A 60 238.013 223.643 258.449 1.00 0.00 C +ATOM 61 CA LEU A 61 236.534 222.276 255.215 1.00 0.00 C +ATOM 62 CA HIS A 62 234.032 220.135 253.298 1.00 0.00 C +ATOM 63 CA GLY A 63 231.838 220.263 250.186 1.00 0.00 C +ATOM 64 CA GLY A 64 231.720 223.867 248.955 1.00 0.00 C +ATOM 65 CA LYS A 65 233.557 226.631 247.085 1.00 0.00 C +ATOM 66 CA ARG A 66 231.304 228.686 244.801 1.00 0.00 C +ATOM 67 CA GLU A 67 228.913 227.337 242.160 1.00 0.00 C +ATOM 68 CA GLY A 68 225.276 227.180 243.283 1.00 0.00 C +ATOM 69 CA TRP A 69 222.161 228.678 244.885 1.00 0.00 C +ATOM 70 CA TRP A 70 219.754 225.773 245.419 1.00 0.00 C +ATOM 71 CA TRP A 71 220.980 222.708 247.322 1.00 0.00 C +TER 72 TRP A 71 +END diff --git a/Plants/Q8H444/Q8H444.dcd b/Plants/Q8H444/Q8H444.dcd new file mode 100644 index 0000000000000000000000000000000000000000..0133072bd4867f3a69bd449e33caca1f0701b499 --- /dev/null +++ b/Plants/Q8H444/Q8H444.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:345f9513ee332d643ac3500bf90a5067486ea64715c6506e99ce8990403a635c +size 11240276 diff --git a/Plants/Q8H444/top.pdb b/Plants/Q8H444/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..3f9c0959709df120ed33eb954eb0f4390e299576 --- /dev/null +++ b/Plants/Q8H444/top.pdb @@ -0,0 +1,91 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 265.709 296.760 267.310 1.00 0.00 C +ATOM 2 CA ALA A 2 262.255 296.355 265.753 1.00 0.00 C +ATOM 3 CA VAL A 3 260.507 293.083 266.625 1.00 0.00 C +ATOM 4 CA VAL A 4 257.240 291.820 265.126 1.00 0.00 C +ATOM 5 CA ARG A 5 256.268 293.719 261.969 1.00 0.00 C +ATOM 6 CA LYS A 6 256.278 297.513 262.325 1.00 0.00 C +ATOM 7 CA ARG A 7 255.453 300.526 260.145 1.00 0.00 C +ATOM 8 CA PRO A 8 256.810 301.625 256.758 1.00 0.00 C +ATOM 9 CA TRP A 9 257.545 305.322 256.205 1.00 0.00 C +ATOM 10 CA MET A 10 257.665 306.788 259.720 1.00 0.00 C +ATOM 11 CA ARG A 11 261.257 306.276 260.883 1.00 0.00 C +ATOM 12 CA ARG A 12 264.866 305.796 259.762 1.00 0.00 C +ATOM 13 CA HIS A 13 267.658 308.116 258.604 1.00 0.00 C +ATOM 14 CA GLN A 14 270.746 307.163 256.586 1.00 0.00 C +ATOM 15 CA ALA A 15 269.883 306.542 252.927 1.00 0.00 C +ATOM 16 CA TRP A 16 266.984 304.810 251.165 1.00 0.00 C +ATOM 17 CA PRO A 17 264.669 303.534 253.910 1.00 0.00 C +ATOM 18 CA ALA A 18 262.938 300.143 254.051 1.00 0.00 C +ATOM 19 CA THR A 19 261.667 296.563 253.761 1.00 0.00 C +ATOM 20 CA ALA A 20 263.521 294.546 256.409 1.00 0.00 C +ATOM 21 CA MET A 21 264.361 295.622 259.966 1.00 0.00 C +ATOM 22 CA GLU A 22 266.260 292.894 261.829 1.00 0.00 C +ATOM 23 CA ASP A 23 265.981 289.136 261.273 1.00 0.00 C +ATOM 24 CA ASP A 24 265.845 287.449 257.859 1.00 0.00 C +ATOM 25 CA GLY A 25 267.073 283.928 257.075 1.00 0.00 C +ATOM 26 CA ARG A 26 270.855 283.522 256.849 1.00 0.00 C +ATOM 27 CA LYS A 27 272.821 283.450 253.586 1.00 0.00 C +ATOM 28 CA ASP A 28 273.439 281.401 250.434 1.00 0.00 C +ATOM 29 CA ASP A 29 271.290 281.095 247.303 1.00 0.00 C +ATOM 30 CA ALA A 30 271.541 277.853 245.318 1.00 0.00 C +ATOM 31 CA ALA A 31 274.069 275.204 244.265 1.00 0.00 C +ATOM 32 CA ALA A 32 272.312 271.846 244.659 1.00 0.00 C +ATOM 33 CA ALA A 33 268.546 271.655 245.197 1.00 0.00 C +ATOM 34 CA PRO A 34 266.759 268.371 244.461 1.00 0.00 C +ATOM 35 CA GLY A 35 266.705 266.601 241.088 1.00 0.00 C +ATOM 36 CA ARG A 36 264.579 264.949 238.392 1.00 0.00 C +ATOM 37 CA ASP A 37 261.678 263.345 240.268 1.00 0.00 C +ATOM 38 CA SER A 38 258.436 261.601 239.285 1.00 0.00 C +ATOM 39 CA HIS A 39 258.939 257.985 238.193 1.00 0.00 C +ATOM 40 CA ARG A 40 255.700 256.007 238.532 1.00 0.00 C +ATOM 41 CA TRP A 41 254.274 254.377 235.397 1.00 0.00 C +ATOM 42 CA PRO A 42 254.401 254.247 231.592 1.00 0.00 C +ATOM 43 CA GLN A 43 255.879 254.109 228.083 1.00 0.00 C +ATOM 44 CA ILE A 44 256.022 251.425 225.382 1.00 0.00 C +ATOM 45 CA ARG A 45 256.660 247.752 226.169 1.00 0.00 C +ATOM 46 CA TRP A 46 256.532 245.895 229.493 1.00 0.00 C +ATOM 47 CA ARG A 47 256.813 242.973 231.922 1.00 0.00 C +ATOM 48 CA PRO A 48 254.937 239.865 233.078 1.00 0.00 C +ATOM 49 CA CYS A 49 254.585 239.473 236.851 1.00 0.00 C +ATOM 50 CA GLN A 50 253.503 236.827 239.371 1.00 0.00 C +ATOM 51 CA ARG A 51 251.362 233.679 239.226 1.00 0.00 C +ATOM 52 CA PRO A 52 249.527 231.005 241.226 1.00 0.00 C +ATOM 53 CA PRO A 53 246.820 228.351 240.851 1.00 0.00 C +ATOM 54 CA ARG A 54 244.941 225.478 242.505 1.00 0.00 C +ATOM 55 CA HIS A 55 245.542 221.841 241.542 1.00 0.00 C +ATOM 56 CA HIS A 56 242.947 219.069 241.228 1.00 0.00 C +ATOM 57 CA CYS A 57 242.924 215.980 238.998 1.00 0.00 C +ATOM 58 CA SER A 58 243.595 212.749 237.094 1.00 0.00 C +ATOM 59 CA THR A 59 240.472 210.813 236.085 1.00 0.00 C +ATOM 60 CA PRO A 60 236.667 210.957 235.934 1.00 0.00 C +ATOM 61 CA PRO A 61 233.697 209.135 237.476 1.00 0.00 C +ATOM 62 CA GLY A 62 234.265 206.175 239.807 1.00 0.00 C +ATOM 63 CA ARG A 63 231.730 205.141 242.457 1.00 0.00 C +ATOM 64 CA ALA A 64 232.470 204.337 246.107 1.00 0.00 C +ATOM 65 CA VAL A 65 233.757 205.005 249.630 1.00 0.00 C +ATOM 66 CA THR A 66 233.477 202.489 252.478 1.00 0.00 C +ATOM 67 CA GLY A 67 229.833 201.997 253.474 1.00 0.00 C +ATOM 68 CA HIS A 68 227.679 204.964 252.436 1.00 0.00 C +ATOM 69 CA ARG A 69 226.830 208.606 253.161 1.00 0.00 C +ATOM 70 CA LEU A 70 223.860 210.946 252.694 1.00 0.00 C +ATOM 71 CA GLY A 71 223.907 214.429 254.237 1.00 0.00 C +ATOM 72 CA TRP A 72 221.379 215.763 256.756 1.00 0.00 C +ATOM 73 CA PRO A 73 222.944 218.488 258.912 1.00 0.00 C +ATOM 74 CA ARG A 74 226.626 217.846 259.651 1.00 0.00 C +ATOM 75 CA PRO A 75 230.227 217.444 258.473 1.00 0.00 C +ATOM 76 CA HIS A 76 231.852 214.090 259.265 1.00 0.00 C +ATOM 77 CA GLY A 77 232.728 210.523 260.279 1.00 0.00 C +ATOM 78 CA CYS A 78 231.081 207.361 258.935 1.00 0.00 C +ATOM 79 CA HIS A 79 232.725 204.281 260.460 1.00 0.00 C +ATOM 80 CA ARG A 80 234.491 201.107 261.610 1.00 0.00 C +ATOM 81 CA ARG A 81 232.356 198.104 260.642 1.00 0.00 C +ATOM 82 CA THR A 82 229.328 195.836 260.184 1.00 0.00 C +ATOM 83 CA VAL A 83 226.699 196.850 257.620 1.00 0.00 C +ATOM 84 CA ALA A 84 223.070 196.742 258.778 1.00 0.00 C +ATOM 85 CA ARG A 85 223.158 194.789 262.048 1.00 0.00 C +ATOM 86 CA SER A 86 222.629 191.297 263.479 1.00 0.00 C +ATOM 87 CA ALA A 87 221.691 188.474 261.099 1.00 0.00 C +TER 88 ALA A 87 +END diff --git a/Plants/Q8H460/Q8H460.dcd b/Plants/Q8H460/Q8H460.dcd new file mode 100644 index 0000000000000000000000000000000000000000..cd1c5014e83cddaa5c746c471a9e9ef35eb7624c --- /dev/null +++ b/Plants/Q8H460/Q8H460.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:8f930be49f66580b815380d22196390b4d3fc4f11a606360324e115acb5784a4 +size 11720276 diff --git a/Plants/Q8H460/top.pdb b/Plants/Q8H460/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a77ec5ec052396c6ac6b27f5a5105283ff8a9721 --- /dev/null +++ b/Plants/Q8H460/top.pdb @@ -0,0 +1,95 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 260.223 230.948 283.270 1.00 0.00 C +ATOM 2 CA PRO A 2 260.783 227.968 280.963 1.00 0.00 C +ATOM 3 CA PRO A 3 262.297 225.027 279.072 1.00 0.00 C +ATOM 4 CA THR A 4 260.838 224.922 275.554 1.00 0.00 C +ATOM 5 CA PRO A 5 260.715 228.287 273.771 1.00 0.00 C +ATOM 6 CA PRO A 6 262.484 231.564 272.969 1.00 0.00 C +ATOM 7 CA ALA A 7 262.071 235.085 274.364 1.00 0.00 C +ATOM 8 CA PRO A 8 261.962 238.789 273.476 1.00 0.00 C +ATOM 9 CA ALA A 9 265.425 240.110 272.593 1.00 0.00 C +ATOM 10 CA ASN A 10 265.046 241.554 269.088 1.00 0.00 C +ATOM 11 CA GLY A 11 262.684 244.005 267.375 1.00 0.00 C +ATOM 12 CA GLY A 12 261.012 247.167 266.064 1.00 0.00 C +ATOM 13 CA ALA A 13 261.063 250.912 266.763 1.00 0.00 C +ATOM 14 CA TRP A 14 258.076 253.254 267.088 1.00 0.00 C +ATOM 15 CA SER A 15 258.620 256.271 264.826 1.00 0.00 C +ATOM 16 CA TRP A 16 261.633 258.561 265.266 1.00 0.00 C +ATOM 17 CA ARG A 17 264.055 261.282 264.151 1.00 0.00 C +ATOM 18 CA CYS A 18 264.562 263.559 261.138 1.00 0.00 C +ATOM 19 CA ARG A 19 262.604 266.535 259.787 1.00 0.00 C +ATOM 20 CA GLY A 20 262.830 269.689 261.913 1.00 0.00 C +ATOM 21 CA GLY A 21 260.200 272.147 260.666 1.00 0.00 C +ATOM 22 CA GLY A 22 260.838 272.489 256.925 1.00 0.00 C +ATOM 23 CA ASP A 23 263.367 272.839 254.097 1.00 0.00 C +ATOM 24 CA ASN A 24 262.973 271.242 250.661 1.00 0.00 C +ATOM 25 CA THR A 25 263.434 270.719 246.915 1.00 0.00 C +ATOM 26 CA GLY A 26 264.076 269.249 243.459 1.00 0.00 C +ATOM 27 CA LYS A 27 267.006 269.042 241.033 1.00 0.00 C +ATOM 28 CA GLY A 28 268.242 266.411 238.570 1.00 0.00 C +ATOM 29 CA GLU A 29 269.818 265.998 235.126 1.00 0.00 C +ATOM 30 CA ALA A 30 270.954 264.421 231.849 1.00 0.00 C +ATOM 31 CA VAL A 31 273.141 265.717 229.011 1.00 0.00 C +ATOM 32 CA VAL A 32 274.597 263.028 226.739 1.00 0.00 C +ATOM 33 CA ALA A 33 278.211 261.835 226.563 1.00 0.00 C +ATOM 34 CA GLU A 34 279.322 258.245 225.935 1.00 0.00 C +ATOM 35 CA ALA A 35 280.709 255.397 228.052 1.00 0.00 C +ATOM 36 CA ALA A 36 279.412 251.815 228.033 1.00 0.00 C +ATOM 37 CA ASP A 37 275.984 250.166 228.247 1.00 0.00 C +ATOM 38 CA PRO A 38 272.711 252.114 228.164 1.00 0.00 C +ATOM 39 CA GLU A 39 270.656 250.931 231.146 1.00 0.00 C +ATOM 40 CA GLU A 40 267.263 251.263 232.847 1.00 0.00 C +ATOM 41 CA ASP A 41 263.999 252.556 234.327 1.00 0.00 C +ATOM 42 CA PHE A 42 261.150 253.106 231.858 1.00 0.00 C +ATOM 43 CA SER A 43 257.899 251.120 231.848 1.00 0.00 C +ATOM 44 CA GLY A 44 255.072 253.175 233.364 1.00 0.00 C +ATOM 45 CA ARG A 45 252.922 252.746 236.480 1.00 0.00 C +ATOM 46 CA ARG A 46 250.658 255.789 236.841 1.00 0.00 C +ATOM 47 CA GLN A 47 247.070 254.524 237.042 1.00 0.00 C +ATOM 48 CA ALA A 48 244.243 252.271 235.837 1.00 0.00 C +ATOM 49 CA LYS A 49 240.994 253.974 236.866 1.00 0.00 C +ATOM 50 CA GLN A 50 241.787 256.921 239.147 1.00 0.00 C +ATOM 51 CA GLU A 51 239.263 258.734 241.351 1.00 0.00 C +ATOM 52 CA LYS A 52 237.047 260.840 243.625 1.00 0.00 C +ATOM 53 CA GLY A 53 233.734 262.477 242.697 1.00 0.00 C +ATOM 54 CA ARG A 54 231.118 259.891 241.700 1.00 0.00 C +ATOM 55 CA GLN A 55 227.752 258.140 241.358 1.00 0.00 C +ATOM 56 CA ARG A 56 227.586 255.847 244.397 1.00 0.00 C +ATOM 57 CA SER A 57 223.909 255.296 245.226 1.00 0.00 C +ATOM 58 CA THR A 58 221.460 252.443 245.845 1.00 0.00 C +ATOM 59 CA ALA A 59 220.771 250.920 242.421 1.00 0.00 C +ATOM 60 CA GLY A 60 222.866 248.521 240.330 1.00 0.00 C +ATOM 61 CA GLY A 61 222.384 244.853 241.243 1.00 0.00 C +ATOM 62 CA GLY A 62 221.767 243.029 244.530 1.00 0.00 C +ATOM 63 CA ARG A 63 221.238 239.297 245.087 1.00 0.00 C +ATOM 64 CA ARG A 64 221.951 237.493 241.807 1.00 0.00 C +ATOM 65 CA ARG A 65 224.029 238.732 238.864 1.00 0.00 C +ATOM 66 CA ARG A 66 227.427 240.453 238.807 1.00 0.00 C +ATOM 67 CA GLY A 67 227.633 243.547 236.594 1.00 0.00 C +ATOM 68 CA GLU A 68 228.728 247.170 236.155 1.00 0.00 C +ATOM 69 CA GLU A 69 231.335 248.637 238.514 1.00 0.00 C +ATOM 70 CA GLN A 70 230.380 251.935 240.165 1.00 0.00 C +ATOM 71 CA PRO A 71 233.311 254.213 241.023 1.00 0.00 C +ATOM 72 CA ALA A 72 236.370 252.661 242.682 1.00 0.00 C +ATOM 73 CA GLY A 73 240.125 252.203 243.136 1.00 0.00 C +ATOM 74 CA GLY A 74 243.634 250.733 243.331 1.00 0.00 C +ATOM 75 CA GLY A 75 244.166 249.943 247.020 1.00 0.00 C +ATOM 76 CA GLY A 76 243.593 246.275 247.874 1.00 0.00 C +ATOM 77 CA GLY A 77 240.738 244.168 249.262 1.00 0.00 C +ATOM 78 CA ALA A 78 239.601 241.175 251.328 1.00 0.00 C +ATOM 79 CA ALA A 79 237.872 240.278 254.602 1.00 0.00 C +ATOM 80 CA LEU A 80 239.967 237.774 256.566 1.00 0.00 C +ATOM 81 CA LEU A 81 242.383 235.753 258.710 1.00 0.00 C +ATOM 82 CA THR A 82 244.564 232.679 258.156 1.00 0.00 C +ATOM 83 CA GLU A 83 247.484 232.259 260.566 1.00 0.00 C +ATOM 84 CA ASN A 84 247.363 232.684 264.351 1.00 0.00 C +ATOM 85 CA THR A 85 244.710 231.789 266.935 1.00 0.00 C +ATOM 86 CA TRP A 86 241.919 234.307 267.554 1.00 0.00 C +ATOM 87 CA PRO A 87 240.531 235.993 270.675 1.00 0.00 C +ATOM 88 CA GLY A 88 240.091 238.250 273.714 1.00 0.00 C +ATOM 89 CA ARG A 89 236.691 239.906 273.252 1.00 0.00 C +ATOM 90 CA SER A 90 234.207 240.483 276.083 1.00 0.00 C +ATOM 91 CA ALA A 91 230.609 241.482 275.322 1.00 0.00 C +TER 92 ALA A 91 +END diff --git a/Plants/Q8H4B3/Q8H4B3.dcd b/Plants/Q8H4B3/Q8H4B3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..d0b9bd326d0a1f5d55749faa58ac96e85b8d4b5e --- /dev/null +++ b/Plants/Q8H4B3/Q8H4B3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2e0fb61565aa69751590370b4e471cbe2849df7e1ae79144f3a1c4636df5c375 +size 13280276 diff --git a/Plants/Q8H4B3/top.pdb b/Plants/Q8H4B3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a2f6d02ee7dfc9d308b0b7eddd3f9462a1d889c3 --- /dev/null +++ b/Plants/Q8H4B3/top.pdb @@ -0,0 +1,108 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 294.971 227.179 282.718 1.00 0.00 C +ATOM 2 CA ALA A 2 292.328 227.624 280.009 1.00 0.00 C +ATOM 3 CA PRO A 3 292.392 230.086 277.103 1.00 0.00 C +ATOM 4 CA CYS A 4 291.170 230.604 273.531 1.00 0.00 C +ATOM 5 CA CYS A 5 293.957 232.331 271.591 1.00 0.00 C +ATOM 6 CA ARG A 6 293.305 235.624 269.789 1.00 0.00 C +ATOM 7 CA GLU A 7 294.724 235.850 266.260 1.00 0.00 C +ATOM 8 CA PRO A 8 293.300 234.120 263.179 1.00 0.00 C +ATOM 9 CA PRO A 9 291.144 231.119 264.109 1.00 0.00 C +ATOM 10 CA THR A 10 287.926 231.456 266.121 1.00 0.00 C +ATOM 11 CA SER A 11 284.363 232.620 265.438 1.00 0.00 C +ATOM 12 CA ARG A 12 282.260 229.681 264.230 1.00 0.00 C +ATOM 13 CA CYS A 13 279.005 230.670 262.514 1.00 0.00 C +ATOM 14 CA ALA A 14 276.070 230.756 264.942 1.00 0.00 C +ATOM 15 CA VAL A 15 276.157 228.346 267.891 1.00 0.00 C +ATOM 16 CA ALA A 16 277.214 227.895 271.524 1.00 0.00 C +ATOM 17 CA PRO A 17 275.050 229.043 274.442 1.00 0.00 C +ATOM 18 CA SER A 18 272.712 230.389 277.132 1.00 0.00 C +ATOM 19 CA VAL A 19 272.146 234.155 277.258 1.00 0.00 C +ATOM 20 CA SER A 20 268.553 234.797 276.166 1.00 0.00 C +ATOM 21 CA ARG A 21 266.719 237.431 274.114 1.00 0.00 C +ATOM 22 CA GLY A 22 263.957 239.337 275.917 1.00 0.00 C +ATOM 23 CA SER A 23 260.237 238.680 276.420 1.00 0.00 C +ATOM 24 CA ALA A 24 258.491 241.483 274.520 1.00 0.00 C +ATOM 25 CA ASP A 25 255.134 243.269 274.283 1.00 0.00 C +ATOM 26 CA PRO A 26 252.115 241.650 272.613 1.00 0.00 C +ATOM 27 CA LEU A 27 249.143 243.953 271.998 1.00 0.00 C +ATOM 28 CA VAL A 28 246.816 244.997 269.168 1.00 0.00 C +ATOM 29 CA ARG A 29 243.146 244.328 268.392 1.00 0.00 C +ATOM 30 CA ARG A 30 240.910 247.019 266.885 1.00 0.00 C +ATOM 31 CA GLY A 31 237.818 249.125 266.165 1.00 0.00 C +ATOM 32 CA GLU A 32 238.953 252.058 264.015 1.00 0.00 C +ATOM 33 CA ALA A 33 237.960 251.905 260.340 1.00 0.00 C +ATOM 34 CA GLU A 34 235.190 249.558 259.183 1.00 0.00 C +ATOM 35 CA GLY A 35 236.304 246.000 259.968 1.00 0.00 C +ATOM 36 CA GLU A 36 236.647 242.273 260.682 1.00 0.00 C +ATOM 37 CA LYS A 37 239.736 240.973 262.494 1.00 0.00 C +ATOM 38 CA GLU A 38 242.883 239.539 260.893 1.00 0.00 C +ATOM 39 CA GLU A 39 244.215 240.237 257.393 1.00 0.00 C +ATOM 40 CA PRO A 40 241.735 242.308 255.373 1.00 0.00 C +ATOM 41 CA ASN A 41 240.255 245.818 255.447 1.00 0.00 C +ATOM 42 CA GLN A 42 238.797 248.996 253.936 1.00 0.00 C +ATOM 43 CA SER A 43 238.386 251.631 251.214 1.00 0.00 C +ATOM 44 CA ARG A 44 241.447 252.537 249.135 1.00 0.00 C +ATOM 45 CA HIS A 45 244.100 249.806 249.011 1.00 0.00 C +ATOM 46 CA ALA A 46 246.784 247.579 250.548 1.00 0.00 C +ATOM 47 CA THR A 47 248.982 246.313 247.705 1.00 0.00 C +ATOM 48 CA GLU A 48 249.434 245.630 243.984 1.00 0.00 C +ATOM 49 CA GLU A 49 248.658 243.847 240.707 1.00 0.00 C +ATOM 50 CA PRO A 50 246.758 242.438 237.721 1.00 0.00 C +ATOM 51 CA LEU A 51 248.001 239.739 235.336 1.00 0.00 C +ATOM 52 CA THR A 52 248.591 240.656 231.685 1.00 0.00 C +ATOM 53 CA ARG A 53 245.717 242.386 229.879 1.00 0.00 C +ATOM 54 CA ARG A 54 242.446 242.102 231.812 1.00 0.00 C +ATOM 55 CA ILE A 55 241.067 245.222 233.510 1.00 0.00 C +ATOM 56 CA TRP A 56 237.428 245.342 232.387 1.00 0.00 C +ATOM 57 CA ARG A 57 234.914 243.174 234.257 1.00 0.00 C +ATOM 58 CA GLY A 58 235.470 242.188 237.895 1.00 0.00 C +ATOM 59 CA GLU A 59 235.234 243.158 241.572 1.00 0.00 C +ATOM 60 CA GLY A 60 234.539 246.559 243.144 1.00 0.00 C +ATOM 61 CA GLY A 61 237.811 247.933 244.529 1.00 0.00 C +ATOM 62 CA GLY A 62 240.736 249.792 242.946 1.00 0.00 C +ATOM 63 CA GLY A 63 240.007 252.578 240.452 1.00 0.00 C +ATOM 64 CA THR A 64 236.351 253.544 239.982 1.00 0.00 C +ATOM 65 CA LEU A 65 235.714 257.213 239.174 1.00 0.00 C +ATOM 66 CA THR A 66 233.498 259.948 237.717 1.00 0.00 C +ATOM 67 CA ARG A 67 232.745 262.946 235.489 1.00 0.00 C +ATOM 68 CA ARG A 68 232.545 264.357 231.956 1.00 0.00 C +ATOM 69 CA LYS A 69 229.477 266.500 231.243 1.00 0.00 C +ATOM 70 CA GLY A 70 229.856 269.988 229.757 1.00 0.00 C +ATOM 71 CA VAL A 71 232.967 269.749 227.570 1.00 0.00 C +ATOM 72 CA ALA A 72 236.001 267.461 227.293 1.00 0.00 C +ATOM 73 CA GLY A 73 239.068 269.439 226.199 1.00 0.00 C +ATOM 74 CA ALA A 74 241.377 268.116 223.473 1.00 0.00 C +ATOM 75 CA GLY A 75 243.605 266.174 221.068 1.00 0.00 C +ATOM 76 CA ARG A 76 246.012 263.291 220.426 1.00 0.00 C +ATOM 77 CA GLU A 77 249.330 264.841 219.376 1.00 0.00 C +ATOM 78 CA SER A 78 251.993 265.591 221.995 1.00 0.00 C +ATOM 79 CA ALA A 79 254.921 263.440 223.143 1.00 0.00 C +ATOM 80 CA GLY A 80 254.250 262.371 226.738 1.00 0.00 C +ATOM 81 CA GLY A 81 252.299 260.443 229.382 1.00 0.00 C +ATOM 82 CA GLU A 82 254.669 257.807 230.778 1.00 0.00 C +ATOM 83 CA ARG A 83 253.136 255.273 233.175 1.00 0.00 C +ATOM 84 CA GLU A 84 253.601 252.023 235.109 1.00 0.00 C +ATOM 85 CA ARG A 85 250.444 251.355 237.136 1.00 0.00 C +ATOM 86 CA LEU A 86 248.521 254.510 238.068 1.00 0.00 C +ATOM 87 CA ARG A 87 248.704 258.310 237.876 1.00 0.00 C +ATOM 88 CA ARG A 88 245.302 259.969 238.309 1.00 0.00 C +ATOM 89 CA ARG A 89 243.823 259.423 241.778 1.00 0.00 C +ATOM 90 CA PRO A 90 243.997 260.278 245.487 1.00 0.00 C +ATOM 91 CA PRO A 91 241.012 262.264 246.776 1.00 0.00 C +ATOM 92 CA SER A 92 238.210 260.515 248.675 1.00 0.00 C +ATOM 93 CA GLU A 93 236.842 262.115 251.851 1.00 0.00 C +ATOM 94 CA GLY A 94 233.109 262.822 251.573 1.00 0.00 C +ATOM 95 CA HIS A 95 231.624 264.559 248.524 1.00 0.00 C +ATOM 96 CA HIS A 96 228.753 265.723 246.306 1.00 0.00 C +ATOM 97 CA ARG A 97 225.735 267.409 244.705 1.00 0.00 C +ATOM 98 CA PRO A 98 223.611 269.543 242.370 1.00 0.00 C +ATOM 99 CA GLY A 99 225.564 272.525 241.024 1.00 0.00 C +ATOM 100 CA GLY A 100 227.866 275.539 241.385 1.00 0.00 C +ATOM 101 CA GLY A 101 230.265 276.045 244.302 1.00 0.00 C +ATOM 102 CA ARG A 102 231.879 277.489 247.436 1.00 0.00 C +ATOM 103 CA ARG A 103 234.176 280.288 246.250 1.00 0.00 C +ATOM 104 CA GLY A 104 234.733 282.913 243.546 1.00 0.00 C +TER 105 GLY A 104 +END diff --git a/Plants/Q8H4E3/Q8H4E3.dcd b/Plants/Q8H4E3/Q8H4E3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..044851c91c0908c8e28d2dca74d18d58223d7849 --- /dev/null +++ b/Plants/Q8H4E3/Q8H4E3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:40f4c5a90c38d6b54afddf9fb91158d1d2aaed6d3e745ae71ffa9c9871adddae +size 14000276 diff --git a/Plants/Q8H4E3/top.pdb b/Plants/Q8H4E3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..d0f097cb510384ea7695d873511e4023eaf65c28 --- /dev/null +++ b/Plants/Q8H4E3/top.pdb @@ -0,0 +1,114 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 273.268 295.556 276.091 1.00 0.00 C +ATOM 2 CA GLY A 2 270.472 293.131 275.190 1.00 0.00 C +ATOM 3 CA ARG A 3 267.668 290.757 274.180 1.00 0.00 C +ATOM 4 CA THR A 4 264.734 288.544 275.185 1.00 0.00 C +ATOM 5 CA ARG A 5 263.623 284.924 275.604 1.00 0.00 C +ATOM 6 CA GLY A 6 265.050 282.536 278.208 1.00 0.00 C +ATOM 7 CA SER A 7 262.443 280.471 280.066 1.00 0.00 C +ATOM 8 CA GLU A 8 260.166 279.097 282.795 1.00 0.00 C +ATOM 9 CA PRO A 9 258.012 277.565 285.539 1.00 0.00 C +ATOM 10 CA PRO A 10 259.373 278.160 289.048 1.00 0.00 C +ATOM 11 CA ASP A 11 256.705 277.503 291.687 1.00 0.00 C +ATOM 12 CA GLN A 12 253.308 276.940 293.319 1.00 0.00 C +ATOM 13 CA ILE A 13 251.102 275.167 290.768 1.00 0.00 C +ATOM 14 CA ARG A 14 249.242 276.873 287.913 1.00 0.00 C +ATOM 15 CA ARG A 15 248.066 274.742 284.982 1.00 0.00 C +ATOM 16 CA ARG A 16 250.759 274.860 282.289 1.00 0.00 C +ATOM 17 CA GLU A 17 253.259 275.557 279.499 1.00 0.00 C +ATOM 18 CA ALA A 18 253.417 275.940 275.712 1.00 0.00 C +ATOM 19 CA GLY A 19 254.296 277.863 272.542 1.00 0.00 C +ATOM 20 CA ASP A 20 255.872 278.410 269.117 1.00 0.00 C +ATOM 21 CA ASP A 21 254.789 276.280 266.150 1.00 0.00 C +ATOM 22 CA GLU A 22 251.641 274.157 265.834 1.00 0.00 C +ATOM 23 CA SER A 23 250.290 272.163 262.882 1.00 0.00 C +ATOM 24 CA ARG A 24 251.527 272.112 259.278 1.00 0.00 C +ATOM 25 CA ARG A 25 249.283 271.502 256.260 1.00 0.00 C +ATOM 26 CA ARG A 26 247.008 274.536 255.883 1.00 0.00 C +ATOM 27 CA THR A 27 245.618 274.357 252.340 1.00 0.00 C +ATOM 28 CA PRO A 28 245.641 272.464 249.034 1.00 0.00 C +ATOM 29 CA THR A 29 246.334 273.213 245.363 1.00 0.00 C +ATOM 30 CA ALA A 30 247.043 270.322 242.985 1.00 0.00 C +ATOM 31 CA ARG A 31 248.349 266.885 241.985 1.00 0.00 C +ATOM 32 CA LYS A 32 247.066 263.919 244.003 1.00 0.00 C +ATOM 33 CA GLY A 33 249.909 261.426 244.474 1.00 0.00 C +ATOM 34 CA GLY A 34 251.052 259.676 241.289 1.00 0.00 C +ATOM 35 CA ASN A 35 252.066 259.570 237.618 1.00 0.00 C +ATOM 36 CA PHE A 36 251.743 261.313 234.245 1.00 0.00 C +ATOM 37 CA THR A 37 248.758 261.533 231.887 1.00 0.00 C +ATOM 38 CA GLY A 38 247.139 259.282 229.274 1.00 0.00 C +ATOM 39 CA ALA A 39 244.229 257.090 228.160 1.00 0.00 C +ATOM 40 CA THR A 40 243.914 253.465 229.287 1.00 0.00 C +ATOM 41 CA GLY A 41 244.335 252.136 232.833 1.00 0.00 C +ATOM 42 CA VAL A 42 243.372 254.451 235.701 1.00 0.00 C +ATOM 43 CA ARG A 43 239.645 253.877 236.250 1.00 0.00 C +ATOM 44 CA LEU A 44 237.914 251.413 233.917 1.00 0.00 C +ATOM 45 CA LYS A 45 238.577 247.674 233.599 1.00 0.00 C +ATOM 46 CA GLY A 46 238.611 244.568 235.806 1.00 0.00 C +ATOM 47 CA VAL A 47 236.407 241.626 236.808 1.00 0.00 C +ATOM 48 CA GLY A 48 234.441 240.028 233.963 1.00 0.00 C +ATOM 49 CA ALA A 49 233.482 236.654 232.476 1.00 0.00 C +ATOM 50 CA TYR A 50 232.559 235.623 228.926 1.00 0.00 C +ATOM 51 CA PRO A 51 234.616 232.976 227.116 1.00 0.00 C +ATOM 52 CA GLY A 52 237.371 232.181 224.607 1.00 0.00 C +ATOM 53 CA PHE A 53 241.109 232.696 225.133 1.00 0.00 C +ATOM 54 CA LYS A 54 244.844 232.371 224.455 1.00 0.00 C +ATOM 55 CA GLU A 55 247.611 229.802 223.947 1.00 0.00 C +ATOM 56 CA SER A 56 251.215 228.565 223.911 1.00 0.00 C +ATOM 57 CA VAL A 57 254.936 228.258 223.155 1.00 0.00 C +ATOM 58 CA SER A 58 256.953 228.252 226.387 1.00 0.00 C +ATOM 59 CA GLY A 59 257.155 226.842 229.921 1.00 0.00 C +ATOM 60 CA ALA A 60 255.485 224.163 232.053 1.00 0.00 C +ATOM 61 CA GLY A 61 256.005 224.258 235.826 1.00 0.00 C +ATOM 62 CA TRP A 62 255.831 221.460 238.406 1.00 0.00 C +ATOM 63 CA ASP A 63 255.645 222.797 241.968 1.00 0.00 C +ATOM 64 CA LYS A 64 252.147 222.127 243.323 1.00 0.00 C +ATOM 65 CA GLY A 65 250.447 219.582 245.592 1.00 0.00 C +ATOM 66 CA VAL A 66 250.325 219.980 249.379 1.00 0.00 C +ATOM 67 CA PRO A 67 251.084 222.735 251.899 1.00 0.00 C +ATOM 68 CA ARG A 68 249.812 223.709 255.355 1.00 0.00 C +ATOM 69 CA ARG A 69 247.405 223.277 258.277 1.00 0.00 C +ATOM 70 CA ALA A 70 247.182 226.099 260.827 1.00 0.00 C +ATOM 71 CA GLY A 71 246.194 229.491 262.254 1.00 0.00 C +ATOM 72 CA ASP A 72 243.008 231.327 263.252 1.00 0.00 C +ATOM 73 CA GLU A 73 242.008 234.912 262.440 1.00 0.00 C +ATOM 74 CA ARG A 74 244.150 237.548 264.166 1.00 0.00 C +ATOM 75 CA ARG A 75 242.350 240.142 266.298 1.00 0.00 C +ATOM 76 CA SER A 76 240.169 243.263 266.151 1.00 0.00 C +ATOM 77 CA PRO A 77 237.917 242.993 263.090 1.00 0.00 C +ATOM 78 CA GLY A 78 238.847 245.714 260.590 1.00 0.00 C +ATOM 79 CA ALA A 79 242.183 247.548 260.460 1.00 0.00 C +ATOM 80 CA ASP A 80 244.529 245.071 258.763 1.00 0.00 C +ATOM 81 CA GLY A 81 247.617 244.735 256.557 1.00 0.00 C +ATOM 82 CA ASN A 82 250.561 242.627 255.371 1.00 0.00 C +ATOM 83 CA GLY A 83 252.393 240.486 252.806 1.00 0.00 C +ATOM 84 CA GLY A 84 250.181 238.375 250.533 1.00 0.00 C +ATOM 85 CA GLU A 85 246.967 237.605 252.428 1.00 0.00 C +ATOM 86 CA ALA A 86 243.657 238.677 253.980 1.00 0.00 C +ATOM 87 CA MET A 87 241.036 236.330 255.443 1.00 0.00 C +ATOM 88 CA PRO A 88 240.002 232.741 256.197 1.00 0.00 C +ATOM 89 CA GLY A 89 239.131 230.333 253.376 1.00 0.00 C +ATOM 90 CA GLY A 90 238.535 231.073 249.687 1.00 0.00 C +ATOM 91 CA GLY A 91 238.935 228.131 247.299 1.00 0.00 C +ATOM 92 CA GLY A 92 239.439 228.216 243.523 1.00 0.00 C +ATOM 93 CA ALA A 93 240.758 231.706 242.754 1.00 0.00 C +ATOM 94 CA ARG A 94 240.291 234.152 239.870 1.00 0.00 C +ATOM 95 CA GLY A 95 243.568 235.710 238.708 1.00 0.00 C +ATOM 96 CA GLY A 96 247.016 237.023 237.757 1.00 0.00 C +ATOM 97 CA VAL A 97 246.567 240.652 236.686 1.00 0.00 C +ATOM 98 CA HIS A 98 249.170 242.649 238.623 1.00 0.00 C +ATOM 99 CA THR A 99 251.600 245.420 239.589 1.00 0.00 C +ATOM 100 CA ARG A 100 254.269 246.669 237.173 1.00 0.00 C +ATOM 101 CA SER A 101 255.936 243.655 235.545 1.00 0.00 C +ATOM 102 CA GLY A 102 257.008 240.085 234.757 1.00 0.00 C +ATOM 103 CA VAL A 103 259.885 238.772 232.633 1.00 0.00 C +ATOM 104 CA PRO A 104 262.048 238.320 229.529 1.00 0.00 C +ATOM 105 CA PRO A 105 265.809 238.576 230.079 1.00 0.00 C +ATOM 106 CA SER A 106 267.490 240.998 227.666 1.00 0.00 C +ATOM 107 CA TYR A 107 269.007 244.231 228.994 1.00 0.00 C +ATOM 108 CA HIS A 108 271.562 244.780 231.767 1.00 0.00 C +ATOM 109 CA ALA A 109 273.535 247.933 232.591 1.00 0.00 C +ATOM 110 CA ASP A 110 273.919 251.292 230.835 1.00 0.00 C +TER 111 ASP A 110 +END diff --git a/Plants/Q8H4J2/Q8H4J2.dcd b/Plants/Q8H4J2/Q8H4J2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..6ac35a37b604464f963677ef7a89facdbbb8b51c --- /dev/null +++ b/Plants/Q8H4J2/Q8H4J2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f9a58bfd5a5fa059d9b9b0288225a22cd1b5437130211dcfbe4194a11c867ade +size 17120276 diff --git a/Plants/Q8H4J2/top.pdb b/Plants/Q8H4J2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..8cb77cadf90368d972871b87550dbb6505b80afe --- /dev/null +++ b/Plants/Q8H4J2/top.pdb @@ -0,0 +1,140 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 231.300 232.556 242.436 1.00 0.00 C +ATOM 2 CA GLN A 2 230.825 236.336 242.362 1.00 0.00 C +ATOM 3 CA PRO A 3 231.822 239.712 240.906 1.00 0.00 C +ATOM 4 CA LYS A 4 229.261 242.308 242.012 1.00 0.00 C +ATOM 5 CA ARG A 5 228.018 245.712 240.837 1.00 0.00 C +ATOM 6 CA LEU A 6 229.266 246.309 237.287 1.00 0.00 C +ATOM 7 CA THR A 7 227.492 245.563 233.999 1.00 0.00 C +ATOM 8 CA LYS A 8 224.932 245.278 231.192 1.00 0.00 C +ATOM 9 CA ARG A 9 226.584 245.745 227.790 1.00 0.00 C +ATOM 10 CA ILE A 10 229.640 247.173 226.018 1.00 0.00 C +ATOM 11 CA ALA A 11 232.298 244.505 225.441 1.00 0.00 C +ATOM 12 CA THR A 12 234.479 242.055 227.379 1.00 0.00 C +ATOM 13 CA ALA A 13 234.959 241.954 231.157 1.00 0.00 C +ATOM 14 CA GLN A 14 237.617 240.460 233.442 1.00 0.00 C +ATOM 15 CA GLN A 15 239.051 238.318 236.247 1.00 0.00 C +ATOM 16 CA VAL A 16 239.426 236.977 239.794 1.00 0.00 C +ATOM 17 CA VAL A 17 241.342 239.345 242.083 1.00 0.00 C +ATOM 18 CA SER A 18 243.048 242.277 240.349 1.00 0.00 C +ATOM 19 CA GLY A 19 244.955 245.415 239.335 1.00 0.00 C +ATOM 20 CA GLY A 20 248.729 245.406 239.860 1.00 0.00 C +ATOM 21 CA THR A 21 250.544 247.902 237.626 1.00 0.00 C +ATOM 22 CA GLY A 22 254.341 247.834 237.327 1.00 0.00 C +ATOM 23 CA THR A 23 257.381 248.337 239.568 1.00 0.00 C +ATOM 24 CA PRO A 24 260.062 250.562 241.109 1.00 0.00 C +ATOM 25 CA GLN A 25 258.695 254.118 241.073 1.00 0.00 C +ATOM 26 CA ASN A 26 255.006 254.521 240.212 1.00 0.00 C +ATOM 27 CA GLN A 27 251.362 254.002 241.198 1.00 0.00 C +ATOM 28 CA ASN A 28 248.738 255.173 238.696 1.00 0.00 C +ATOM 29 CA THR A 29 247.928 255.733 235.015 1.00 0.00 C +ATOM 30 CA SER A 30 246.322 258.909 233.655 1.00 0.00 C +ATOM 31 CA THR A 31 247.681 261.734 235.820 1.00 0.00 C +ATOM 32 CA VAL A 32 247.359 265.523 236.058 1.00 0.00 C +ATOM 33 CA GLU A 33 246.197 267.708 238.955 1.00 0.00 C +ATOM 34 CA SER A 34 244.625 270.203 241.366 1.00 0.00 C +ATOM 35 CA GLY A 35 241.133 271.425 242.277 1.00 0.00 C +ATOM 36 CA MET A 36 238.345 272.939 240.166 1.00 0.00 C +ATOM 37 CA GLY A 37 234.675 272.234 240.905 1.00 0.00 C +ATOM 38 CA ARG A 38 232.440 269.167 241.243 1.00 0.00 C +ATOM 39 CA ILE A 39 229.207 268.895 243.241 1.00 0.00 C +ATOM 40 CA GLY A 40 227.696 269.429 246.697 1.00 0.00 C +ATOM 41 CA ARG A 41 224.396 270.445 248.310 1.00 0.00 C +ATOM 42 CA GLU A 42 221.493 271.679 246.174 1.00 0.00 C +ATOM 43 CA LYS A 43 222.061 275.169 244.756 1.00 0.00 C +ATOM 44 CA MET A 44 220.010 278.363 244.417 1.00 0.00 C +ATOM 45 CA SER A 45 217.415 281.067 243.735 1.00 0.00 C +ATOM 46 CA LYS A 46 213.814 279.830 243.612 1.00 0.00 C +ATOM 47 CA GLY A 47 211.513 278.908 246.506 1.00 0.00 C +ATOM 48 CA GLY A 48 209.748 276.205 248.530 1.00 0.00 C +ATOM 49 CA CYS A 49 210.494 272.612 249.553 1.00 0.00 C +ATOM 50 CA GLY A 50 208.946 269.251 248.642 1.00 0.00 C +ATOM 51 CA VAL A 51 210.268 265.793 247.742 1.00 0.00 C +ATOM 52 CA ARG A 52 212.057 263.678 250.358 1.00 0.00 C +ATOM 53 CA VAL A 53 214.632 264.690 252.977 1.00 0.00 C +ATOM 54 CA ARG A 54 215.465 268.368 252.438 1.00 0.00 C +ATOM 55 CA SER A 55 216.646 271.861 253.397 1.00 0.00 C +ATOM 56 CA TRP A 56 220.135 271.527 254.891 1.00 0.00 C +ATOM 57 CA GLY A 57 222.170 268.314 255.121 1.00 0.00 C +ATOM 58 CA GLY A 58 225.305 266.195 254.680 1.00 0.00 C +ATOM 59 CA ALA A 59 226.163 264.942 251.185 1.00 0.00 C +ATOM 60 CA GLU A 60 228.939 263.621 248.934 1.00 0.00 C +ATOM 61 CA GLN A 61 231.923 262.981 246.654 1.00 0.00 C +ATOM 62 CA GLN A 62 235.708 263.285 246.968 1.00 0.00 C +ATOM 63 CA GLY A 63 238.461 260.783 246.145 1.00 0.00 C +ATOM 64 CA ASN A 64 241.835 260.738 244.376 1.00 0.00 C +ATOM 65 CA ALA A 65 243.733 258.713 241.765 1.00 0.00 C +ATOM 66 CA SER A 66 241.697 255.966 240.085 1.00 0.00 C +ATOM 67 CA GLY A 67 238.914 254.497 242.234 1.00 0.00 C +ATOM 68 CA ALA A 68 235.222 255.032 241.460 1.00 0.00 C +ATOM 69 CA GLY A 69 231.829 253.969 242.828 1.00 0.00 C +ATOM 70 CA GLU A 70 232.132 250.227 243.473 1.00 0.00 C +ATOM 71 CA ASP A 71 234.179 247.025 243.738 1.00 0.00 C +ATOM 72 CA LYS A 72 237.509 245.830 245.152 1.00 0.00 C +ATOM 73 CA VAL A 73 240.331 247.669 243.370 1.00 0.00 C +ATOM 74 CA ARG A 74 243.763 247.191 244.955 1.00 0.00 C +ATOM 75 CA TRP A 75 245.830 247.837 248.090 1.00 0.00 C +ATOM 76 CA ARG A 76 246.351 251.511 248.956 1.00 0.00 C +ATOM 77 CA ARG A 77 247.390 254.444 251.154 1.00 0.00 C +ATOM 78 CA ALA A 78 247.826 253.457 254.808 1.00 0.00 C +ATOM 79 CA ARG A 79 245.318 251.262 256.654 1.00 0.00 C +ATOM 80 CA GLU A 80 246.254 250.661 260.298 1.00 0.00 C +ATOM 81 CA LYS A 81 246.454 247.256 261.995 1.00 0.00 C +ATOM 82 CA ARG A 82 249.855 245.761 262.840 1.00 0.00 C +ATOM 83 CA GLU A 83 250.062 242.740 265.152 1.00 0.00 C +ATOM 84 CA ARG A 84 252.192 240.298 267.157 1.00 0.00 C +ATOM 85 CA ARG A 85 255.744 239.901 268.476 1.00 0.00 C +ATOM 86 CA GLN A 86 257.676 236.922 267.093 1.00 0.00 C +ATOM 87 CA ARG A 87 261.275 235.774 267.593 1.00 0.00 C +ATOM 88 CA ARG A 88 262.791 234.058 264.548 1.00 0.00 C +ATOM 89 CA ARG A 89 263.065 236.752 261.868 1.00 0.00 C +ATOM 90 CA GLY A 90 262.820 238.927 258.749 1.00 0.00 C +ATOM 91 CA THR A 91 264.509 241.674 256.720 1.00 0.00 C +ATOM 92 CA ARG A 92 268.061 242.548 255.655 1.00 0.00 C +ATOM 93 CA GLU A 93 271.178 244.119 254.128 1.00 0.00 C +ATOM 94 CA GLY A 94 272.499 247.496 255.297 1.00 0.00 C +ATOM 95 CA ARG A 95 270.335 249.470 257.734 1.00 0.00 C +ATOM 96 CA ARG A 96 269.715 247.124 260.671 1.00 0.00 C +ATOM 97 CA ARG A 97 266.204 247.530 262.093 1.00 0.00 C +ATOM 98 CA GLY A 98 265.368 249.448 265.277 1.00 0.00 C +ATOM 99 CA ARG A 99 264.741 253.026 266.425 1.00 0.00 C +ATOM 100 CA GLY A 100 262.239 255.439 264.864 1.00 0.00 C +ATOM 101 CA THR A 101 261.038 259.050 265.039 1.00 0.00 C +ATOM 102 CA SER A 102 258.375 259.616 267.705 1.00 0.00 C +ATOM 103 CA PRO A 103 259.390 258.954 271.317 1.00 0.00 C +ATOM 104 CA ALA A 104 261.556 255.821 271.233 1.00 0.00 C +ATOM 105 CA ALA A 105 265.286 256.579 271.392 1.00 0.00 C +ATOM 106 CA GLU A 106 266.915 253.628 273.168 1.00 0.00 C +ATOM 107 CA GLU A 107 267.449 250.156 271.694 1.00 0.00 C +ATOM 108 CA GLU A 108 267.290 246.587 273.016 1.00 0.00 C +ATOM 109 CA GLN A 109 269.642 243.848 271.797 1.00 0.00 C +ATOM 110 CA VAL A 110 269.835 244.054 267.997 1.00 0.00 C +ATOM 111 CA ARG A 111 273.246 243.930 266.303 1.00 0.00 C +ATOM 112 CA ARG A 112 274.850 240.830 264.775 1.00 0.00 C +ATOM 113 CA TRP A 113 273.865 237.492 263.225 1.00 0.00 C +ATOM 114 CA ARG A 114 270.498 236.043 264.264 1.00 0.00 C +ATOM 115 CA LYS A 115 270.706 232.463 265.551 1.00 0.00 C +ATOM 116 CA ARG A 116 272.380 229.956 263.221 1.00 0.00 C +ATOM 117 CA ASN A 117 275.511 231.294 261.512 1.00 0.00 C +ATOM 118 CA LYS A 118 277.119 234.038 259.415 1.00 0.00 C +ATOM 119 CA SER A 119 280.789 234.624 258.575 1.00 0.00 C +ATOM 120 CA GLY A 120 281.039 237.297 255.871 1.00 0.00 C +ATOM 121 CA GLY A 121 284.414 239.065 255.842 1.00 0.00 C +ATOM 122 CA GLY A 122 286.397 237.417 258.648 1.00 0.00 C +ATOM 123 CA GLU A 123 286.965 233.659 258.899 1.00 0.00 C +ATOM 124 CA GLU A 124 286.480 230.478 260.940 1.00 0.00 C +ATOM 125 CA GLU A 125 283.771 227.799 260.912 1.00 0.00 C +ATOM 126 CA GLU A 126 282.262 226.680 257.597 1.00 0.00 C +ATOM 127 CA HIS A 127 285.049 226.102 255.065 1.00 0.00 C +ATOM 128 CA GLY A 128 287.489 225.908 252.145 1.00 0.00 C +ATOM 129 CA GLY A 129 287.959 223.881 248.953 1.00 0.00 C +ATOM 130 CA GLY A 130 286.329 223.293 245.560 1.00 0.00 C +ATOM 131 CA GLY A 131 286.950 226.504 243.606 1.00 0.00 C +ATOM 132 CA LYS A 132 289.109 229.538 242.800 1.00 0.00 C +ATOM 133 CA ASN A 133 290.503 229.316 239.261 1.00 0.00 C +ATOM 134 CA HIS A 134 293.858 231.039 238.720 1.00 0.00 C +ATOM 135 CA LEU A 135 294.041 234.491 240.323 1.00 0.00 C +ATOM 136 CA ALA A 136 292.208 236.959 238.072 1.00 0.00 C +TER 137 ALA A 136 +END diff --git a/Plants/Q8H4N5/Q8H4N5.dcd b/Plants/Q8H4N5/Q8H4N5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..4f80072762fa343446361033fa1aec4a87e14e7c --- /dev/null +++ b/Plants/Q8H4N5/Q8H4N5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:63ba7aabc84572e67cf936258f77c4f106610e03346648654ff1ef41201f53fa +size 10640276 diff --git a/Plants/Q8H4N5/top.pdb b/Plants/Q8H4N5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..51ac64f7512ea678a850dfdeed04dc18d29b31e7 --- /dev/null +++ b/Plants/Q8H4N5/top.pdb @@ -0,0 +1,86 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 288.124 262.211 269.807 1.00 0.00 C +ATOM 2 CA ASN A 2 284.473 262.120 268.721 1.00 0.00 C +ATOM 3 CA GLY A 3 283.141 260.936 265.354 1.00 0.00 C +ATOM 4 CA PRO A 4 281.689 264.046 263.699 1.00 0.00 C +ATOM 5 CA LEU A 5 279.572 266.668 265.476 1.00 0.00 C +ATOM 6 CA LEU A 6 279.293 267.587 269.163 1.00 0.00 C +ATOM 7 CA PRO A 7 277.782 269.018 272.354 1.00 0.00 C +ATOM 8 CA PRO A 8 275.314 270.790 274.654 1.00 0.00 C +ATOM 9 CA ARG A 9 271.778 271.593 275.825 1.00 0.00 C +ATOM 10 CA ARG A 10 268.838 269.960 274.034 1.00 0.00 C +ATOM 11 CA PRO A 11 265.257 271.083 273.375 1.00 0.00 C +ATOM 12 CA PRO A 12 262.417 268.850 272.167 1.00 0.00 C +ATOM 13 CA PRO A 13 263.064 267.197 268.796 1.00 0.00 C +ATOM 14 CA ALA A 14 261.983 264.280 266.596 1.00 0.00 C +ATOM 15 CA CYS A 15 262.060 262.211 263.397 1.00 0.00 C +ATOM 16 CA ARG A 16 260.654 258.701 262.930 1.00 0.00 C +ATOM 17 CA ARG A 17 257.865 256.437 264.200 1.00 0.00 C +ATOM 18 CA ALA A 18 256.748 254.515 267.294 1.00 0.00 C +ATOM 19 CA ARG A 19 258.223 256.098 270.430 1.00 0.00 C +ATOM 20 CA PRO A 20 256.534 256.437 273.829 1.00 0.00 C +ATOM 21 CA SER A 21 253.165 254.726 274.314 1.00 0.00 C +ATOM 22 CA GLU A 22 249.602 253.781 275.279 1.00 0.00 C +ATOM 23 CA ARG A 23 246.209 254.984 276.527 1.00 0.00 C +ATOM 24 CA ARG A 24 243.353 252.508 276.047 1.00 0.00 C +ATOM 25 CA ALA A 25 240.692 253.345 273.451 1.00 0.00 C +ATOM 26 CA ALA A 26 237.707 252.939 271.120 1.00 0.00 C +ATOM 27 CA SER A 27 235.825 254.358 268.127 1.00 0.00 C +ATOM 28 CA PRO A 28 235.748 258.156 268.420 1.00 0.00 C +ATOM 29 CA ALA A 29 238.331 259.191 271.024 1.00 0.00 C +ATOM 30 CA GLY A 30 238.524 260.039 274.733 1.00 0.00 C +ATOM 31 CA SER A 31 241.996 261.041 275.941 1.00 0.00 C +ATOM 32 CA ARG A 32 243.965 262.052 272.840 1.00 0.00 C +ATOM 33 CA ARG A 33 246.535 261.554 270.072 1.00 0.00 C +ATOM 34 CA ALA A 34 245.671 258.475 268.001 1.00 0.00 C +ATOM 35 CA PRO A 35 246.861 254.855 267.963 1.00 0.00 C +ATOM 36 CA ARG A 36 247.479 251.247 266.907 1.00 0.00 C +ATOM 37 CA ALA A 37 250.091 249.283 264.948 1.00 0.00 C +ATOM 38 CA ALA A 38 248.814 246.195 263.119 1.00 0.00 C +ATOM 39 CA ARG A 39 247.143 244.829 259.979 1.00 0.00 C +ATOM 40 CA LEU A 40 247.697 241.063 259.808 1.00 0.00 C +ATOM 41 CA VAL A 41 249.422 237.863 258.668 1.00 0.00 C +ATOM 42 CA PRO A 42 248.820 236.119 255.335 1.00 0.00 C +ATOM 43 CA GLY A 43 246.096 238.073 253.524 1.00 0.00 C +ATOM 44 CA ARG A 44 245.429 238.923 249.870 1.00 0.00 C +ATOM 45 CA ARG A 45 241.947 240.444 249.598 1.00 0.00 C +ATOM 46 CA ARG A 46 239.337 240.387 246.823 1.00 0.00 C +ATOM 47 CA GLU A 47 236.237 242.584 246.535 1.00 0.00 C +ATOM 48 CA ALA A 48 233.537 243.213 243.921 1.00 0.00 C +ATOM 49 CA THR A 49 234.246 245.101 240.688 1.00 0.00 C +ATOM 50 CA SER A 50 231.903 247.721 239.219 1.00 0.00 C +ATOM 51 CA ARG A 51 233.709 250.979 238.415 1.00 0.00 C +ATOM 52 CA GLN A 52 233.052 252.552 235.007 1.00 0.00 C +ATOM 53 CA LEU A 53 230.880 254.278 232.396 1.00 0.00 C +ATOM 54 CA ALA A 54 228.768 254.001 229.238 1.00 0.00 C +ATOM 55 CA ALA A 55 231.066 255.241 226.464 1.00 0.00 C +ATOM 56 CA SER A 56 234.737 254.578 225.692 1.00 0.00 C +ATOM 57 CA PRO A 57 238.358 253.461 226.091 1.00 0.00 C +ATOM 58 CA GLY A 58 239.578 255.226 229.240 1.00 0.00 C +ATOM 59 CA LEU A 59 238.901 258.447 231.160 1.00 0.00 C +ATOM 60 CA ARG A 60 240.410 260.173 234.202 1.00 0.00 C +ATOM 61 CA ALA A 61 242.854 258.205 236.364 1.00 0.00 C +ATOM 62 CA PRO A 62 244.645 254.887 235.821 1.00 0.00 C +ATOM 63 CA ARG A 63 242.749 251.945 237.326 1.00 0.00 C +ATOM 64 CA ARG A 64 240.395 250.661 234.619 1.00 0.00 C +ATOM 65 CA ARG A 65 241.383 249.114 231.281 1.00 0.00 C +ATOM 66 CA ALA A 66 242.795 247.958 227.936 1.00 0.00 C +ATOM 67 CA GLY A 67 243.073 244.195 227.406 1.00 0.00 C +ATOM 68 CA ARG A 68 243.730 242.704 223.962 1.00 0.00 C +ATOM 69 CA PRO A 69 247.262 241.285 223.804 1.00 0.00 C +ATOM 70 CA VAL A 70 250.001 238.668 223.393 1.00 0.00 C +ATOM 71 CA SER A 71 253.786 238.283 223.579 1.00 0.00 C +ATOM 72 CA ARG A 72 255.425 235.141 224.979 1.00 0.00 C +ATOM 73 CA PRO A 73 257.007 232.155 223.219 1.00 0.00 C +ATOM 74 CA GLU A 74 256.435 228.611 221.943 1.00 0.00 C +ATOM 75 CA LEU A 75 257.027 225.170 220.419 1.00 0.00 C +ATOM 76 CA VAL A 76 256.900 222.183 218.057 1.00 0.00 C +ATOM 77 CA PRO A 77 254.229 222.266 215.342 1.00 0.00 C +ATOM 78 CA THR A 78 250.592 222.875 216.299 1.00 0.00 C +ATOM 79 CA GLY A 79 247.396 221.020 217.226 1.00 0.00 C +ATOM 80 CA THR A 80 245.838 217.552 217.475 1.00 0.00 C +ATOM 81 CA SER A 81 245.443 214.600 215.099 1.00 0.00 C +ATOM 82 CA PRO A 82 244.383 215.797 211.641 1.00 0.00 C +TER 83 PRO A 82 +END diff --git a/Plants/Q8H4Q1/Q8H4Q1.dcd b/Plants/Q8H4Q1/Q8H4Q1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..ed8a79ee4c0175f876257fe83eaca4978039ba43 --- /dev/null +++ b/Plants/Q8H4Q1/Q8H4Q1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:7a013dfc1d99abadb80cd03b8bd84ace95caa9ea6228787ad9b6d975515c3d0f +size 10880276 diff --git a/Plants/Q8H4Q1/top.pdb b/Plants/Q8H4Q1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..81d4b5720ee6e1f6827a79ea57318867c5198b83 --- /dev/null +++ b/Plants/Q8H4Q1/top.pdb @@ -0,0 +1,88 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 229.371 220.619 232.170 1.00 0.00 C +ATOM 2 CA ASP A 2 228.969 219.290 235.718 1.00 0.00 C +ATOM 3 CA ALA A 3 229.760 221.773 238.498 1.00 0.00 C +ATOM 4 CA ALA A 4 232.362 223.206 240.884 1.00 0.00 C +ATOM 5 CA ARG A 5 236.000 223.169 239.752 1.00 0.00 C +ATOM 6 CA HIS A 6 239.230 222.272 237.941 1.00 0.00 C +ATOM 7 CA GLY A 7 242.012 221.706 240.482 1.00 0.00 C +ATOM 8 CA GLN A 8 244.610 223.531 242.588 1.00 0.00 C +ATOM 9 CA ARG A 9 246.930 226.163 241.104 1.00 0.00 C +ATOM 10 CA LEU A 10 247.524 228.145 237.905 1.00 0.00 C +ATOM 11 CA PRO A 11 245.532 228.329 234.662 1.00 0.00 C +ATOM 12 CA PRO A 12 243.861 231.742 234.388 1.00 0.00 C +ATOM 13 CA ALA A 13 245.149 234.126 237.066 1.00 0.00 C +ATOM 14 CA ALA A 14 248.338 235.981 238.018 1.00 0.00 C +ATOM 15 CA PRO A 15 250.323 239.069 236.998 1.00 0.00 C +ATOM 16 CA PRO A 16 251.795 240.558 240.182 1.00 0.00 C +ATOM 17 CA ALA A 17 254.715 242.990 239.911 1.00 0.00 C +ATOM 18 CA PRO A 18 258.147 242.616 238.301 1.00 0.00 C +ATOM 19 CA PRO A 19 259.936 244.300 235.389 1.00 0.00 C +ATOM 20 CA ARG A 20 263.642 244.614 236.217 1.00 0.00 C +ATOM 21 CA ALA A 21 266.997 246.043 237.322 1.00 0.00 C +ATOM 22 CA ALA A 22 266.785 249.787 236.653 1.00 0.00 C +ATOM 23 CA PRO A 23 265.267 252.895 238.252 1.00 0.00 C +ATOM 24 CA PRO A 24 265.747 255.349 241.126 1.00 0.00 C +ATOM 25 CA VAL A 25 262.867 257.818 240.780 1.00 0.00 C +ATOM 26 CA ALA A 26 259.467 259.101 241.927 1.00 0.00 C +ATOM 27 CA ALA A 27 258.222 262.678 241.513 1.00 0.00 C +ATOM 28 CA GLY A 28 254.601 263.716 240.943 1.00 0.00 C +ATOM 29 CA ARG A 29 251.166 264.650 239.586 1.00 0.00 C +ATOM 30 CA GLY A 30 249.170 267.895 239.511 1.00 0.00 C +ATOM 31 CA PRO A 31 246.255 268.584 241.866 1.00 0.00 C +ATOM 32 CA ALA A 32 247.139 269.970 245.303 1.00 0.00 C +ATOM 33 CA SER A 33 249.061 268.148 248.041 1.00 0.00 C +ATOM 34 CA CYS A 34 250.521 268.984 251.460 1.00 0.00 C +ATOM 35 CA ARG A 35 250.043 272.664 252.321 1.00 0.00 C +ATOM 36 CA CYS A 36 249.212 272.809 256.036 1.00 0.00 C +ATOM 37 CA ALA A 37 247.544 276.055 257.130 1.00 0.00 C +ATOM 38 CA LEU A 38 247.976 278.809 259.727 1.00 0.00 C +ATOM 39 CA PRO A 39 250.599 278.145 262.409 1.00 0.00 C +ATOM 40 CA ARG A 40 251.774 274.801 263.806 1.00 0.00 C +ATOM 41 CA ARG A 41 249.705 271.979 262.300 1.00 0.00 C +ATOM 42 CA PRO A 42 246.828 269.540 262.842 1.00 0.00 C +ATOM 43 CA LEU A 43 247.410 266.290 260.941 1.00 0.00 C +ATOM 44 CA ALA A 44 250.673 264.324 260.932 1.00 0.00 C +ATOM 45 CA ARG A 45 253.158 261.436 260.980 1.00 0.00 C +ATOM 46 CA ARG A 46 255.465 261.075 263.990 1.00 0.00 C +ATOM 47 CA ARG A 47 255.919 260.806 267.763 1.00 0.00 C +ATOM 48 CA ARG A 48 255.925 259.904 271.465 1.00 0.00 C +ATOM 49 CA PRO A 49 252.818 259.802 273.666 1.00 0.00 C +ATOM 50 CA PRO A 50 249.605 257.947 274.538 1.00 0.00 C +ATOM 51 CA ASP A 51 248.332 256.909 277.975 1.00 0.00 C +ATOM 52 CA GLY A 52 246.882 253.815 279.661 1.00 0.00 C +ATOM 53 CA ARG A 53 247.084 250.590 281.680 1.00 0.00 C +ATOM 54 CA LYS A 54 248.170 246.943 281.485 1.00 0.00 C +ATOM 55 CA GLY A 55 246.085 243.785 281.040 1.00 0.00 C +ATOM 56 CA GLU A 56 246.023 240.819 278.650 1.00 0.00 C +ATOM 57 CA GLU A 57 247.517 242.034 275.362 1.00 0.00 C +ATOM 58 CA ARG A 58 248.306 244.805 272.870 1.00 0.00 C +ATOM 59 CA ARG A 59 250.394 247.434 271.069 1.00 0.00 C +ATOM 60 CA LYS A 60 252.071 250.780 271.781 1.00 0.00 C +ATOM 61 CA GLY A 61 251.666 252.966 268.686 1.00 0.00 C +ATOM 62 CA GLY A 62 252.075 256.173 266.671 1.00 0.00 C +ATOM 63 CA GLY A 63 252.132 254.996 263.048 1.00 0.00 C +ATOM 64 CA GLU A 64 255.004 253.457 261.074 1.00 0.00 C +ATOM 65 CA GLY A 65 255.602 249.732 260.541 1.00 0.00 C +ATOM 66 CA ARG A 66 253.397 247.637 258.247 1.00 0.00 C +ATOM 67 CA GLY A 67 250.644 248.053 255.646 1.00 0.00 C +ATOM 68 CA GLY A 68 247.903 249.334 253.331 1.00 0.00 C +ATOM 69 CA GLU A 69 248.370 249.782 249.576 1.00 0.00 C +ATOM 70 CA GLU A 70 247.677 246.685 247.467 1.00 0.00 C +ATOM 71 CA LYS A 71 244.074 246.167 246.344 1.00 0.00 C +ATOM 72 CA GLY A 72 241.926 248.906 244.794 1.00 0.00 C +ATOM 73 CA GLU A 73 243.438 252.351 244.190 1.00 0.00 C +ATOM 74 CA GLU A 74 246.811 253.031 242.555 1.00 0.00 C +ATOM 75 CA ILE A 75 247.738 251.793 239.073 1.00 0.00 C +ATOM 76 CA ARG A 76 246.271 252.416 235.613 1.00 0.00 C +ATOM 77 CA GLY A 77 247.896 252.248 232.171 1.00 0.00 C +ATOM 78 CA VAL A 78 251.458 251.642 230.962 1.00 0.00 C +ATOM 79 CA GLY A 79 254.124 249.511 229.270 1.00 0.00 C +ATOM 80 CA GLY A 80 252.748 245.961 229.113 1.00 0.00 C +ATOM 81 CA GLU A 81 255.512 243.428 229.790 1.00 0.00 C +ATOM 82 CA GLY A 82 255.141 239.707 230.519 1.00 0.00 C +ATOM 83 CA MET A 83 256.425 236.321 229.333 1.00 0.00 C +ATOM 84 CA ILE A 84 254.985 233.585 227.107 1.00 0.00 C +TER 85 ILE A 84 +END diff --git a/Plants/Q8H4T9/Q8H4T9.dcd b/Plants/Q8H4T9/Q8H4T9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..3b8816b8903b9b2ad0dc2cac7ca0c395a59a4e81 --- /dev/null +++ b/Plants/Q8H4T9/Q8H4T9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e708a287fda8d3f9330af9d0ce4c2a924b4f5eb80709a042a64d647aa3297054 +size 9800276 diff --git a/Plants/Q8H4T9/top.pdb b/Plants/Q8H4T9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..cfbb5597b76f7fe02eab90bea399616c423a7d27 --- /dev/null +++ b/Plants/Q8H4T9/top.pdb @@ -0,0 +1,79 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 248.468 232.115 233.231 1.00 0.00 C +ATOM 2 CA ALA A 2 251.787 230.411 234.003 1.00 0.00 C +ATOM 3 CA ASP A 3 251.323 229.019 237.519 1.00 0.00 C +ATOM 4 CA GLY A 4 249.844 227.713 240.779 1.00 0.00 C +ATOM 5 CA VAL A 5 247.510 225.492 242.812 1.00 0.00 C +ATOM 6 CA GLY A 6 246.787 224.403 246.391 1.00 0.00 C +ATOM 7 CA SER A 7 247.841 225.308 249.939 1.00 0.00 C +ATOM 8 CA THR A 8 250.296 228.218 249.819 1.00 0.00 C +ATOM 9 CA GLY A 9 254.088 228.538 249.620 1.00 0.00 C +ATOM 10 CA GLY A 10 257.052 226.872 251.338 1.00 0.00 C +ATOM 11 CA VAL A 11 259.813 225.547 253.605 1.00 0.00 C +ATOM 12 CA GLU A 12 261.553 228.523 255.227 1.00 0.00 C +ATOM 13 CA GLY A 13 261.300 231.287 252.617 1.00 0.00 C +ATOM 14 CA SER A 14 261.583 230.190 248.980 1.00 0.00 C +ATOM 15 CA SER A 15 260.981 232.469 245.987 1.00 0.00 C +ATOM 16 CA GLY A 16 259.544 235.895 245.142 1.00 0.00 C +ATOM 17 CA LYS A 17 261.218 238.791 243.317 1.00 0.00 C +ATOM 18 CA TRP A 18 261.656 239.448 239.590 1.00 0.00 C +ATOM 19 CA GLY A 19 260.438 241.565 236.666 1.00 0.00 C +ATOM 20 CA LYS A 20 257.350 243.780 236.941 1.00 0.00 C +ATOM 21 CA ARG A 21 257.471 247.430 235.857 1.00 0.00 C +ATOM 22 CA GLU A 22 260.246 250.028 235.594 1.00 0.00 C +ATOM 23 CA ARG A 23 262.032 251.802 238.454 1.00 0.00 C +ATOM 24 CA GLU A 24 264.109 252.224 241.620 1.00 0.00 C +ATOM 25 CA GLY A 25 264.603 254.203 244.838 1.00 0.00 C +ATOM 26 CA ARG A 26 265.584 257.009 247.221 1.00 0.00 C +ATOM 27 CA GLN A 27 267.614 258.105 250.253 1.00 0.00 C +ATOM 28 CA PRO A 28 268.571 259.829 253.514 1.00 0.00 C +ATOM 29 CA ALA A 29 265.315 260.417 255.404 1.00 0.00 C +ATOM 30 CA ARG A 30 264.821 262.891 258.259 1.00 0.00 C +ATOM 31 CA LYS A 31 265.437 263.593 261.953 1.00 0.00 C +ATOM 32 CA TRP A 32 263.115 261.219 263.819 1.00 0.00 C +ATOM 33 CA HIS A 33 261.032 263.249 266.280 1.00 0.00 C +ATOM 34 CA GLY A 34 258.421 260.779 267.542 1.00 0.00 C +ATOM 35 CA ASP A 35 254.853 261.654 266.530 1.00 0.00 C +ATOM 36 CA MET A 36 252.871 261.379 263.287 1.00 0.00 C +ATOM 37 CA GLY A 37 249.332 259.987 263.063 1.00 0.00 C +ATOM 38 CA ARG A 38 247.038 262.898 262.181 1.00 0.00 C +ATOM 39 CA MET A 39 243.909 262.114 260.153 1.00 0.00 C +ATOM 40 CA VAL A 40 243.192 261.447 256.471 1.00 0.00 C +ATOM 41 CA ALA A 41 244.249 257.930 255.459 1.00 0.00 C +ATOM 42 CA GLY A 42 246.550 256.199 252.964 1.00 0.00 C +ATOM 43 CA PHE A 43 248.596 257.737 250.142 1.00 0.00 C +ATOM 44 CA GLY A 44 246.752 258.437 246.882 1.00 0.00 C +ATOM 45 CA GLY A 45 247.028 259.567 243.254 1.00 0.00 C +ATOM 46 CA LYS A 46 244.002 261.711 242.381 1.00 0.00 C +ATOM 47 CA GLU A 47 242.058 264.805 243.460 1.00 0.00 C +ATOM 48 CA TRP A 48 238.392 265.830 243.616 1.00 0.00 C +ATOM 49 CA GLY A 49 236.773 267.369 246.702 1.00 0.00 C +ATOM 50 CA LYS A 50 238.875 266.228 249.668 1.00 0.00 C +ATOM 51 CA TRP A 51 242.087 267.138 251.503 1.00 0.00 C +ATOM 52 CA ALA A 52 244.466 269.474 253.347 1.00 0.00 C +ATOM 53 CA GLN A 53 242.237 271.876 255.290 1.00 0.00 C +ATOM 54 CA ASP A 54 238.945 270.267 256.335 1.00 0.00 C +ATOM 55 CA GLY A 55 236.213 268.430 258.253 1.00 0.00 C +ATOM 56 CA ARG A 56 234.210 265.667 259.946 1.00 0.00 C +ATOM 57 CA GLU A 57 236.353 262.539 260.321 1.00 0.00 C +ATOM 58 CA VAL A 58 236.812 260.598 257.074 1.00 0.00 C +ATOM 59 CA GLU A 59 236.722 258.181 254.130 1.00 0.00 C +ATOM 60 CA GLU A 60 235.701 259.752 250.813 1.00 0.00 C +ATOM 61 CA ARG A 61 234.048 259.081 247.446 1.00 0.00 C +ATOM 62 CA GLY A 62 235.711 259.193 244.020 1.00 0.00 C +ATOM 63 CA GLY A 63 238.932 257.183 243.701 1.00 0.00 C +ATOM 64 CA ILE A 64 238.308 253.961 245.638 1.00 0.00 C +ATOM 65 CA TRP A 65 240.966 251.306 245.004 1.00 0.00 C +ATOM 66 CA ALA A 66 242.745 247.956 245.357 1.00 0.00 C +ATOM 67 CA HIS A 67 243.100 246.590 248.896 1.00 0.00 C +ATOM 68 CA ALA A 68 245.967 247.222 251.325 1.00 0.00 C +ATOM 69 CA ARG A 69 248.074 244.367 252.712 1.00 0.00 C +ATOM 70 CA GLU A 70 249.951 241.100 252.148 1.00 0.00 C +ATOM 71 CA LYS A 71 250.720 237.671 253.619 1.00 0.00 C +ATOM 72 CA ARG A 72 248.385 234.691 253.186 1.00 0.00 C +ATOM 73 CA GLY A 73 245.328 233.676 251.153 1.00 0.00 C +ATOM 74 CA GLU A 74 241.577 234.166 250.695 1.00 0.00 C +ATOM 75 CA ALA A 75 239.169 234.259 247.744 1.00 0.00 C +TER 76 ALA A 75 +END diff --git a/Plants/Q8H524/Q8H524.dcd b/Plants/Q8H524/Q8H524.dcd new file mode 100644 index 0000000000000000000000000000000000000000..49c3fb2ab59ca4786b336d1b0346a69de5e4e16d --- /dev/null +++ b/Plants/Q8H524/Q8H524.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:721f543efa9d35f977e4d3f31f02c90d44c67fddddd5e712a86d53dd3bd12f6f +size 16400276 diff --git a/Plants/Q8H524/top.pdb b/Plants/Q8H524/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..fcb7a96310dafe70259bd8b786b053fd0cf20daf --- /dev/null +++ b/Plants/Q8H524/top.pdb @@ -0,0 +1,134 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 253.218 259.560 247.768 1.00 0.00 C +ATOM 2 CA ALA A 2 253.370 263.337 248.246 1.00 0.00 C +ATOM 3 CA THR A 3 252.300 266.100 250.641 1.00 0.00 C +ATOM 4 CA ALA A 4 252.032 267.552 254.153 1.00 0.00 C +ATOM 5 CA VAL A 5 248.536 266.558 255.294 1.00 0.00 C +ATOM 6 CA ALA A 6 246.499 268.602 257.782 1.00 0.00 C +ATOM 7 CA ARG A 7 244.927 266.347 260.420 1.00 0.00 C +ATOM 8 CA GLY A 8 245.690 263.630 262.979 1.00 0.00 C +ATOM 9 CA SER A 9 247.040 260.833 265.186 1.00 0.00 C +ATOM 10 CA GLY A 10 250.840 261.062 265.035 1.00 0.00 C +ATOM 11 CA ARG A 11 253.974 258.901 265.192 1.00 0.00 C +ATOM 12 CA ASP A 12 252.751 255.333 264.651 1.00 0.00 C +ATOM 13 CA ALA A 13 251.064 254.792 261.278 1.00 0.00 C +ATOM 14 CA MET A 14 253.646 253.573 258.755 1.00 0.00 C +ATOM 15 CA GLY A 15 255.720 256.322 257.124 1.00 0.00 C +ATOM 16 CA GLY A 16 257.978 259.274 257.961 1.00 0.00 C +ATOM 17 CA ASP A 17 256.775 262.357 259.848 1.00 0.00 C +ATOM 18 CA THR A 18 256.048 264.589 262.849 1.00 0.00 C +ATOM 19 CA THR A 19 256.622 266.596 266.037 1.00 0.00 C +ATOM 20 CA ALA A 20 259.508 269.063 266.352 1.00 0.00 C +ATOM 21 CA ARG A 21 262.508 268.089 264.216 1.00 0.00 C +ATOM 22 CA ARG A 22 263.549 269.487 260.828 1.00 0.00 C +ATOM 23 CA ASP A 23 262.448 272.848 259.411 1.00 0.00 C +ATOM 24 CA SER A 24 265.604 274.836 258.636 1.00 0.00 C +ATOM 25 CA ASP A 25 269.206 273.618 258.385 1.00 0.00 C +ATOM 26 CA ASP A 26 270.668 270.109 258.137 1.00 0.00 C +ATOM 27 CA GLY A 27 269.794 266.963 260.102 1.00 0.00 C +ATOM 28 CA THR A 28 268.872 263.300 259.606 1.00 0.00 C +ATOM 29 CA ALA A 29 270.375 259.998 258.442 1.00 0.00 C +ATOM 30 CA ARG A 30 269.465 258.228 255.193 1.00 0.00 C +ATOM 31 CA ARG A 31 272.588 257.945 253.030 1.00 0.00 C +ATOM 32 CA GLY A 32 272.137 256.174 249.686 1.00 0.00 C +ATOM 33 CA LEU A 33 271.942 256.408 245.888 1.00 0.00 C +ATOM 34 CA ASP A 34 271.628 252.953 244.313 1.00 0.00 C +ATOM 35 CA GLY A 35 270.168 252.288 240.857 1.00 0.00 C +ATOM 36 CA THR A 36 266.399 252.420 241.397 1.00 0.00 C +ATOM 37 CA ALA A 37 264.962 253.185 237.952 1.00 0.00 C +ATOM 38 CA ARG A 38 266.543 251.024 235.242 1.00 0.00 C +ATOM 39 CA GLY A 39 268.700 247.977 236.006 1.00 0.00 C +ATOM 40 CA ALA A 40 268.862 244.307 237.015 1.00 0.00 C +ATOM 41 CA ALA A 41 270.522 244.245 240.444 1.00 0.00 C +ATOM 42 CA ALA A 42 273.794 243.349 242.177 1.00 0.00 C +ATOM 43 CA ALA A 43 274.265 245.036 245.560 1.00 0.00 C +ATOM 44 CA GLN A 44 273.799 242.605 248.457 1.00 0.00 C +ATOM 45 CA LEU A 45 270.466 243.563 250.035 1.00 0.00 C +ATOM 46 CA GLU A 46 267.027 245.004 250.818 1.00 0.00 C +ATOM 47 CA ALA A 47 263.415 244.483 249.725 1.00 0.00 C +ATOM 48 CA ALA A 48 260.115 244.623 247.826 1.00 0.00 C +ATOM 49 CA MET A 49 257.665 247.485 248.393 1.00 0.00 C +ATOM 50 CA GLU A 50 255.744 250.245 246.601 1.00 0.00 C +ATOM 51 CA ARG A 51 258.198 253.013 245.687 1.00 0.00 C +ATOM 52 CA ALA A 52 261.070 254.304 243.544 1.00 0.00 C +ATOM 53 CA ARG A 53 260.130 257.749 242.215 1.00 0.00 C +ATOM 54 CA GLY A 54 257.406 258.670 239.716 1.00 0.00 C +ATOM 55 CA ASP A 55 257.607 261.360 237.026 1.00 0.00 C +ATOM 56 CA GLY A 56 259.840 260.586 234.038 1.00 0.00 C +ATOM 57 CA MET A 57 261.053 256.982 233.806 1.00 0.00 C +ATOM 58 CA ALA A 58 258.973 254.969 231.329 1.00 0.00 C +ATOM 59 CA THR A 59 256.796 256.853 228.833 1.00 0.00 C +ATOM 60 CA ALA A 60 254.577 259.534 230.385 1.00 0.00 C +ATOM 61 CA THR A 61 250.990 258.544 231.203 1.00 0.00 C +ATOM 62 CA ALA A 62 248.795 261.370 229.894 1.00 0.00 C +ATOM 63 CA ARG A 63 247.398 261.369 226.349 1.00 0.00 C +ATOM 64 CA GLN A 64 244.246 259.783 224.912 1.00 0.00 C +ATOM 65 CA TRP A 65 244.284 256.323 223.317 1.00 0.00 C +ATOM 66 CA TRP A 66 240.689 255.148 222.863 1.00 0.00 C +ATOM 67 CA ARG A 67 238.678 256.595 225.758 1.00 0.00 C +ATOM 68 CA ALA A 68 239.444 258.027 229.204 1.00 0.00 C +ATOM 69 CA ALA A 69 236.293 259.536 230.725 1.00 0.00 C +ATOM 70 CA ARG A 70 232.921 258.076 229.717 1.00 0.00 C +ATOM 71 CA GLY A 71 230.217 256.477 227.562 1.00 0.00 C +ATOM 72 CA GLY A 72 227.455 254.481 225.858 1.00 0.00 C +ATOM 73 CA THR A 73 224.256 255.578 224.103 1.00 0.00 C +ATOM 74 CA ARG A 74 220.572 254.628 223.903 1.00 0.00 C +ATOM 75 CA ARG A 75 217.998 252.201 222.488 1.00 0.00 C +ATOM 76 CA ARG A 76 218.095 249.205 220.136 1.00 0.00 C +ATOM 77 CA ARG A 77 220.004 246.552 222.094 1.00 0.00 C +ATOM 78 CA ARG A 78 221.484 246.522 225.605 1.00 0.00 C +ATOM 79 CA GLY A 79 221.766 249.497 227.968 1.00 0.00 C +ATOM 80 CA ARG A 80 223.117 251.000 231.198 1.00 0.00 C +ATOM 81 CA GLY A 81 225.507 248.790 233.179 1.00 0.00 C +ATOM 82 CA ASP A 82 225.310 244.987 233.059 1.00 0.00 C +ATOM 83 CA LYS A 83 225.640 242.392 235.829 1.00 0.00 C +ATOM 84 CA MET A 84 227.361 242.587 239.223 1.00 0.00 C +ATOM 85 CA VAL A 85 228.796 239.746 241.318 1.00 0.00 C +ATOM 86 CA THR A 86 226.488 238.903 244.229 1.00 0.00 C +ATOM 87 CA ALA A 87 222.956 239.932 245.221 1.00 0.00 C +ATOM 88 CA THR A 88 222.760 242.030 248.395 1.00 0.00 C +ATOM 89 CA GLY A 89 225.621 244.070 249.866 1.00 0.00 C +ATOM 90 CA GLY A 90 226.020 243.736 253.640 1.00 0.00 C +ATOM 91 CA ASP A 91 222.595 243.741 255.309 1.00 0.00 C +ATOM 92 CA GLY A 92 221.626 240.245 256.474 1.00 0.00 C +ATOM 93 CA ASP A 93 220.704 236.562 256.164 1.00 0.00 C +ATOM 94 CA GLY A 94 217.996 236.383 253.490 1.00 0.00 C +ATOM 95 CA GLY A 95 219.653 236.209 250.063 1.00 0.00 C +ATOM 96 CA ALA A 96 222.842 234.350 249.121 1.00 0.00 C +ATOM 97 CA ALA A 97 226.415 233.031 248.999 1.00 0.00 C +ATOM 98 CA ALA A 98 228.546 235.882 250.358 1.00 0.00 C +ATOM 99 CA GLY A 99 230.782 238.382 248.553 1.00 0.00 C +ATOM 100 CA ASP A 100 234.217 239.844 247.786 1.00 0.00 C +ATOM 101 CA ASP A 101 237.787 238.518 247.694 1.00 0.00 C +ATOM 102 CA GLY A 102 241.467 239.226 248.384 1.00 0.00 C +ATOM 103 CA ASP A 103 241.906 243.006 248.200 1.00 0.00 C +ATOM 104 CA GLY A 104 244.803 243.727 250.567 1.00 0.00 C +ATOM 105 CA ALA A 105 246.674 240.591 251.656 1.00 0.00 C +ATOM 106 CA ARG A 106 245.648 239.222 255.060 1.00 0.00 C +ATOM 107 CA ARG A 107 245.927 239.010 258.854 1.00 0.00 C +ATOM 108 CA LEU A 108 248.492 241.184 260.646 1.00 0.00 C +ATOM 109 CA ALA A 109 250.163 242.812 263.658 1.00 0.00 C +ATOM 110 CA THR A 110 249.858 242.474 267.441 1.00 0.00 C +ATOM 111 CA MET A 111 251.718 243.755 270.510 1.00 0.00 C +ATOM 112 CA ALA A 112 252.504 240.705 272.654 1.00 0.00 C +ATOM 113 CA THR A 113 250.009 240.003 275.446 1.00 0.00 C +ATOM 114 CA ALA A 114 248.282 240.101 278.841 1.00 0.00 C +ATOM 115 CA ARG A 115 250.249 239.177 281.971 1.00 0.00 C +ATOM 116 CA GLY A 116 252.017 236.460 283.973 1.00 0.00 C +ATOM 117 CA ASP A 117 253.612 233.806 281.752 1.00 0.00 C +ATOM 118 CA GLY A 118 256.297 233.663 279.053 1.00 0.00 C +ATOM 119 CA GLY A 119 256.706 235.399 275.686 1.00 0.00 C +ATOM 120 CA ASP A 120 260.035 237.251 275.770 1.00 0.00 C +ATOM 121 CA LYS A 121 263.524 235.866 276.419 1.00 0.00 C +ATOM 122 CA GLU A 122 266.816 236.321 274.556 1.00 0.00 C +ATOM 123 CA ARG A 123 268.057 235.694 271.009 1.00 0.00 C +ATOM 124 CA GLY A 124 271.048 234.092 269.275 1.00 0.00 C +ATOM 125 CA LYS A 125 272.942 234.668 266.019 1.00 0.00 C +ATOM 126 CA GLU A 126 273.491 236.388 262.665 1.00 0.00 C +ATOM 127 CA GLU A 127 273.288 233.706 259.966 1.00 0.00 C +ATOM 128 CA GLU A 128 271.212 230.517 260.150 1.00 0.00 C +ATOM 129 CA LEU A 129 268.264 229.980 262.503 1.00 0.00 C +ATOM 130 CA GLY A 130 269.252 228.770 265.978 1.00 0.00 C +TER 131 GLY A 130 +END diff --git a/Plants/Q8H576/Q8H576.dcd b/Plants/Q8H576/Q8H576.dcd new file mode 100644 index 0000000000000000000000000000000000000000..ac548f5b34f52d7f4af87e2b6e6240a243396c7a --- /dev/null +++ b/Plants/Q8H576/Q8H576.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:4dfea98a1603d91d5427c497e34da4e65905d7131fb636593741fc5ee2bb4c67 +size 10280276 diff --git a/Plants/Q8H576/top.pdb b/Plants/Q8H576/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..92545956099b4267b32ddf63c1db8232e048c1a1 --- /dev/null +++ b/Plants/Q8H576/top.pdb @@ -0,0 +1,83 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 250.882 264.726 213.860 1.00 0.00 C +ATOM 2 CA GLU A 2 253.406 266.981 215.608 1.00 0.00 C +ATOM 3 CA GLY A 3 256.411 269.185 214.814 1.00 0.00 C +ATOM 4 CA ALA A 4 259.525 267.012 215.133 1.00 0.00 C +ATOM 5 CA PRO A 5 260.077 263.905 217.268 1.00 0.00 C +ATOM 6 CA THR A 6 258.733 263.542 220.814 1.00 0.00 C +ATOM 7 CA SER A 7 255.183 263.780 222.177 1.00 0.00 C +ATOM 8 CA ARG A 8 251.676 265.232 221.842 1.00 0.00 C +ATOM 9 CA ARG A 9 249.247 267.457 223.756 1.00 0.00 C +ATOM 10 CA PRO A 10 249.674 268.414 227.419 1.00 0.00 C +ATOM 11 CA THR A 11 250.415 266.481 230.617 1.00 0.00 C +ATOM 12 CA ALA A 12 248.961 267.978 233.805 1.00 0.00 C +ATOM 13 CA ALA A 13 247.276 271.240 234.822 1.00 0.00 C +ATOM 14 CA ALA A 14 250.064 273.641 235.809 1.00 0.00 C +ATOM 15 CA ALA A 15 249.908 274.367 239.546 1.00 0.00 C +ATOM 16 CA VAL A 16 248.182 276.496 242.192 1.00 0.00 C +ATOM 17 CA ALA A 17 244.732 277.967 242.864 1.00 0.00 C +ATOM 18 CA ARG A 18 241.074 277.881 243.924 1.00 0.00 C +ATOM 19 CA SER A 19 239.722 276.775 247.310 1.00 0.00 C +ATOM 20 CA SER A 20 239.645 274.461 250.336 1.00 0.00 C +ATOM 21 CA ALA A 21 238.763 271.025 251.726 1.00 0.00 C +ATOM 22 CA PRO A 22 240.524 267.885 252.972 1.00 0.00 C +ATOM 23 CA ARG A 23 243.635 266.341 254.539 1.00 0.00 C +ATOM 24 CA PRO A 24 244.457 262.919 256.000 1.00 0.00 C +ATOM 25 CA LEU A 25 243.309 262.358 259.589 1.00 0.00 C +ATOM 26 CA LEU A 26 240.293 260.030 259.564 1.00 0.00 C +ATOM 27 CA HIS A 27 239.750 258.687 256.040 1.00 0.00 C +ATOM 28 CA GLY A 28 241.141 255.262 255.115 1.00 0.00 C +ATOM 29 CA GLN A 29 242.868 255.535 251.730 1.00 0.00 C +ATOM 30 CA ARG A 30 244.843 257.491 249.125 1.00 0.00 C +ATOM 31 CA SER A 31 248.627 257.075 248.952 1.00 0.00 C +ATOM 32 CA PRO A 32 250.014 254.698 246.318 1.00 0.00 C +ATOM 33 CA SER A 33 247.994 251.557 245.560 1.00 0.00 C +ATOM 34 CA GLU A 34 245.577 250.346 242.876 1.00 0.00 C +ATOM 35 CA ALA A 35 242.990 247.555 243.071 1.00 0.00 C +ATOM 36 CA ALA A 36 240.956 247.550 246.293 1.00 0.00 C +ATOM 37 CA GLY A 37 242.521 246.527 249.612 1.00 0.00 C +ATOM 38 CA GLU A 38 240.715 246.671 252.963 1.00 0.00 C +ATOM 39 CA SER A 39 239.049 246.448 256.382 1.00 0.00 C +ATOM 40 CA LYS A 40 237.549 244.657 259.393 1.00 0.00 C +ATOM 41 CA GLY A 41 235.563 242.410 261.742 1.00 0.00 C +ATOM 42 CA GLY A 42 233.287 239.507 262.698 1.00 0.00 C +ATOM 43 CA SER A 43 230.615 238.158 265.055 1.00 0.00 C +ATOM 44 CA ALA A 44 230.589 237.911 268.856 1.00 0.00 C +ATOM 45 CA PRO A 45 234.103 236.782 269.803 1.00 0.00 C +ATOM 46 CA PRO A 46 237.656 238.152 269.921 1.00 0.00 C +ATOM 47 CA LEU A 47 240.999 236.324 269.899 1.00 0.00 C +ATOM 48 CA SER A 48 243.065 234.283 267.433 1.00 0.00 C +ATOM 49 CA LEU A 49 246.624 234.005 268.765 1.00 0.00 C +ATOM 50 CA ARG A 50 249.258 236.479 267.558 1.00 0.00 C +ATOM 51 CA GLY A 51 252.944 236.017 268.406 1.00 0.00 C +ATOM 52 CA GLU A 52 256.030 234.289 266.992 1.00 0.00 C +ATOM 53 CA ALA A 53 255.382 232.267 263.828 1.00 0.00 C +ATOM 54 CA ALA A 54 252.517 229.759 263.958 1.00 0.00 C +ATOM 55 CA SER A 55 249.633 228.469 261.829 1.00 0.00 C +ATOM 56 CA SER A 56 246.307 227.381 263.337 1.00 0.00 C +ATOM 57 CA SER A 57 243.449 229.863 262.905 1.00 0.00 C +ATOM 58 CA GLU A 58 242.726 230.685 259.255 1.00 0.00 C +ATOM 59 CA LEU A 59 240.644 232.762 256.834 1.00 0.00 C +ATOM 60 CA VAL A 60 239.701 235.951 254.975 1.00 0.00 C +ATOM 61 CA ALA A 61 242.952 237.790 254.222 1.00 0.00 C +ATOM 62 CA ASP A 62 246.320 238.427 255.886 1.00 0.00 C +ATOM 63 CA ALA A 63 250.054 237.722 256.156 1.00 0.00 C +ATOM 64 CA GLU A 64 252.076 239.085 259.084 1.00 0.00 C +ATOM 65 CA LEU A 65 255.850 238.915 259.572 1.00 0.00 C +ATOM 66 CA LEU A 66 258.234 241.791 260.322 1.00 0.00 C +ATOM 67 CA SER A 67 260.891 244.376 261.202 1.00 0.00 C +ATOM 68 CA PRO A 68 263.924 246.619 261.741 1.00 0.00 C +ATOM 69 CA TYR A 69 267.498 245.671 260.822 1.00 0.00 C +ATOM 70 CA SER A 70 271.270 245.464 260.326 1.00 0.00 C +ATOM 71 CA ASP A 71 272.290 242.317 258.435 1.00 0.00 C +ATOM 72 CA GLU A 72 272.524 242.209 254.634 1.00 0.00 C +ATOM 73 CA GLU A 73 272.598 241.035 251.010 1.00 0.00 C +ATOM 74 CA GLU A 74 275.695 239.821 249.153 1.00 0.00 C +ATOM 75 CA GLY A 75 275.267 236.748 246.940 1.00 0.00 C +ATOM 76 CA ARG A 76 273.074 237.453 243.905 1.00 0.00 C +ATOM 77 CA THR A 77 271.875 234.500 241.817 1.00 0.00 C +ATOM 78 CA ALA A 78 273.338 231.134 242.837 1.00 0.00 C +ATOM 79 CA ASP A 79 272.815 229.333 246.154 1.00 0.00 C +TER 80 ASP A 79 +END diff --git a/Plants/Q8H5T9/Q8H5T9.dcd b/Plants/Q8H5T9/Q8H5T9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..d404e8e7889d3796980e2e6ebd246b074b20d8d6 --- /dev/null +++ b/Plants/Q8H5T9/Q8H5T9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:3578e59dff37b6a1e5bebe7894d9e31a40ba5bb6d7577e8a402f60b27f6555fe +size 12320276 diff --git a/Plants/Q8H5T9/top.pdb b/Plants/Q8H5T9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..8f22243467e2de5e1ed0a30aaa4de952ffe218ce --- /dev/null +++ b/Plants/Q8H5T9/top.pdb @@ -0,0 +1,100 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 266.209 270.676 244.258 1.00 0.00 C +ATOM 2 CA LEU A 2 265.173 273.812 242.358 1.00 0.00 C +ATOM 3 CA ALA A 3 266.665 276.724 240.407 1.00 0.00 C +ATOM 4 CA THR A 4 265.961 279.796 238.265 1.00 0.00 C +ATOM 5 CA ALA A 5 263.061 280.555 235.913 1.00 0.00 C +ATOM 6 CA GLY A 6 259.447 279.353 235.801 1.00 0.00 C +ATOM 7 CA ALA A 7 255.774 279.426 236.812 1.00 0.00 C +ATOM 8 CA ALA A 8 253.712 279.314 240.013 1.00 0.00 C +ATOM 9 CA LEU A 9 250.680 277.008 239.988 1.00 0.00 C +ATOM 10 CA ARG A 10 250.681 273.213 240.329 1.00 0.00 C +ATOM 11 CA GLY A 11 250.959 269.414 240.245 1.00 0.00 C +ATOM 12 CA PRO A 12 248.141 268.155 242.479 1.00 0.00 C +ATOM 13 CA PRO A 13 247.803 269.703 245.944 1.00 0.00 C +ATOM 14 CA CYS A 14 244.910 269.942 248.411 1.00 0.00 C +ATOM 15 CA LEU A 15 241.330 268.652 248.207 1.00 0.00 C +ATOM 16 CA ARG A 16 237.765 267.413 247.691 1.00 0.00 C +ATOM 17 CA ARG A 17 236.647 266.184 251.119 1.00 0.00 C +ATOM 18 CA LEU A 18 233.936 267.416 253.496 1.00 0.00 C +ATOM 19 CA LEU A 19 231.333 269.880 254.788 1.00 0.00 C +ATOM 20 CA PRO A 20 232.913 273.339 254.555 1.00 0.00 C +ATOM 21 CA PRO A 21 231.238 276.716 255.113 1.00 0.00 C +ATOM 22 CA GLY A 22 227.931 278.235 253.986 1.00 0.00 C +ATOM 23 CA ARG A 23 227.749 281.852 255.170 1.00 0.00 C +ATOM 24 CA PRO A 24 229.528 285.186 255.650 1.00 0.00 C +ATOM 25 CA SER A 25 233.229 285.751 254.939 1.00 0.00 C +ATOM 26 CA ALA A 26 236.175 287.602 256.490 1.00 0.00 C +ATOM 27 CA HIS A 27 239.323 285.466 256.278 1.00 0.00 C +ATOM 28 CA SER A 28 239.570 283.042 259.207 1.00 0.00 C +ATOM 29 CA PRO A 29 241.214 279.615 258.945 1.00 0.00 C +ATOM 30 CA PRO A 30 240.980 276.570 261.224 1.00 0.00 C +ATOM 31 CA GLY A 31 244.294 275.639 262.856 1.00 0.00 C +ATOM 32 CA PHE A 32 247.210 274.054 260.985 1.00 0.00 C +ATOM 33 CA ARG A 33 247.594 270.732 259.158 1.00 0.00 C +ATOM 34 CA ALA A 34 248.754 267.953 261.492 1.00 0.00 C +ATOM 35 CA GLY A 35 251.453 265.266 261.402 1.00 0.00 C +ATOM 36 CA GLN A 36 252.507 262.953 258.564 1.00 0.00 C +ATOM 37 CA PRO A 37 255.471 260.789 257.539 1.00 0.00 C +ATOM 38 CA PRO A 38 255.666 260.511 253.744 1.00 0.00 C +ATOM 39 CA LEU A 39 253.721 260.434 250.469 1.00 0.00 C +ATOM 40 CA PRO A 40 251.058 261.479 247.953 1.00 0.00 C +ATOM 41 CA ALA A 41 248.705 260.403 245.156 1.00 0.00 C +ATOM 42 CA ALA A 42 247.918 262.158 241.867 1.00 0.00 C +ATOM 43 CA ALA A 43 246.737 259.360 239.566 1.00 0.00 C +ATOM 44 CA ALA A 44 246.165 255.614 239.166 1.00 0.00 C +ATOM 45 CA ARG A 45 246.310 254.310 235.589 1.00 0.00 C +ATOM 46 CA LYS A 46 249.898 253.348 234.743 1.00 0.00 C +ATOM 47 CA THR A 47 253.506 252.767 233.664 1.00 0.00 C +ATOM 48 CA TRP A 48 255.275 249.849 231.968 1.00 0.00 C +ATOM 49 CA GLU A 49 258.114 247.775 233.435 1.00 0.00 C +ATOM 50 CA ARG A 50 257.213 245.998 236.683 1.00 0.00 C +ATOM 51 CA GLY A 51 256.903 243.128 239.169 1.00 0.00 C +ATOM 52 CA ARG A 52 260.359 241.544 239.414 1.00 0.00 C +ATOM 53 CA GLY A 53 263.940 240.247 239.295 1.00 0.00 C +ATOM 54 CA GLY A 54 265.812 241.297 242.442 1.00 0.00 C +ATOM 55 CA GLY A 55 265.968 243.365 245.639 1.00 0.00 C +ATOM 56 CA GLU A 56 263.712 246.202 246.812 1.00 0.00 C +ATOM 57 CA GLY A 57 260.933 247.675 248.962 1.00 0.00 C +ATOM 58 CA ARG A 58 260.999 249.042 252.518 1.00 0.00 C +ATOM 59 CA ARG A 59 260.502 250.519 255.994 1.00 0.00 C +ATOM 60 CA GLY A 60 261.514 249.723 259.580 1.00 0.00 C +ATOM 61 CA GLU A 61 258.620 249.458 262.044 1.00 0.00 C +ATOM 62 CA GLY A 62 258.185 247.554 265.315 1.00 0.00 C +ATOM 63 CA VAL A 63 256.710 244.064 265.723 1.00 0.00 C +ATOM 64 CA ARG A 64 255.494 241.437 263.246 1.00 0.00 C +ATOM 65 CA ARG A 65 258.401 240.303 261.060 1.00 0.00 C +ATOM 66 CA ARG A 66 257.913 238.724 257.626 1.00 0.00 C +ATOM 67 CA THR A 67 259.368 236.954 254.582 1.00 0.00 C +ATOM 68 CA ASN A 68 257.593 233.770 253.474 1.00 0.00 C +ATOM 69 CA GLY A 69 257.024 234.221 249.734 1.00 0.00 C +ATOM 70 CA GLY A 70 257.072 231.889 246.721 1.00 0.00 C +ATOM 71 CA GLU A 71 259.547 232.093 243.832 1.00 0.00 C +ATOM 72 CA GLU A 72 259.835 231.540 240.073 1.00 0.00 C +ATOM 73 CA LYS A 73 257.482 232.260 237.164 1.00 0.00 C +ATOM 74 CA LEU A 74 254.513 229.934 236.623 1.00 0.00 C +ATOM 75 CA ARG A 75 250.812 229.096 236.960 1.00 0.00 C +ATOM 76 CA ILE A 76 247.368 228.586 238.508 1.00 0.00 C +ATOM 77 CA ARG A 77 246.101 226.080 241.083 1.00 0.00 C +ATOM 78 CA LEU A 78 243.636 223.185 241.330 1.00 0.00 C +ATOM 79 CA ARG A 79 240.204 221.552 241.600 1.00 0.00 C +ATOM 80 CA ARG A 80 237.529 219.128 242.818 1.00 0.00 C +ATOM 81 CA ASP A 81 238.933 216.191 244.798 1.00 0.00 C +ATOM 82 CA ARG A 82 240.172 216.074 248.399 1.00 0.00 C +ATOM 83 CA GLN A 83 239.106 213.542 251.039 1.00 0.00 C +ATOM 84 CA ILE A 84 239.068 212.457 254.691 1.00 0.00 C +ATOM 85 CA ASP A 85 241.840 213.798 256.936 1.00 0.00 C +ATOM 86 CA ALA A 86 242.075 215.483 260.344 1.00 0.00 C +ATOM 87 CA PRO A 87 244.436 216.828 263.016 1.00 0.00 C +ATOM 88 CA ARG A 88 244.762 217.708 266.709 1.00 0.00 C +ATOM 89 CA ASP A 89 246.906 215.562 269.013 1.00 0.00 C +ATOM 90 CA LYS A 90 250.374 215.176 267.483 1.00 0.00 C +ATOM 91 CA HIS A 91 250.049 213.833 263.932 1.00 0.00 C +ATOM 92 CA ARG A 92 249.607 210.877 261.569 1.00 0.00 C +ATOM 93 CA ALA A 93 252.887 208.944 261.703 1.00 0.00 C +ATOM 94 CA GLY A 94 254.037 205.316 261.882 1.00 0.00 C +ATOM 95 CA LEU A 95 251.904 202.278 261.023 1.00 0.00 C +ATOM 96 CA GLU A 96 252.187 199.961 264.034 1.00 0.00 C +TER 97 GLU A 96 +END diff --git a/Plants/Q8H5U7/Q8H5U7.dcd b/Plants/Q8H5U7/Q8H5U7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..5b49b051481813c781123e9ef10275a52e1ecfad --- /dev/null +++ b/Plants/Q8H5U7/Q8H5U7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:9a352822dd567dfa5e83c8f3537ea46b64c9a0e67c88d43ede19035d8c4b23d0 +size 17720276 diff --git a/Plants/Q8H5U7/top.pdb b/Plants/Q8H5U7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a8299c212a52cc2670d79d5a6d20db6051537eed --- /dev/null +++ b/Plants/Q8H5U7/top.pdb @@ -0,0 +1,145 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 250.545 281.582 278.189 1.00 0.00 C +ATOM 2 CA GLU A 2 251.765 278.207 279.467 1.00 0.00 C +ATOM 3 CA PHE A 3 251.264 274.897 281.286 1.00 0.00 C +ATOM 4 CA ASP A 4 248.683 272.723 283.055 1.00 0.00 C +ATOM 5 CA SER A 5 246.990 273.053 286.452 1.00 0.00 C +ATOM 6 CA GLY A 6 247.141 270.196 288.968 1.00 0.00 C +ATOM 7 CA GLY A 7 244.327 267.690 288.403 1.00 0.00 C +ATOM 8 CA SER A 8 240.640 268.482 287.864 1.00 0.00 C +ATOM 9 CA GLY A 9 239.627 271.910 286.544 1.00 0.00 C +ATOM 10 CA THR A 10 238.130 274.912 284.740 1.00 0.00 C +ATOM 11 CA GLU A 11 237.004 273.803 281.273 1.00 0.00 C +ATOM 12 CA GLY A 12 235.099 270.938 279.635 1.00 0.00 C +ATOM 13 CA GLY A 13 235.641 269.436 276.176 1.00 0.00 C +ATOM 14 CA ASP A 14 239.335 268.726 275.570 1.00 0.00 C +ATOM 15 CA VAL A 15 240.708 270.567 272.530 1.00 0.00 C +ATOM 16 CA ALA A 16 239.361 272.050 269.289 1.00 0.00 C +ATOM 17 CA GLY A 17 239.038 275.550 267.819 1.00 0.00 C +ATOM 18 CA ALA A 18 240.711 278.916 267.197 1.00 0.00 C +ATOM 19 CA ARG A 19 238.724 282.074 266.425 1.00 0.00 C +ATOM 20 CA PRO A 20 239.625 285.042 268.637 1.00 0.00 C +ATOM 21 CA ARG A 21 241.565 286.202 271.704 1.00 0.00 C +ATOM 22 CA GLY A 22 241.279 289.751 273.059 1.00 0.00 C +ATOM 23 CA GLY A 23 239.064 289.757 276.159 1.00 0.00 C +ATOM 24 CA ALA A 24 235.568 290.520 274.851 1.00 0.00 C +ATOM 25 CA ASP A 25 233.010 292.753 273.122 1.00 0.00 C +ATOM 26 CA HIS A 26 229.398 292.642 271.914 1.00 0.00 C +ATOM 27 CA HIS A 27 227.549 295.898 271.210 1.00 0.00 C +ATOM 28 CA ALA A 28 226.882 298.480 273.931 1.00 0.00 C +ATOM 29 CA ALA A 29 227.285 298.013 277.691 1.00 0.00 C +ATOM 30 CA VAL A 30 228.681 300.969 279.647 1.00 0.00 C +ATOM 31 CA ASP A 31 229.204 302.132 283.237 1.00 0.00 C +ATOM 32 CA ARG A 32 230.984 301.159 286.462 1.00 0.00 C +ATOM 33 CA LEU A 33 234.569 300.076 285.761 1.00 0.00 C +ATOM 34 CA LEU A 34 236.392 299.660 282.441 1.00 0.00 C +ATOM 35 CA ASN A 35 236.609 299.209 278.664 1.00 0.00 C +ATOM 36 CA SER A 36 238.352 297.114 276.002 1.00 0.00 C +ATOM 37 CA SER A 37 241.552 296.750 273.965 1.00 0.00 C +ATOM 38 CA ASN A 38 244.756 297.428 275.912 1.00 0.00 C +ATOM 39 CA SER A 39 247.999 297.861 273.960 1.00 0.00 C +ATOM 40 CA LYS A 40 250.699 300.527 273.617 1.00 0.00 C +ATOM 41 CA GLN A 41 253.479 302.230 275.589 1.00 0.00 C +ATOM 42 CA SER A 42 256.458 301.740 277.913 1.00 0.00 C +ATOM 43 CA GLY A 43 257.824 302.798 281.308 1.00 0.00 C +ATOM 44 CA LYS A 44 258.986 299.986 283.602 1.00 0.00 C +ATOM 45 CA GLN A 45 256.549 297.360 284.897 1.00 0.00 C +ATOM 46 CA SER A 46 256.216 295.703 288.311 1.00 0.00 C +ATOM 47 CA LEU A 47 256.165 291.893 288.266 1.00 0.00 C +ATOM 48 CA HIS A 48 253.051 290.024 289.418 1.00 0.00 C +ATOM 49 CA HIS A 49 249.760 291.378 288.056 1.00 0.00 C +ATOM 50 CA ALA A 50 249.899 292.276 284.356 1.00 0.00 C +ATOM 51 CA GLY A 51 249.663 291.505 280.632 1.00 0.00 C +ATOM 52 CA ASP A 52 248.369 289.821 277.469 1.00 0.00 C +ATOM 53 CA ALA A 53 249.747 287.706 274.615 1.00 0.00 C +ATOM 54 CA ALA A 54 247.784 286.723 271.501 1.00 0.00 C +ATOM 55 CA ALA A 55 249.102 283.327 270.387 1.00 0.00 C +ATOM 56 CA ALA A 56 252.090 281.651 268.718 1.00 0.00 C +ATOM 57 CA SER A 57 254.494 280.091 266.208 1.00 0.00 C +ATOM 58 CA LEU A 58 254.018 276.711 264.515 1.00 0.00 C +ATOM 59 CA ARG A 59 253.843 273.088 263.349 1.00 0.00 C +ATOM 60 CA ARG A 60 254.324 272.207 259.673 1.00 0.00 C +ATOM 61 CA ARG A 61 254.489 269.042 257.559 1.00 0.00 C +ATOM 62 CA ALA A 62 252.595 267.803 254.494 1.00 0.00 C +ATOM 63 CA TYR A 63 251.223 264.505 253.170 1.00 0.00 C +ATOM 64 CA HIS A 64 248.603 265.543 250.606 1.00 0.00 C +ATOM 65 CA HIS A 65 247.896 263.984 247.202 1.00 0.00 C +ATOM 66 CA LEU A 66 246.628 260.405 246.886 1.00 0.00 C +ATOM 67 CA THR A 67 246.032 256.932 248.333 1.00 0.00 C +ATOM 68 CA ARG A 68 248.119 253.752 248.552 1.00 0.00 C +ATOM 69 CA ARG A 69 251.039 251.947 246.899 1.00 0.00 C +ATOM 70 CA ARG A 70 253.525 249.866 244.898 1.00 0.00 C +ATOM 71 CA ALA A 71 253.586 246.148 244.066 1.00 0.00 C +ATOM 72 CA ASP A 72 252.982 244.394 240.738 1.00 0.00 C +ATOM 73 CA HIS A 73 249.592 242.905 239.842 1.00 0.00 C +ATOM 74 CA PRO A 74 245.838 242.847 239.192 1.00 0.00 C +ATOM 75 CA GLY A 75 244.240 243.831 235.876 1.00 0.00 C +ATOM 76 CA SER A 76 246.554 243.642 232.856 1.00 0.00 C +ATOM 77 CA SER A 77 247.955 244.970 229.571 1.00 0.00 C +ATOM 78 CA TYR A 78 251.329 245.167 227.812 1.00 0.00 C +ATOM 79 CA ARG A 79 254.466 244.840 229.949 1.00 0.00 C +ATOM 80 CA GLY A 80 254.810 241.567 231.868 1.00 0.00 C +ATOM 81 CA ALA A 81 252.591 238.503 231.421 1.00 0.00 C +ATOM 82 CA SER A 82 252.578 234.787 232.264 1.00 0.00 C +ATOM 83 CA SER A 83 254.516 232.502 234.618 1.00 0.00 C +ATOM 84 CA PRO A 84 254.372 228.976 236.055 1.00 0.00 C +ATOM 85 CA PRO A 85 255.292 225.282 235.915 1.00 0.00 C +ATOM 86 CA VAL A 86 256.707 222.473 233.765 1.00 0.00 C +ATOM 87 CA GLU A 87 259.712 220.389 232.693 1.00 0.00 C +ATOM 88 CA ALA A 88 260.582 219.055 229.232 1.00 0.00 C +ATOM 89 CA PRO A 89 262.639 219.022 226.025 1.00 0.00 C +ATOM 90 CA VAL A 90 262.887 220.661 222.595 1.00 0.00 C +ATOM 91 CA ALA A 91 259.705 221.821 220.850 1.00 0.00 C +ATOM 92 CA GLY A 92 256.567 223.890 220.228 1.00 0.00 C +ATOM 93 CA ALA A 93 254.842 225.608 217.297 1.00 0.00 C +ATOM 94 CA VAL A 94 254.290 223.079 214.501 1.00 0.00 C +ATOM 95 CA ALA A 95 253.000 219.608 215.397 1.00 0.00 C +ATOM 96 CA HIS A 96 254.588 217.015 213.101 1.00 0.00 C +ATOM 97 CA ARG A 97 258.028 216.020 214.401 1.00 0.00 C +ATOM 98 CA ARG A 98 258.395 213.200 216.936 1.00 0.00 C +ATOM 99 CA SER A 99 259.234 209.646 215.849 1.00 0.00 C +ATOM 100 CA SER A 100 258.487 208.649 212.249 1.00 0.00 C +ATOM 101 CA ASP A 101 260.822 209.916 209.518 1.00 0.00 C +ATOM 102 CA SER A 102 260.916 210.999 205.866 1.00 0.00 C +ATOM 103 CA PRO A 103 260.767 210.678 202.073 1.00 0.00 C +ATOM 104 CA PRO A 104 259.846 209.542 198.554 1.00 0.00 C +ATOM 105 CA ARG A 105 258.558 212.102 196.043 1.00 0.00 C +ATOM 106 CA SER A 106 259.542 215.732 196.645 1.00 0.00 C +ATOM 107 CA PRO A 107 256.928 218.410 197.363 1.00 0.00 C +ATOM 108 CA ALA A 108 255.227 220.676 199.910 1.00 0.00 C +ATOM 109 CA PRO A 109 254.036 222.833 202.816 1.00 0.00 C +ATOM 110 CA PRO A 110 253.138 221.716 206.346 1.00 0.00 C +ATOM 111 CA PRO A 111 250.891 219.064 207.906 1.00 0.00 C +ATOM 112 CA THR A 112 247.174 219.557 207.230 1.00 0.00 C +ATOM 113 CA ARG A 113 244.093 219.154 209.436 1.00 0.00 C +ATOM 114 CA PRO A 114 241.319 218.589 211.985 1.00 0.00 C +ATOM 115 CA VAL A 115 239.175 215.580 212.913 1.00 0.00 C +ATOM 116 CA ARG A 116 240.759 212.550 214.595 1.00 0.00 C +ATOM 117 CA SER A 117 244.399 213.188 215.523 1.00 0.00 C +ATOM 118 CA GLY A 118 247.529 211.917 217.284 1.00 0.00 C +ATOM 119 CA THR A 119 251.020 211.038 218.531 1.00 0.00 C +ATOM 120 CA PRO A 120 253.714 209.116 220.419 1.00 0.00 C +ATOM 121 CA ARG A 121 256.840 208.095 222.343 1.00 0.00 C +ATOM 122 CA GLU A 122 258.135 204.779 223.700 1.00 0.00 C +ATOM 123 CA GLU A 123 259.806 204.616 227.121 1.00 0.00 C +ATOM 124 CA GLU A 124 263.136 205.966 228.388 1.00 0.00 C +ATOM 125 CA GLU A 125 265.145 206.092 231.623 1.00 0.00 C +ATOM 126 CA ARG A 126 265.886 203.227 234.023 1.00 0.00 C +ATOM 127 CA GLU A 127 264.193 200.067 235.313 1.00 0.00 C +ATOM 128 CA GLY A 128 264.768 196.431 236.295 1.00 0.00 C +ATOM 129 CA SER A 129 264.784 196.100 240.091 1.00 0.00 C +ATOM 130 CA GLU A 130 261.158 196.097 241.259 1.00 0.00 C +ATOM 131 CA ASP A 131 260.198 198.409 244.132 1.00 0.00 C +ATOM 132 CA GLU A 132 259.564 201.332 246.492 1.00 0.00 C +ATOM 133 CA GLU A 133 261.900 201.295 249.502 1.00 0.00 C +ATOM 134 CA GLU A 134 261.883 203.639 252.505 1.00 0.00 C +ATOM 135 CA GLN A 135 259.324 202.508 255.091 1.00 0.00 C +ATOM 136 CA ARG A 136 257.141 205.305 256.480 1.00 0.00 C +ATOM 137 CA GLU A 137 254.541 207.552 258.126 1.00 0.00 C +ATOM 138 CA LYS A 138 250.822 206.731 258.218 1.00 0.00 C +ATOM 139 CA ARG A 139 250.119 204.461 261.196 1.00 0.00 C +ATOM 140 CA GLU A 140 249.693 206.806 264.168 1.00 0.00 C +ATOM 141 CA GLY A 141 253.016 207.986 265.610 1.00 0.00 C +TER 142 GLY A 141 +END diff --git a/Plants/Q8H5X1/Q8H5X1.dcd b/Plants/Q8H5X1/Q8H5X1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..b805d91f461b1ab47d3bb414b8ff488ffce40a90 --- /dev/null +++ b/Plants/Q8H5X1/Q8H5X1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:97628c100142c54aaec88fac6613d9cacb0d1c4542605f8bf8c1f0865a57bc15 +size 10880276 diff --git a/Plants/Q8H5X1/top.pdb b/Plants/Q8H5X1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..2af59934699bc308043d713d17066ed097221752 --- /dev/null +++ b/Plants/Q8H5X1/top.pdb @@ -0,0 +1,88 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 208.942 246.189 252.109 1.00 0.00 C +ATOM 2 CA PHE A 2 211.519 248.656 250.772 1.00 0.00 C +ATOM 3 CA PRO A 3 211.578 252.457 250.509 1.00 0.00 C +ATOM 4 CA TRP A 4 215.118 253.786 250.979 1.00 0.00 C +ATOM 5 CA PRO A 5 217.767 252.790 248.429 1.00 0.00 C +ATOM 6 CA ASP A 6 220.101 252.115 245.494 1.00 0.00 C +ATOM 7 CA GLN A 7 222.446 249.889 243.478 1.00 0.00 C +ATOM 8 CA ALA A 8 221.560 247.520 240.629 1.00 0.00 C +ATOM 9 CA PRO A 9 220.593 245.694 237.428 1.00 0.00 C +ATOM 10 CA PRO A 10 221.557 242.052 236.857 1.00 0.00 C +ATOM 11 CA CYS A 11 224.807 240.347 235.835 1.00 0.00 C +ATOM 12 CA ARG A 12 228.369 239.727 234.633 1.00 0.00 C +ATOM 13 CA ILE A 13 231.979 239.195 235.728 1.00 0.00 C +ATOM 14 CA LEU A 14 232.166 237.456 239.112 1.00 0.00 C +ATOM 15 CA SER A 15 229.493 236.806 241.748 1.00 0.00 C +ATOM 16 CA ARG A 16 228.665 235.995 245.377 1.00 0.00 C +ATOM 17 CA SER A 17 230.811 233.446 247.225 1.00 0.00 C +ATOM 18 CA SER A 18 230.006 230.695 249.735 1.00 0.00 C +ATOM 19 CA SER A 19 228.950 228.124 252.341 1.00 0.00 C +ATOM 20 CA ARG A 20 228.923 229.966 255.676 1.00 0.00 C +ATOM 21 CA ARG A 21 226.537 232.923 255.955 1.00 0.00 C +ATOM 22 CA ASP A 22 225.346 234.906 258.983 1.00 0.00 C +ATOM 23 CA LEU A 23 226.635 238.294 260.155 1.00 0.00 C +ATOM 24 CA GLU A 24 229.402 239.725 257.962 1.00 0.00 C +ATOM 25 CA ILE A 25 232.314 242.059 257.192 1.00 0.00 C +ATOM 26 CA LYS A 26 234.197 245.370 257.290 1.00 0.00 C +ATOM 27 CA GLY A 27 237.565 246.944 256.456 1.00 0.00 C +ATOM 28 CA ASP A 28 240.745 246.021 258.341 1.00 0.00 C +ATOM 29 CA GLY A 29 241.497 242.287 258.434 1.00 0.00 C +ATOM 30 CA ARG A 30 244.774 242.042 260.362 1.00 0.00 C +ATOM 31 CA GLU A 31 248.137 240.978 261.803 1.00 0.00 C +ATOM 32 CA ARG A 32 251.423 239.051 261.752 1.00 0.00 C +ATOM 33 CA MET A 33 253.337 237.420 264.614 1.00 0.00 C +ATOM 34 CA VAL A 34 255.014 238.367 267.901 1.00 0.00 C +ATOM 35 CA TRP A 35 252.552 240.121 270.219 1.00 0.00 C +ATOM 36 CA GLU A 36 249.542 241.800 268.596 1.00 0.00 C +ATOM 37 CA THR A 37 246.411 243.963 268.410 1.00 0.00 C +ATOM 38 CA THR A 38 245.370 247.096 266.508 1.00 0.00 C +ATOM 39 CA THR A 39 247.780 249.186 264.424 1.00 0.00 C +ATOM 40 CA SER A 40 251.531 248.948 263.798 1.00 0.00 C +ATOM 41 CA GLY A 41 253.881 248.341 260.862 1.00 0.00 C +ATOM 42 CA GLN A 42 254.597 245.174 258.868 1.00 0.00 C +ATOM 43 CA HIS A 43 255.422 241.556 258.004 1.00 0.00 C +ATOM 44 CA ARG A 44 254.335 239.422 255.041 1.00 0.00 C +ATOM 45 CA ARG A 45 256.035 236.057 254.487 1.00 0.00 C +ATOM 46 CA GLN A 46 256.286 235.126 250.801 1.00 0.00 C +ATOM 47 CA GLN A 47 257.012 234.085 247.208 1.00 0.00 C +ATOM 48 CA LEU A 48 259.814 234.808 244.730 1.00 0.00 C +ATOM 49 CA GLU A 49 262.689 234.868 242.230 1.00 0.00 C +ATOM 50 CA ALA A 50 262.175 236.551 238.850 1.00 0.00 C +ATOM 51 CA SER A 51 261.815 240.299 238.271 1.00 0.00 C +ATOM 52 CA LYS A 52 265.091 242.210 237.906 1.00 0.00 C +ATOM 53 CA ALA A 53 268.283 244.283 237.733 1.00 0.00 C +ATOM 54 CA ALA A 54 271.285 245.384 239.804 1.00 0.00 C +ATOM 55 CA GLY A 55 270.873 248.793 241.453 1.00 0.00 C +ATOM 56 CA GLY A 56 271.824 252.336 242.484 1.00 0.00 C +ATOM 57 CA GLY A 57 271.746 253.250 246.181 1.00 0.00 C +ATOM 58 CA GLY A 58 271.974 255.966 248.844 1.00 0.00 C +ATOM 59 CA SER A 59 270.157 259.312 248.701 1.00 0.00 C +ATOM 60 CA ARG A 60 266.587 259.644 247.412 1.00 0.00 C +ATOM 61 CA PRO A 61 266.555 258.449 243.795 1.00 0.00 C +ATOM 62 CA MET A 62 265.159 259.295 240.352 1.00 0.00 C +ATOM 63 CA ARG A 63 261.355 259.402 240.177 1.00 0.00 C +ATOM 64 CA MET A 64 258.427 259.740 237.762 1.00 0.00 C +ATOM 65 CA THR A 65 255.613 261.261 235.693 1.00 0.00 C +ATOM 66 CA GLU A 66 254.686 264.370 233.694 1.00 0.00 C +ATOM 67 CA GLY A 67 256.542 267.385 235.100 1.00 0.00 C +ATOM 68 CA THR A 68 255.471 268.652 238.529 1.00 0.00 C +ATOM 69 CA THR A 69 255.330 266.204 241.446 1.00 0.00 C +ATOM 70 CA LEU A 70 255.388 266.940 245.183 1.00 0.00 C +ATOM 71 CA ALA A 71 258.543 265.880 247.038 1.00 0.00 C +ATOM 72 CA MET A 72 261.632 266.238 249.239 1.00 0.00 C +ATOM 73 CA ALA A 73 264.608 266.519 251.602 1.00 0.00 C +ATOM 74 CA THR A 74 265.472 269.252 254.112 1.00 0.00 C +ATOM 75 CA ARG A 75 267.504 270.002 257.246 1.00 0.00 C +ATOM 76 CA THR A 76 270.647 270.339 259.374 1.00 0.00 C +ATOM 77 CA ASP A 77 274.092 269.088 258.336 1.00 0.00 C +ATOM 78 CA SER A 78 277.531 270.343 257.280 1.00 0.00 C +ATOM 79 CA GLY A 79 280.922 271.705 256.203 1.00 0.00 C +ATOM 80 CA ILE A 80 284.501 272.451 255.129 1.00 0.00 C +ATOM 81 CA ASP A 81 284.246 273.632 251.515 1.00 0.00 C +ATOM 82 CA CYS A 82 284.675 276.241 248.772 1.00 0.00 C +ATOM 83 CA GLU A 83 286.452 277.990 245.891 1.00 0.00 C +ATOM 84 CA LEU A 84 287.311 280.753 243.412 1.00 0.00 C +TER 85 LEU A 84 +END diff --git a/Plants/Q8H672/Q8H672.dcd b/Plants/Q8H672/Q8H672.dcd new file mode 100644 index 0000000000000000000000000000000000000000..5b017cf6ca68c73569a8beae3ad461223465aaa0 --- /dev/null +++ b/Plants/Q8H672/Q8H672.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c24b9a17bc74b3d09d1aced75ca53b43da210ddf785c4a28bf72ed77d4c2ad22 +size 7760276 diff --git a/Plants/Q8H672/top.pdb b/Plants/Q8H672/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..be1fb19a3630506c07f2fecf4abe683226c9f20c --- /dev/null +++ b/Plants/Q8H672/top.pdb @@ -0,0 +1,62 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 248.203 283.055 260.607 1.00 0.00 C +ATOM 2 CA ASP A 2 247.874 279.907 258.485 1.00 0.00 C +ATOM 3 CA ALA A 3 250.882 277.581 258.246 1.00 0.00 C +ATOM 4 CA ALA A 4 251.090 275.302 261.292 1.00 0.00 C +ATOM 5 CA LYS A 5 248.441 272.615 260.762 1.00 0.00 C +ATOM 6 CA THR A 6 245.620 271.073 262.806 1.00 0.00 C +ATOM 7 CA THR A 7 245.931 267.277 262.934 1.00 0.00 C +ATOM 8 CA PRO A 8 245.904 263.491 263.359 1.00 0.00 C +ATOM 9 CA PRO A 9 248.732 261.433 261.851 1.00 0.00 C +ATOM 10 CA ALA A 10 250.730 258.529 263.296 1.00 0.00 C +ATOM 11 CA ALA A 11 248.995 256.014 265.572 1.00 0.00 C +ATOM 12 CA GLY A 12 249.329 252.225 265.797 1.00 0.00 C +ATOM 13 CA GLY A 13 251.448 250.019 268.067 1.00 0.00 C +ATOM 14 CA ASP A 14 251.975 246.406 266.979 1.00 0.00 C +ATOM 15 CA HIS A 15 251.231 246.290 263.244 1.00 0.00 C +ATOM 16 CA GLY A 16 253.477 243.701 261.581 1.00 0.00 C +ATOM 17 CA GLY A 17 255.825 242.646 258.772 1.00 0.00 C +ATOM 18 CA ASP A 18 255.975 243.868 255.166 1.00 0.00 C +ATOM 19 CA GLN A 19 256.319 243.293 251.416 1.00 0.00 C +ATOM 20 CA LEU A 20 256.403 245.128 248.077 1.00 0.00 C +ATOM 21 CA GLY A 21 256.814 248.162 245.810 1.00 0.00 C +ATOM 22 CA GLU A 22 258.580 250.912 247.768 1.00 0.00 C +ATOM 23 CA ALA A 23 259.990 253.968 249.554 1.00 0.00 C +ATOM 24 CA GLY A 24 261.164 254.764 253.090 1.00 0.00 C +ATOM 25 CA ASP A 25 261.678 252.664 256.228 1.00 0.00 C +ATOM 26 CA GLY A 26 258.165 251.500 257.134 1.00 0.00 C +ATOM 27 CA VAL A 27 256.059 251.131 253.981 1.00 0.00 C +ATOM 28 CA HIS A 28 252.864 253.199 253.790 1.00 0.00 C +ATOM 29 CA SER A 29 252.696 256.053 251.271 1.00 0.00 C +ATOM 30 CA GLY A 30 250.488 255.633 248.195 1.00 0.00 C +ATOM 31 CA ALA A 31 247.520 256.063 245.844 1.00 0.00 C +ATOM 32 CA VAL A 32 245.469 252.881 246.277 1.00 0.00 C +ATOM 33 CA ARG A 33 247.204 249.525 246.764 1.00 0.00 C +ATOM 34 CA HIS A 34 249.219 248.111 249.673 1.00 0.00 C +ATOM 35 CA ARG A 35 250.569 246.332 252.759 1.00 0.00 C +ATOM 36 CA ARG A 36 250.181 247.708 256.291 1.00 0.00 C +ATOM 37 CA GLN A 37 247.123 248.077 258.533 1.00 0.00 C +ATOM 38 CA HIS A 38 243.331 247.832 258.811 1.00 0.00 C +ATOM 39 CA GLN A 39 239.824 249.266 258.407 1.00 0.00 C +ATOM 40 CA GLN A 40 239.741 251.911 255.666 1.00 0.00 C +ATOM 41 CA ARG A 41 237.645 251.740 252.489 1.00 0.00 C +ATOM 42 CA ARG A 42 238.374 249.750 249.323 1.00 0.00 C +ATOM 43 CA ARG A 43 240.779 246.798 249.220 1.00 0.00 C +ATOM 44 CA GLY A 44 242.004 246.271 245.651 1.00 0.00 C +ATOM 45 CA ALA A 45 241.366 243.747 242.869 1.00 0.00 C +ATOM 46 CA HIS A 46 242.123 242.538 239.336 1.00 0.00 C +ATOM 47 CA LEU A 47 243.426 244.157 236.143 1.00 0.00 C +ATOM 48 CA LYS A 48 246.698 244.474 234.217 1.00 0.00 C +ATOM 49 CA LYS A 49 248.209 242.688 231.210 1.00 0.00 C +ATOM 50 CA SER A 50 250.570 240.276 229.442 1.00 0.00 C +ATOM 51 CA LEU A 51 251.566 237.023 231.156 1.00 0.00 C +ATOM 52 CA LYS A 52 253.575 233.826 231.668 1.00 0.00 C +ATOM 53 CA ASP A 53 252.480 230.195 232.037 1.00 0.00 C +ATOM 54 CA ASN A 54 255.198 227.890 230.691 1.00 0.00 C +ATOM 55 CA GLY A 55 255.939 226.206 227.354 1.00 0.00 C +ATOM 56 CA SER A 56 254.539 226.462 223.820 1.00 0.00 C +ATOM 57 CA LEU A 57 252.026 229.251 223.170 1.00 0.00 C +ATOM 58 CA SER A 58 250.420 231.161 226.049 1.00 0.00 C +TER 59 SER A 58 +END diff --git a/Plants/Q8H6E7/Q8H6E7.dcd b/Plants/Q8H6E7/Q8H6E7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..d2b014589881dc891a4c9e50d5ada05b73b33e86 --- /dev/null +++ b/Plants/Q8H6E7/Q8H6E7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:1a4e768e2f08d26bcafc263e9841b9cdb0d32eebad34ab3eb3bd4fd3dbabfe67 +size 11120276 diff --git a/Plants/Q8H6E7/top.pdb b/Plants/Q8H6E7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..4f28b9a9d463e6ce26b2077bfa322f398434811b --- /dev/null +++ b/Plants/Q8H6E7/top.pdb @@ -0,0 +1,90 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 259.333 271.470 275.942 1.00 0.00 C +ATOM 2 CA ALA A 2 262.213 273.898 275.371 1.00 0.00 C +ATOM 3 CA GLY A 3 263.811 275.586 272.353 1.00 0.00 C +ATOM 4 CA ILE A 4 267.482 274.579 272.190 1.00 0.00 C +ATOM 5 CA ILE A 5 269.061 271.300 271.064 1.00 0.00 C +ATOM 6 CA HIS A 6 267.777 270.417 267.587 1.00 0.00 C +ATOM 7 CA LYS A 7 264.125 271.259 266.899 1.00 0.00 C +ATOM 8 CA ILE A 8 260.616 272.496 266.079 1.00 0.00 C +ATOM 9 CA GLU A 9 257.868 269.866 265.872 1.00 0.00 C +ATOM 10 CA GLU A 10 256.475 267.558 263.180 1.00 0.00 C +ATOM 11 CA LYS A 11 254.761 264.308 262.170 1.00 0.00 C +ATOM 12 CA LEU A 12 252.979 261.125 263.269 1.00 0.00 C +ATOM 13 CA HIS A 13 252.026 258.045 265.299 1.00 0.00 C +ATOM 14 CA ILE A 14 253.306 258.488 268.860 1.00 0.00 C +ATOM 15 CA GLY A 15 255.052 256.619 271.684 1.00 0.00 C +ATOM 16 CA GLY A 16 255.089 253.416 273.747 1.00 0.00 C +ATOM 17 CA GLY A 17 258.550 252.007 274.488 1.00 0.00 C +ATOM 18 CA HIS A 18 259.475 248.451 275.497 1.00 0.00 C +ATOM 19 CA LYS A 19 261.139 245.871 273.242 1.00 0.00 C +ATOM 20 CA GLU A 20 260.967 242.880 270.888 1.00 0.00 C +ATOM 21 CA GLU A 21 261.656 240.979 267.659 1.00 0.00 C +ATOM 22 CA GLU A 22 258.370 240.203 265.893 1.00 0.00 C +ATOM 23 CA HIS A 23 255.652 237.795 267.046 1.00 0.00 C +ATOM 24 CA LYS A 24 254.366 234.395 265.904 1.00 0.00 C +ATOM 25 CA LYS A 25 254.045 233.214 262.296 1.00 0.00 C +ATOM 26 CA GLU A 26 252.189 232.960 258.978 1.00 0.00 C +ATOM 27 CA GLU A 27 251.601 235.291 256.022 1.00 0.00 C +ATOM 28 CA HIS A 28 251.457 238.631 254.194 1.00 0.00 C +ATOM 29 CA LYS A 29 252.207 239.494 250.560 1.00 0.00 C +ATOM 30 CA GLY A 30 250.598 241.720 247.919 1.00 0.00 C +ATOM 31 CA GLU A 31 249.994 240.362 244.412 1.00 0.00 C +ATOM 32 CA GLY A 32 248.886 239.697 240.827 1.00 0.00 C +ATOM 33 CA HIS A 33 250.508 240.529 237.481 1.00 0.00 C +ATOM 34 CA LYS A 34 249.757 240.937 233.769 1.00 0.00 C +ATOM 35 CA GLU A 35 247.462 241.967 230.907 1.00 0.00 C +ATOM 36 CA GLY A 36 247.318 242.855 227.205 1.00 0.00 C +ATOM 37 CA PHE A 37 250.475 241.643 225.449 1.00 0.00 C +ATOM 38 CA VAL A 38 254.129 240.663 225.898 1.00 0.00 C +ATOM 39 CA GLU A 39 255.946 238.091 223.752 1.00 0.00 C +ATOM 40 CA LYS A 40 257.236 234.718 222.540 1.00 0.00 C +ATOM 41 CA ILE A 41 255.458 231.935 220.639 1.00 0.00 C +ATOM 42 CA LYS A 42 251.757 231.679 221.507 1.00 0.00 C +ATOM 43 CA ASP A 43 249.576 230.621 224.447 1.00 0.00 C +ATOM 44 CA LYS A 44 246.395 232.695 224.147 1.00 0.00 C +ATOM 45 CA ILE A 45 245.648 235.960 222.329 1.00 0.00 C +ATOM 46 CA HIS A 46 246.699 239.005 220.295 1.00 0.00 C +ATOM 47 CA GLY A 47 245.351 241.237 217.516 1.00 0.00 C +ATOM 48 CA GLU A 48 241.885 241.478 215.952 1.00 0.00 C +ATOM 49 CA GLU A 49 241.416 241.441 212.171 1.00 0.00 C +ATOM 50 CA SER A 50 240.169 244.745 210.741 1.00 0.00 C +ATOM 51 CA GLY A 51 241.650 248.184 210.037 1.00 0.00 C +ATOM 52 CA GLU A 52 241.325 251.691 211.489 1.00 0.00 C +ATOM 53 CA HIS A 53 239.323 253.431 214.224 1.00 0.00 C +ATOM 54 CA HIS A 54 241.176 252.807 217.494 1.00 0.00 C +ATOM 55 CA LYS A 55 244.952 252.384 217.209 1.00 0.00 C +ATOM 56 CA ASP A 56 246.799 251.140 220.301 1.00 0.00 C +ATOM 57 CA GLY A 57 249.521 252.933 222.274 1.00 0.00 C +ATOM 58 CA LYS A 58 250.053 256.028 224.430 1.00 0.00 C +ATOM 59 CA GLU A 59 247.896 255.597 227.541 1.00 0.00 C +ATOM 60 CA LYS A 60 248.085 258.375 230.142 1.00 0.00 C +ATOM 61 CA LYS A 61 246.291 259.533 233.297 1.00 0.00 C +ATOM 62 CA LYS A 62 244.320 256.744 234.985 1.00 0.00 C +ATOM 63 CA LYS A 63 243.266 255.997 238.569 1.00 0.00 C +ATOM 64 CA LYS A 64 246.308 254.893 240.581 1.00 0.00 C +ATOM 65 CA ASP A 65 248.076 251.529 240.319 1.00 0.00 C +ATOM 66 CA LYS A 66 246.765 249.153 242.994 1.00 0.00 C +ATOM 67 CA LYS A 67 249.021 248.286 245.938 1.00 0.00 C +ATOM 68 CA GLU A 68 251.165 247.904 249.065 1.00 0.00 C +ATOM 69 CA LYS A 69 252.161 246.741 252.554 1.00 0.00 C +ATOM 70 CA LYS A 70 251.217 246.504 256.237 1.00 0.00 C +ATOM 71 CA GLU A 71 253.806 245.361 258.788 1.00 0.00 C +ATOM 72 CA LYS A 72 254.580 246.051 262.454 1.00 0.00 C +ATOM 73 CA LYS A 73 252.008 246.472 265.232 1.00 0.00 C +ATOM 74 CA HIS A 74 249.947 249.677 265.260 1.00 0.00 C +ATOM 75 CA ASP A 75 246.964 251.987 265.789 1.00 0.00 C +ATOM 76 CA GLY A 76 244.073 254.431 265.360 1.00 0.00 C +ATOM 77 CA HIS A 77 240.384 255.042 266.095 1.00 0.00 C +ATOM 78 CA ASP A 78 237.569 253.759 268.319 1.00 0.00 C +ATOM 79 CA SER A 79 237.027 253.462 272.078 1.00 0.00 C +ATOM 80 CA SER A 80 236.102 256.102 274.664 1.00 0.00 C +ATOM 81 CA SER A 81 234.194 254.874 277.725 1.00 0.00 C +ATOM 82 CA SER A 82 232.592 256.468 280.793 1.00 0.00 C +ATOM 83 CA SER A 83 232.806 256.701 284.590 1.00 0.00 C +ATOM 84 CA ASP A 84 235.130 256.832 287.606 1.00 0.00 C +ATOM 85 CA SER A 85 237.362 254.611 289.750 1.00 0.00 C +ATOM 86 CA ASP A 86 235.776 251.734 291.681 1.00 0.00 C +TER 87 ASP A 86 +END diff --git a/Plants/Q8H7K2/Q8H7K2.dcd b/Plants/Q8H7K2/Q8H7K2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..e88a6e073897a7f2feb7a9fb0f490a233d07b97a --- /dev/null +++ b/Plants/Q8H7K2/Q8H7K2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:a46d7a16bfed8a37a3f2b34b6184a4cf3f86bed73536cffb9beb6bbbe6d1e561 +size 15320276 diff --git a/Plants/Q8H7K2/top.pdb b/Plants/Q8H7K2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..304c1003689a07f383f52cccf89fc1143208f839 --- /dev/null +++ b/Plants/Q8H7K2/top.pdb @@ -0,0 +1,125 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 246.574 275.170 198.515 1.00 0.00 C +ATOM 2 CA ARG A 2 249.315 275.051 201.159 1.00 0.00 C +ATOM 3 CA VAL A 3 249.939 277.657 203.868 1.00 0.00 C +ATOM 4 CA THR A 4 250.474 276.973 207.578 1.00 0.00 C +ATOM 5 CA PHE A 5 249.471 276.857 211.252 1.00 0.00 C +ATOM 6 CA ASP A 6 247.921 273.476 212.078 1.00 0.00 C +ATOM 7 CA GLY A 7 247.045 271.510 215.222 1.00 0.00 C +ATOM 8 CA SER A 8 243.290 270.957 215.553 1.00 0.00 C +ATOM 9 CA TYR A 9 242.679 268.109 218.009 1.00 0.00 C +ATOM 10 CA ASN A 10 244.768 267.558 221.148 1.00 0.00 C +ATOM 11 CA MET A 11 248.450 266.696 221.612 1.00 0.00 C +ATOM 12 CA SER A 12 250.795 265.685 224.440 1.00 0.00 C +ATOM 13 CA SER A 13 254.175 265.892 226.186 1.00 0.00 C +ATOM 14 CA SER A 14 255.193 266.593 229.789 1.00 0.00 C +ATOM 15 CA VAL A 15 258.523 268.421 230.083 1.00 0.00 C +ATOM 16 CA SER A 16 261.097 269.197 227.383 1.00 0.00 C +ATOM 17 CA HIS A 17 264.635 268.539 226.132 1.00 0.00 C +ATOM 18 CA PRO A 18 266.649 271.198 224.291 1.00 0.00 C +ATOM 19 CA ALA A 19 264.720 273.894 222.415 1.00 0.00 C +ATOM 20 CA ALA A 20 261.739 272.843 220.287 1.00 0.00 C +ATOM 21 CA THR A 21 258.815 270.550 221.127 1.00 0.00 C +ATOM 22 CA HIS A 22 256.513 267.589 220.457 1.00 0.00 C +ATOM 23 CA HIS A 23 258.355 264.582 221.899 1.00 0.00 C +ATOM 24 CA SER A 24 260.464 261.634 220.726 1.00 0.00 C +ATOM 25 CA GLY A 25 260.033 258.370 218.808 1.00 0.00 C +ATOM 26 CA GLY A 26 259.290 254.633 218.765 1.00 0.00 C +ATOM 27 CA PRO A 27 256.305 252.532 217.676 1.00 0.00 C +ATOM 28 CA ILE A 28 255.697 249.131 219.282 1.00 0.00 C +ATOM 29 CA GLU A 29 252.754 246.845 220.076 1.00 0.00 C +ATOM 30 CA PRO A 30 249.374 247.876 221.500 1.00 0.00 C +ATOM 31 CA LYS A 31 246.688 245.307 220.664 1.00 0.00 C +ATOM 32 CA MET A 32 243.088 244.693 221.749 1.00 0.00 C +ATOM 33 CA LYS A 33 240.744 242.858 219.370 1.00 0.00 C +ATOM 34 CA THR A 34 242.182 239.675 217.847 1.00 0.00 C +ATOM 35 CA THR A 35 242.698 236.251 219.436 1.00 0.00 C +ATOM 36 CA PRO A 36 241.312 233.497 221.674 1.00 0.00 C +ATOM 37 CA LEU A 37 240.138 230.166 220.245 1.00 0.00 C +ATOM 38 CA PRO A 38 240.254 226.619 218.860 1.00 0.00 C +ATOM 39 CA ASN A 39 240.637 223.211 217.200 1.00 0.00 C +ATOM 40 CA ALA A 40 244.122 221.690 216.955 1.00 0.00 C +ATOM 41 CA ILE A 41 247.112 224.043 216.762 1.00 0.00 C +ATOM 42 CA ASP A 42 250.070 226.288 215.911 1.00 0.00 C +ATOM 43 CA LYS A 43 253.110 224.607 217.476 1.00 0.00 C +ATOM 44 CA PRO A 44 256.815 224.724 218.355 1.00 0.00 C +ATOM 45 CA ARG A 45 259.357 227.496 217.746 1.00 0.00 C +ATOM 46 CA HIS A 46 258.043 230.979 216.934 1.00 0.00 C +ATOM 47 CA PRO A 47 256.888 234.414 215.758 1.00 0.00 C +ATOM 48 CA SER A 48 253.106 234.419 215.301 1.00 0.00 C +ATOM 49 CA LEU A 49 249.903 232.422 214.775 1.00 0.00 C +ATOM 50 CA LEU A 50 248.102 232.423 218.132 1.00 0.00 C +ATOM 51 CA ILE A 51 250.233 230.694 220.774 1.00 0.00 C +ATOM 52 CA SER A 52 251.088 232.173 224.180 1.00 0.00 C +ATOM 53 CA SER A 53 249.523 232.961 227.563 1.00 0.00 C +ATOM 54 CA ARG A 54 249.171 232.593 231.339 1.00 0.00 C +ATOM 55 CA ARG A 55 248.318 229.099 232.598 1.00 0.00 C +ATOM 56 CA ARG A 56 248.062 227.938 236.217 1.00 0.00 C +ATOM 57 CA ALA A 57 245.226 226.076 237.951 1.00 0.00 C +ATOM 58 CA SER A 58 242.771 227.677 240.386 1.00 0.00 C +ATOM 59 CA ALA A 59 240.948 229.749 243.013 1.00 0.00 C +ATOM 60 CA SER A 60 238.802 231.777 245.421 1.00 0.00 C +ATOM 61 CA PRO A 61 237.748 231.629 249.080 1.00 0.00 C +ATOM 62 CA PRO A 62 238.701 234.564 251.314 1.00 0.00 C +ATOM 63 CA GLY A 63 241.341 234.991 254.028 1.00 0.00 C +ATOM 64 CA LEU A 64 245.006 234.158 253.407 1.00 0.00 C +ATOM 65 CA PRO A 65 247.013 237.372 253.804 1.00 0.00 C +ATOM 66 CA LEU A 66 246.129 239.657 250.886 1.00 0.00 C +ATOM 67 CA THR A 67 244.433 242.778 252.265 1.00 0.00 C +ATOM 68 CA ALA A 68 244.376 245.225 255.184 1.00 0.00 C +ATOM 69 CA PRO A 69 244.480 248.988 255.775 1.00 0.00 C +ATOM 70 CA ALA A 70 241.454 250.503 257.524 1.00 0.00 C +ATOM 71 CA THR A 71 240.336 249.345 260.978 1.00 0.00 C +ATOM 72 CA MET A 72 241.533 246.861 263.606 1.00 0.00 C +ATOM 73 CA ASN A 73 240.679 243.160 263.306 1.00 0.00 C +ATOM 74 CA PRO A 74 238.736 240.011 264.216 1.00 0.00 C +ATOM 75 CA GLY A 75 236.628 237.772 266.464 1.00 0.00 C +ATOM 76 CA ALA A 76 237.707 237.493 270.107 1.00 0.00 C +ATOM 77 CA LEU A 77 240.177 235.759 272.433 1.00 0.00 C +ATOM 78 CA ASP A 78 243.336 237.869 272.725 1.00 0.00 C +ATOM 79 CA PRO A 79 243.351 239.899 275.949 1.00 0.00 C +ATOM 80 CA ASP A 80 243.012 241.322 279.467 1.00 0.00 C +ATOM 81 CA THR A 81 244.544 240.314 282.807 1.00 0.00 C +ATOM 82 CA LEU A 82 246.678 241.966 285.496 1.00 0.00 C +ATOM 83 CA ASN A 83 249.731 240.521 287.259 1.00 0.00 C +ATOM 84 CA SER A 84 253.494 240.075 287.655 1.00 0.00 C +ATOM 85 CA LYS A 85 254.958 240.100 291.173 1.00 0.00 C +ATOM 86 CA VAL A 86 256.085 240.405 294.800 1.00 0.00 C +ATOM 87 CA ALA A 87 254.507 238.752 297.848 1.00 0.00 C +ATOM 88 CA ASP A 88 250.814 239.590 298.275 1.00 0.00 C +ATOM 89 CA PRO A 89 248.207 242.043 296.971 1.00 0.00 C +ATOM 90 CA ALA A 90 247.634 245.810 297.015 1.00 0.00 C +ATOM 91 CA ILE A 91 245.689 248.899 298.106 1.00 0.00 C +ATOM 92 CA PRO A 92 246.277 251.987 295.954 1.00 0.00 C +ATOM 93 CA SER A 93 246.741 253.282 292.401 1.00 0.00 C +ATOM 94 CA LEU A 94 243.487 254.512 290.847 1.00 0.00 C +ATOM 95 CA GLY A 95 242.313 258.120 291.197 1.00 0.00 C +ATOM 96 CA ALA A 96 242.693 260.150 287.996 1.00 0.00 C +ATOM 97 CA PRO A 97 241.383 260.266 284.420 1.00 0.00 C +ATOM 98 CA ASP A 98 243.907 258.540 282.147 1.00 0.00 C +ATOM 99 CA PRO A 99 245.420 256.661 279.198 1.00 0.00 C +ATOM 100 CA SER A 100 248.083 258.179 276.936 1.00 0.00 C +ATOM 101 CA ALA A 101 250.717 260.531 278.367 1.00 0.00 C +ATOM 102 CA ARG A 102 252.999 262.672 280.541 1.00 0.00 C +ATOM 103 CA LYS A 103 252.469 263.889 284.112 1.00 0.00 C +ATOM 104 CA ALA A 104 250.881 267.141 285.305 1.00 0.00 C +ATOM 105 CA VAL A 105 247.082 267.333 285.100 1.00 0.00 C +ATOM 106 CA ARG A 106 245.140 268.487 288.168 1.00 0.00 C +ATOM 107 CA ARG A 107 245.831 270.738 291.163 1.00 0.00 C +ATOM 108 CA PRO A 108 248.227 271.288 294.074 1.00 0.00 C +ATOM 109 CA HIS A 109 251.948 272.017 293.703 1.00 0.00 C +ATOM 110 CA HIS A 110 254.491 272.493 290.906 1.00 0.00 C +ATOM 111 CA SER A 111 256.996 271.563 288.190 1.00 0.00 C +ATOM 112 CA ALA A 112 259.769 270.626 285.750 1.00 0.00 C +ATOM 113 CA SER A 113 262.282 270.200 282.919 1.00 0.00 C +ATOM 114 CA SER A 114 264.617 267.767 281.145 1.00 0.00 C +ATOM 115 CA ARG A 115 266.142 264.325 281.730 1.00 0.00 C +ATOM 116 CA HIS A 116 267.309 260.975 280.339 1.00 0.00 C +ATOM 117 CA TRP A 117 268.459 257.642 281.780 1.00 0.00 C +ATOM 118 CA GLY A 118 267.071 254.228 280.812 1.00 0.00 C +ATOM 119 CA LEU A 119 266.400 251.050 278.822 1.00 0.00 C +ATOM 120 CA TYR A 120 268.858 248.173 278.371 1.00 0.00 C +ATOM 121 CA SER A 121 269.925 244.798 279.780 1.00 0.00 C +TER 122 SER A 121 +END diff --git a/Plants/Q8H7S9/Q8H7S9.dcd b/Plants/Q8H7S9/Q8H7S9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..1dcdff5dcc91a6a7a93cb5d94f3cb733a9619bf1 --- /dev/null +++ b/Plants/Q8H7S9/Q8H7S9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:222b26a8d47dbdb2ce4ac1257dd1ca35ddd3ba25b937c0b2151d529b9e6e8b94 +size 18320276 diff --git a/Plants/Q8H7S9/top.pdb b/Plants/Q8H7S9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..43f39be70e8a32c3dfac374c71df2129cf1474f4 --- /dev/null +++ b/Plants/Q8H7S9/top.pdb @@ -0,0 +1,150 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 238.321 229.529 250.935 1.00 0.00 C +ATOM 2 CA ALA A 2 237.804 232.994 252.433 1.00 0.00 C +ATOM 3 CA ALA A 3 238.733 236.514 253.558 1.00 0.00 C +ATOM 4 CA ARG A 4 238.493 239.840 251.714 1.00 0.00 C +ATOM 5 CA ARG A 5 240.792 241.845 249.432 1.00 0.00 C +ATOM 6 CA ARG A 6 242.206 245.320 248.771 1.00 0.00 C +ATOM 7 CA GLY A 7 245.678 246.300 247.543 1.00 0.00 C +ATOM 8 CA ALA A 8 247.547 242.998 247.201 1.00 0.00 C +ATOM 9 CA ARG A 9 247.407 240.824 250.327 1.00 0.00 C +ATOM 10 CA GLY A 10 246.033 237.272 250.455 1.00 0.00 C +ATOM 11 CA GLY A 11 243.729 236.289 247.584 1.00 0.00 C +ATOM 12 CA ASP A 12 242.632 234.580 244.361 1.00 0.00 C +ATOM 13 CA GLY A 13 239.434 233.173 242.840 1.00 0.00 C +ATOM 14 CA THR A 14 238.536 233.447 239.148 1.00 0.00 C +ATOM 15 CA ARG A 15 237.250 236.828 237.952 1.00 0.00 C +ATOM 16 CA ALA A 16 234.541 237.062 235.283 1.00 0.00 C +ATOM 17 CA ARG A 17 233.866 240.504 233.794 1.00 0.00 C +ATOM 18 CA ARG A 18 234.228 241.923 230.276 1.00 0.00 C +ATOM 19 CA ARG A 19 233.629 241.972 226.514 1.00 0.00 C +ATOM 20 CA ASP A 20 231.023 241.873 223.737 1.00 0.00 C +ATOM 21 CA GLY A 21 229.123 243.011 220.636 1.00 0.00 C +ATOM 22 CA ASP A 22 231.616 242.966 217.755 1.00 0.00 C +ATOM 23 CA GLY A 23 232.925 239.877 215.949 1.00 0.00 C +ATOM 24 CA ASP A 24 230.352 237.950 213.903 1.00 0.00 C +ATOM 25 CA GLY A 25 229.038 236.319 210.721 1.00 0.00 C +ATOM 26 CA ALA A 26 226.344 238.396 209.006 1.00 0.00 C +ATOM 27 CA ALA A 27 224.974 240.684 206.285 1.00 0.00 C +ATOM 28 CA MET A 28 226.616 243.749 204.726 1.00 0.00 C +ATOM 29 CA VAL A 29 226.156 247.245 206.167 1.00 0.00 C +ATOM 30 CA ALA A 30 223.258 249.154 207.740 1.00 0.00 C +ATOM 31 CA ARG A 31 219.704 250.179 208.655 1.00 0.00 C +ATOM 32 CA GLY A 32 215.901 250.039 208.483 1.00 0.00 C +ATOM 33 CA ALA A 33 214.155 247.376 210.574 1.00 0.00 C +ATOM 34 CA ARG A 34 213.039 244.149 212.265 1.00 0.00 C +ATOM 35 CA ARG A 35 215.962 241.981 213.394 1.00 0.00 C +ATOM 36 CA ARG A 36 217.886 239.457 211.288 1.00 0.00 C +ATOM 37 CA TRP A 37 220.981 238.085 213.036 1.00 0.00 C +ATOM 38 CA ASP A 38 223.174 238.387 216.137 1.00 0.00 C +ATOM 39 CA ALA A 39 223.302 239.008 219.894 1.00 0.00 C +ATOM 40 CA ARG A 40 219.690 239.518 220.996 1.00 0.00 C +ATOM 41 CA ALA A 41 219.324 240.247 224.717 1.00 0.00 C +ATOM 42 CA GLU A 42 222.688 241.394 226.092 1.00 0.00 C +ATOM 43 CA GLY A 43 223.882 244.816 224.919 1.00 0.00 C +ATOM 44 CA ARG A 44 224.296 248.240 226.538 1.00 0.00 C +ATOM 45 CA ASP A 45 223.344 251.811 227.468 1.00 0.00 C +ATOM 46 CA GLY A 46 222.506 255.484 226.903 1.00 0.00 C +ATOM 47 CA ASP A 47 224.733 257.503 229.243 1.00 0.00 C +ATOM 48 CA GLY A 48 227.406 259.285 227.193 1.00 0.00 C +ATOM 49 CA VAL A 49 229.277 260.521 224.114 1.00 0.00 C +ATOM 50 CA SER A 50 232.942 260.818 225.112 1.00 0.00 C +ATOM 51 CA ALA A 51 236.050 258.848 224.122 1.00 0.00 C +ATOM 52 CA ALA A 52 239.818 258.289 224.142 1.00 0.00 C +ATOM 53 CA ALA A 53 241.094 256.474 227.240 1.00 0.00 C +ATOM 54 CA ALA A 54 242.314 252.991 228.187 1.00 0.00 C +ATOM 55 CA VAL A 55 243.675 249.667 229.457 1.00 0.00 C +ATOM 56 CA ALA A 56 241.110 246.855 229.641 1.00 0.00 C +ATOM 57 CA THR A 57 240.339 243.206 230.422 1.00 0.00 C +ATOM 58 CA ALA A 58 239.806 239.636 229.202 1.00 0.00 C +ATOM 59 CA ARG A 59 241.705 236.411 229.910 1.00 0.00 C +ATOM 60 CA GLY A 60 244.132 237.001 232.788 1.00 0.00 C +ATOM 61 CA ASP A 61 245.972 235.033 235.482 1.00 0.00 C +ATOM 62 CA ALA A 62 247.465 237.493 237.979 1.00 0.00 C +ATOM 63 CA THR A 63 250.675 237.249 240.016 1.00 0.00 C +ATOM 64 CA ALA A 64 252.163 234.601 242.316 1.00 0.00 C +ATOM 65 CA ARG A 65 255.909 234.695 241.628 1.00 0.00 C +ATOM 66 CA GLN A 66 257.866 236.691 239.039 1.00 0.00 C +ATOM 67 CA VAL A 67 261.055 238.719 238.550 1.00 0.00 C +ATOM 68 CA GLN A 68 263.749 238.874 235.860 1.00 0.00 C +ATOM 69 CA GLY A 69 264.843 242.502 235.462 1.00 0.00 C +ATOM 70 CA ALA A 70 262.784 245.441 234.181 1.00 0.00 C +ATOM 71 CA ARG A 71 259.200 244.951 232.984 1.00 0.00 C +ATOM 72 CA ARG A 72 255.654 245.441 234.288 1.00 0.00 C +ATOM 73 CA LYS A 73 255.609 244.130 237.865 1.00 0.00 C +ATOM 74 CA ALA A 74 258.303 244.457 240.540 1.00 0.00 C +ATOM 75 CA ALA A 75 261.517 245.486 242.308 1.00 0.00 C +ATOM 76 CA ARG A 76 260.941 248.314 244.796 1.00 0.00 C +ATOM 77 CA ARG A 77 263.310 248.109 247.772 1.00 0.00 C +ATOM 78 CA VAL A 78 262.648 247.103 251.387 1.00 0.00 C +ATOM 79 CA ALA A 79 262.799 243.417 252.339 1.00 0.00 C +ATOM 80 CA ARG A 80 263.688 240.190 250.519 1.00 0.00 C +ATOM 81 CA GLY A 81 265.624 236.919 250.257 1.00 0.00 C +ATOM 82 CA ASP A 82 266.916 233.759 248.566 1.00 0.00 C +ATOM 83 CA ALA A 83 269.655 231.197 247.893 1.00 0.00 C +ATOM 84 CA THR A 84 271.010 227.937 249.327 1.00 0.00 C +ATOM 85 CA ALA A 85 270.281 224.954 251.583 1.00 0.00 C +ATOM 86 CA ALA A 86 270.663 222.606 254.558 1.00 0.00 C +ATOM 87 CA ARG A 87 271.493 224.671 257.650 1.00 0.00 C +ATOM 88 CA ARG A 88 275.126 224.334 258.749 1.00 0.00 C +ATOM 89 CA GLY A 89 276.470 227.080 261.022 1.00 0.00 C +ATOM 90 CA SER A 90 279.289 226.295 263.461 1.00 0.00 C +ATOM 91 CA GLY A 91 279.253 226.355 267.270 1.00 0.00 C +ATOM 92 CA ASP A 92 281.136 228.655 269.653 1.00 0.00 C +ATOM 93 CA GLY A 93 284.276 230.605 270.580 1.00 0.00 C +ATOM 94 CA MET A 94 284.335 232.619 273.813 1.00 0.00 C +ATOM 95 CA ALA A 95 280.751 233.205 274.967 1.00 0.00 C +ATOM 96 CA THR A 96 278.838 234.502 271.938 1.00 0.00 C +ATOM 97 CA ALA A 97 280.489 237.722 270.746 1.00 0.00 C +ATOM 98 CA THR A 98 280.508 241.524 270.995 1.00 0.00 C +ATOM 99 CA GLY A 99 277.092 243.211 270.995 1.00 0.00 C +ATOM 100 CA SER A 100 275.933 245.085 267.887 1.00 0.00 C +ATOM 101 CA ASP A 101 275.199 245.974 264.255 1.00 0.00 C +ATOM 102 CA GLY A 102 276.742 249.403 263.644 1.00 0.00 C +ATOM 103 CA ASP A 103 276.560 250.444 259.984 1.00 0.00 C +ATOM 104 CA GLY A 104 273.308 251.739 258.479 1.00 0.00 C +ATOM 105 CA GLY A 105 270.697 252.641 255.855 1.00 0.00 C +ATOM 106 CA ALA A 106 269.347 252.318 252.307 1.00 0.00 C +ATOM 107 CA ALA A 107 268.172 252.236 248.683 1.00 0.00 C +ATOM 108 CA ALA A 108 266.944 252.987 245.156 1.00 0.00 C +ATOM 109 CA GLY A 109 263.467 254.493 245.559 1.00 0.00 C +ATOM 110 CA ASP A 110 260.651 253.649 247.983 1.00 0.00 C +ATOM 111 CA ASP A 111 258.802 254.912 251.065 1.00 0.00 C +ATOM 112 CA GLY A 112 258.453 251.908 253.381 1.00 0.00 C +ATOM 113 CA ASP A 113 258.985 250.093 256.689 1.00 0.00 C +ATOM 114 CA GLY A 114 261.764 249.985 259.294 1.00 0.00 C +ATOM 115 CA ALA A 115 263.326 250.690 262.696 1.00 0.00 C +ATOM 116 CA ARG A 116 265.393 253.885 262.892 1.00 0.00 C +ATOM 117 CA ARG A 117 262.955 256.784 263.306 1.00 0.00 C +ATOM 118 CA LEU A 118 261.614 259.405 265.724 1.00 0.00 C +ATOM 119 CA GLY A 119 262.418 262.964 266.821 1.00 0.00 C +ATOM 120 CA THR A 120 261.913 265.120 269.921 1.00 0.00 C +ATOM 121 CA ARG A 121 258.619 265.631 271.767 1.00 0.00 C +ATOM 122 CA ASP A 122 258.148 269.144 273.164 1.00 0.00 C +ATOM 123 CA GLY A 123 256.896 270.056 276.645 1.00 0.00 C +ATOM 124 CA GLN A 124 258.223 272.253 279.461 1.00 0.00 C +ATOM 125 CA ALA A 125 255.980 274.725 281.298 1.00 0.00 C +ATOM 126 CA ARG A 126 253.441 277.494 281.932 1.00 0.00 C +ATOM 127 CA ARG A 127 254.086 280.828 283.659 1.00 0.00 C +ATOM 128 CA ALA A 128 257.482 282.548 283.815 1.00 0.00 C +ATOM 129 CA VAL A 129 259.707 285.641 283.842 1.00 0.00 C +ATOM 130 CA ALA A 130 260.181 289.290 284.828 1.00 0.00 C +ATOM 131 CA ARG A 131 258.199 289.763 288.048 1.00 0.00 C +ATOM 132 CA GLY A 132 256.348 287.520 290.510 1.00 0.00 C +ATOM 133 CA GLU A 133 254.561 284.452 289.128 1.00 0.00 C +ATOM 134 CA GLY A 134 253.471 282.266 292.052 1.00 0.00 C +ATOM 135 CA GLY A 135 251.133 283.436 294.824 1.00 0.00 C +ATOM 136 CA ASP A 136 250.722 280.839 297.582 1.00 0.00 C +ATOM 137 CA ARG A 137 253.030 279.769 300.418 1.00 0.00 C +ATOM 138 CA GLU A 138 250.760 278.177 303.032 1.00 0.00 C +ATOM 139 CA ARG A 139 247.605 278.654 305.113 1.00 0.00 C +ATOM 140 CA GLY A 140 247.282 281.990 306.926 1.00 0.00 C +ATOM 141 CA LYS A 141 245.948 285.144 308.597 1.00 0.00 C +ATOM 142 CA GLU A 142 244.578 287.942 306.403 1.00 0.00 C +ATOM 143 CA GLU A 143 245.304 291.416 307.789 1.00 0.00 C +ATOM 144 CA GLY A 144 248.688 292.043 309.424 1.00 0.00 C +ATOM 145 CA LEU A 145 249.897 295.536 308.502 1.00 0.00 C +ATOM 146 CA GLY A 146 251.193 297.568 311.453 1.00 0.00 C +TER 147 GLY A 146 +END diff --git a/Plants/Q8H7Z8/Q8H7Z8.dcd b/Plants/Q8H7Z8/Q8H7Z8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..2573ce67b9b412534b61911b756236b0f7490849 --- /dev/null +++ b/Plants/Q8H7Z8/Q8H7Z8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:94b2f0af4b98a38ad7b70a5f6cba98a4881a495026531d5b624abbc07f436940 +size 9440276 diff --git a/Plants/Q8H7Z8/top.pdb b/Plants/Q8H7Z8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..fbe298a63c3b05c5b55bef122e132a5daceae2b9 --- /dev/null +++ b/Plants/Q8H7Z8/top.pdb @@ -0,0 +1,76 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 281.262 280.071 258.630 1.00 0.00 C +ATOM 2 CA VAL A 2 280.161 283.466 257.295 1.00 0.00 C +ATOM 3 CA THR A 3 277.789 285.477 259.496 1.00 0.00 C +ATOM 4 CA PRO A 4 275.078 283.355 261.127 1.00 0.00 C +ATOM 5 CA GLY A 5 271.672 281.651 261.238 1.00 0.00 C +ATOM 6 CA MET A 6 270.803 278.566 263.299 1.00 0.00 C +ATOM 7 CA GLU A 7 269.369 275.115 264.039 1.00 0.00 C +ATOM 8 CA VAL A 8 266.203 273.125 263.309 1.00 0.00 C +ATOM 9 CA ALA A 9 263.254 273.781 260.988 1.00 0.00 C +ATOM 10 CA ALA A 10 259.513 273.961 261.687 1.00 0.00 C +ATOM 11 CA PRO A 11 259.274 274.948 265.359 1.00 0.00 C +ATOM 12 CA VAL A 12 257.904 274.730 268.907 1.00 0.00 C +ATOM 13 CA THR A 13 254.198 273.964 269.347 1.00 0.00 C +ATOM 14 CA ASN A 14 251.798 274.766 266.499 1.00 0.00 C +ATOM 15 CA ALA A 15 253.683 274.649 263.191 1.00 0.00 C +ATOM 16 CA GLY A 16 253.192 271.151 261.765 1.00 0.00 C +ATOM 17 CA GLY A 17 254.074 269.799 258.313 1.00 0.00 C +ATOM 18 CA SER A 18 257.387 268.536 256.919 1.00 0.00 C +ATOM 19 CA THR A 19 260.958 267.622 255.957 1.00 0.00 C +ATOM 20 CA MET A 20 263.232 264.586 255.600 1.00 0.00 C +ATOM 21 CA GLY A 21 264.509 261.516 253.739 1.00 0.00 C +ATOM 22 CA PRO A 22 264.257 257.720 253.536 1.00 0.00 C +ATOM 23 CA GLN A 23 264.566 256.119 256.979 1.00 0.00 C +ATOM 24 CA TYR A 24 265.492 258.811 259.511 1.00 0.00 C +ATOM 25 CA LYS A 25 264.759 257.206 262.888 1.00 0.00 C +ATOM 26 CA HIS A 26 266.563 254.912 265.337 1.00 0.00 C +ATOM 27 CA GLY A 27 269.351 252.507 266.318 1.00 0.00 C +ATOM 28 CA GLU A 28 270.996 249.163 267.108 1.00 0.00 C +ATOM 29 CA GLU A 29 271.684 245.558 266.083 1.00 0.00 C +ATOM 30 CA GLY A 30 274.905 244.934 264.147 1.00 0.00 C +ATOM 31 CA LYS A 31 275.455 247.073 261.042 1.00 0.00 C +ATOM 32 CA ASN A 32 273.107 249.716 259.623 1.00 0.00 C +ATOM 33 CA LYS A 33 275.179 252.341 257.797 1.00 0.00 C +ATOM 34 CA GLU A 34 275.854 256.066 257.364 1.00 0.00 C +ATOM 35 CA MET A 35 275.061 258.129 254.261 1.00 0.00 C +ATOM 36 CA ALA A 36 272.054 256.416 252.666 1.00 0.00 C +ATOM 37 CA SER A 37 269.804 254.160 254.754 1.00 0.00 C +ATOM 38 CA PRO A 38 267.674 251.830 252.620 1.00 0.00 C +ATOM 39 CA ALA A 39 265.163 249.200 251.484 1.00 0.00 C +ATOM 40 CA LEU A 40 262.110 249.323 249.208 1.00 0.00 C +ATOM 41 CA GLU A 41 258.879 247.957 247.720 1.00 0.00 C +ATOM 42 CA GLU A 42 256.081 250.530 247.980 1.00 0.00 C +ATOM 43 CA SER A 43 252.886 249.107 246.469 1.00 0.00 C +ATOM 44 CA GLY A 44 250.756 245.968 246.110 1.00 0.00 C +ATOM 45 CA GLY A 45 249.311 243.021 248.044 1.00 0.00 C +ATOM 46 CA ALA A 46 247.986 239.486 247.526 1.00 0.00 C +ATOM 47 CA ARG A 47 244.220 238.950 247.312 1.00 0.00 C +ATOM 48 CA ARG A 48 242.190 237.561 244.403 1.00 0.00 C +ATOM 49 CA ARG A 49 243.214 233.895 244.239 1.00 0.00 C +ATOM 50 CA ARG A 50 241.325 231.220 246.187 1.00 0.00 C +ATOM 51 CA PRO A 51 238.604 230.502 248.755 1.00 0.00 C +ATOM 52 CA VAL A 52 235.341 232.123 247.640 1.00 0.00 C +ATOM 53 CA ALA A 53 232.460 233.878 249.410 1.00 0.00 C +ATOM 54 CA CYS A 54 230.803 236.246 246.927 1.00 0.00 C +ATOM 55 CA SER A 55 229.720 235.300 243.399 1.00 0.00 C +ATOM 56 CA ASP A 56 230.665 232.792 240.691 1.00 0.00 C +ATOM 57 CA ARG A 57 228.130 232.890 237.849 1.00 0.00 C +ATOM 58 CA SER A 58 225.507 230.741 236.111 1.00 0.00 C +ATOM 59 CA ALA A 59 225.724 227.114 234.965 1.00 0.00 C +ATOM 60 CA ASP A 60 224.185 224.406 232.771 1.00 0.00 C +ATOM 61 CA ASP A 61 220.680 223.304 231.763 1.00 0.00 C +ATOM 62 CA HIS A 62 217.798 221.554 233.536 1.00 0.00 C +ATOM 63 CA GLY A 63 214.155 222.160 234.474 1.00 0.00 C +ATOM 64 CA ASN A 64 210.974 221.044 232.699 1.00 0.00 C +ATOM 65 CA LEU A 65 210.069 220.234 229.088 1.00 0.00 C +ATOM 66 CA CYS A 66 212.966 219.837 226.646 1.00 0.00 C +ATOM 67 CA ASP A 67 213.749 222.366 223.906 1.00 0.00 C +ATOM 68 CA ASN A 68 211.249 224.984 222.720 1.00 0.00 C +ATOM 69 CA VAL A 69 211.338 227.853 220.214 1.00 0.00 C +ATOM 70 CA TYR A 70 208.968 230.283 218.484 1.00 0.00 C +ATOM 71 CA THR A 71 206.416 232.801 219.776 1.00 0.00 C +ATOM 72 CA ILE A 72 204.301 233.874 222.757 1.00 0.00 C +TER 73 ILE A 72 +END diff --git a/Plants/Q8H7Z9/Q8H7Z9.dcd b/Plants/Q8H7Z9/Q8H7Z9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..b8287515f2b1f7e5cec5224fdc431f1279c2995b --- /dev/null +++ b/Plants/Q8H7Z9/Q8H7Z9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:233a09b7441fe489ded5545937e79ed04a7412fb4567cc27bae5cc57800c4cf2 +size 39180276 diff --git a/Plants/Q8H7Z9/top.pdb b/Plants/Q8H7Z9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..bdd4befd9dd6d04a2f563c3dc302e63aa5616b6c --- /dev/null +++ b/Plants/Q8H7Z9/top.pdb @@ -0,0 +1,215 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 331.602 224.795 267.610 1.00 0.00 C +ATOM 2 CA ALA A 2 328.823 225.578 265.124 1.00 0.00 C +ATOM 3 CA ASN A 3 326.263 226.068 262.345 1.00 0.00 C +ATOM 4 CA ALA A 4 324.367 224.182 259.632 1.00 0.00 C +ATOM 5 CA ALA A 5 322.527 224.907 256.375 1.00 0.00 C +ATOM 6 CA ALA A 6 319.614 227.252 255.649 1.00 0.00 C +ATOM 7 CA SER A 7 318.452 230.559 257.144 1.00 0.00 C +ATOM 8 CA MET A 8 315.425 231.884 255.248 1.00 0.00 C +ATOM 9 CA VAL A 9 315.183 235.678 254.992 1.00 0.00 C +ATOM 10 CA ARG A 10 314.478 237.477 251.709 1.00 0.00 C +ATOM 11 CA LEU A 11 313.442 241.036 252.591 1.00 0.00 C +ATOM 12 CA GLY A 12 314.393 244.550 251.468 1.00 0.00 C +ATOM 13 CA ALA A 13 315.287 245.527 247.896 1.00 0.00 C +ATOM 14 CA VAL A 14 316.102 244.106 244.456 1.00 0.00 C +ATOM 15 CA ALA A 15 318.555 241.809 242.660 1.00 0.00 C +ATOM 16 CA SER A 16 318.994 242.010 238.881 1.00 0.00 C +ATOM 17 CA GLY A 17 316.647 239.577 237.123 1.00 0.00 C +ATOM 18 CA SER A 18 316.917 238.672 233.432 1.00 0.00 C +ATOM 19 CA ARG A 19 316.059 241.127 230.647 1.00 0.00 C +ATOM 20 CA SER A 20 313.364 241.735 228.023 1.00 0.00 C +ATOM 21 CA THR A 21 312.934 245.512 227.763 1.00 0.00 C +ATOM 22 CA ALA A 22 310.701 247.585 225.476 1.00 0.00 C +ATOM 23 CA GLY A 23 311.296 246.865 221.783 1.00 0.00 C +ATOM 24 CA GLY A 24 314.648 245.329 220.822 1.00 0.00 C +ATOM 25 CA ARG A 25 317.689 247.147 222.223 1.00 0.00 C +ATOM 26 CA ARG A 26 317.770 250.915 222.783 1.00 0.00 C +ATOM 27 CA ARG A 27 315.017 252.655 224.760 1.00 0.00 C +ATOM 28 CA TRP A 28 316.250 253.363 228.295 1.00 0.00 C +ATOM 29 CA GLY A 29 317.088 252.378 231.879 1.00 0.00 C +ATOM 30 CA ALA A 30 319.249 249.393 232.845 1.00 0.00 C +ATOM 31 CA PRO A 31 317.236 246.691 234.624 1.00 0.00 C +ATOM 32 CA ASP A 32 313.436 246.937 234.501 1.00 0.00 C +ATOM 33 CA PHE A 33 311.724 246.262 237.837 1.00 0.00 C +ATOM 34 CA ALA A 34 309.109 244.087 239.554 1.00 0.00 C +ATOM 35 CA GLY A 35 306.612 241.501 240.817 1.00 0.00 C +ATOM 36 CA ASP A 36 307.511 239.613 244.002 1.00 0.00 C +ATOM 37 CA VAL A 37 305.846 236.312 244.921 1.00 0.00 C +ATOM 38 CA GLY A 38 302.779 235.506 242.808 1.00 0.00 C +ATOM 39 CA GLU A 39 300.601 238.266 241.339 1.00 0.00 C +ATOM 40 CA TRP A 40 297.480 240.302 242.129 1.00 0.00 C +ATOM 41 CA GLY A 41 294.181 240.335 240.224 1.00 0.00 C +ATOM 42 CA GLU A 42 291.538 242.743 241.539 1.00 0.00 C +ATOM 43 CA ARG A 43 289.187 245.081 239.661 1.00 0.00 C +ATOM 44 CA VAL A 44 285.629 243.764 239.308 1.00 0.00 C +ATOM 45 CA GLY A 45 282.605 244.674 237.177 1.00 0.00 C +ATOM 46 CA GLY A 46 280.460 241.906 235.675 1.00 0.00 C +ATOM 47 CA ASP A 47 276.999 241.652 237.247 1.00 0.00 C +ATOM 48 CA SER A 48 273.424 242.044 235.989 1.00 0.00 C +ATOM 49 CA LYS A 49 271.531 238.984 234.737 1.00 0.00 C +ATOM 50 CA PHE A 50 271.580 235.987 232.385 1.00 0.00 C +ATOM 51 CA LYS A 51 272.815 232.633 231.064 1.00 0.00 C +ATOM 52 CA SER A 52 272.699 228.834 230.803 1.00 0.00 C +ATOM 53 CA ALA A 53 270.929 225.679 229.608 1.00 0.00 C +ATOM 54 CA PRO A 54 267.748 225.216 231.654 1.00 0.00 C +ATOM 55 CA CYS A 55 266.248 223.825 234.868 1.00 0.00 C +ATOM 56 CA GLY A 56 263.267 224.239 237.205 1.00 0.00 C +ATOM 57 CA HIS A 57 261.337 226.803 239.257 1.00 0.00 C +ATOM 58 CA ALA A 58 258.838 229.549 240.111 1.00 0.00 C +ATOM 59 CA ALA A 59 258.314 232.486 242.481 1.00 0.00 C +ATOM 60 CA TRP A 60 260.340 232.853 245.687 1.00 0.00 C +ATOM 61 CA ALA A 61 262.042 236.256 245.900 1.00 0.00 C +ATOM 62 CA GLY A 62 261.035 239.707 247.159 1.00 0.00 C +ATOM 63 CA ARG A 63 263.532 242.516 246.532 1.00 0.00 C +ATOM 64 CA ARG A 64 266.088 242.928 249.327 1.00 0.00 C +ATOM 65 CA GLY A 65 264.917 245.948 251.333 1.00 0.00 C +ATOM 66 CA ARG A 66 264.404 248.594 254.025 1.00 0.00 C +ATOM 67 CA ARG A 67 266.046 250.263 257.032 1.00 0.00 C +ATOM 68 CA ARG A 68 264.409 252.499 259.646 1.00 0.00 C +ATOM 69 CA ASP A 69 261.005 252.600 261.353 1.00 0.00 C +ATOM 70 CA ASP A 70 258.494 251.847 264.118 1.00 0.00 C +ATOM 71 CA VAL A 71 260.142 252.911 267.385 1.00 0.00 C +ATOM 72 CA GLY A 72 261.975 255.086 269.919 1.00 0.00 C +ATOM 73 CA THR A 73 259.566 256.097 272.691 1.00 0.00 C +ATOM 74 CA GLY A 74 258.208 256.754 276.190 1.00 0.00 C +ATOM 75 CA LYS A 75 256.274 259.785 277.451 1.00 0.00 C +ATOM 76 CA ALA A 76 252.613 258.865 276.938 1.00 0.00 C +ATOM 77 CA ASP A 77 250.010 259.178 279.703 1.00 0.00 C +ATOM 78 CA GLY A 78 246.796 260.843 280.891 1.00 0.00 C +ATOM 79 CA GLY A 79 244.621 262.446 278.204 1.00 0.00 C +ATOM 80 CA VAL A 80 245.080 266.189 277.664 1.00 0.00 C +ATOM 81 CA GLY A 81 247.888 268.240 276.107 1.00 0.00 C +ATOM 82 CA ALA A 82 249.166 271.382 274.371 1.00 0.00 C +ATOM 83 CA GLY A 83 249.300 274.460 276.613 1.00 0.00 C +ATOM 84 CA CYS A 84 246.474 276.718 275.415 1.00 0.00 C +ATOM 85 CA GLY A 85 246.358 280.516 275.689 1.00 0.00 C +ATOM 86 CA VAL A 86 247.783 281.958 278.915 1.00 0.00 C +ATOM 87 CA GLU A 87 250.064 284.938 278.262 1.00 0.00 C +ATOM 88 CA GLU A 88 249.981 287.049 281.433 1.00 0.00 C +ATOM 89 CA VAL A 89 248.921 289.002 284.528 1.00 0.00 C +ATOM 90 CA ARG A 90 247.853 292.632 284.089 1.00 0.00 C +ATOM 91 CA ARG A 91 249.432 294.460 281.142 1.00 0.00 C +ATOM 92 CA GLN A 92 248.434 293.496 277.594 1.00 0.00 C +ATOM 93 CA TRP A 93 247.698 294.417 273.971 1.00 0.00 C +ATOM 94 CA ARG A 94 248.929 292.217 271.114 1.00 0.00 C +ATOM 95 CA GLY A 95 252.072 293.473 269.364 1.00 0.00 C +ATOM 96 CA GLN A 96 254.672 295.974 270.589 1.00 0.00 C +ATOM 97 CA LEU A 97 257.794 296.041 268.407 1.00 0.00 C +ATOM 98 CA GLU A 98 259.826 297.006 265.332 1.00 0.00 C +ATOM 99 CA LEU A 99 260.629 294.546 262.536 1.00 0.00 C +ATOM 100 CA ARG A 100 263.094 296.031 260.039 1.00 0.00 C +ATOM 101 CA LEU A 101 263.487 299.811 259.760 1.00 0.00 C +ATOM 102 CA GLN A 102 265.923 301.589 262.089 1.00 0.00 C +ATOM 103 CA ARG A 103 269.344 301.445 260.418 1.00 0.00 C +ATOM 104 CA PRO A 104 272.576 299.501 259.879 1.00 0.00 C +ATOM 105 CA GLU A 105 275.256 299.277 257.180 1.00 0.00 C +ATOM 106 CA GLU A 106 274.751 298.149 253.576 1.00 0.00 C +ATOM 107 CA GLU A 107 272.476 295.266 252.563 1.00 0.00 C +ATOM 108 CA GLU A 108 270.083 293.696 250.048 1.00 0.00 C +ATOM 109 CA GLY A 109 267.416 292.738 247.502 1.00 0.00 C +ATOM 110 CA ALA A 110 264.640 290.244 248.271 1.00 0.00 C +ATOM 111 CA ASP A 111 264.914 288.261 251.512 1.00 0.00 C +ATOM 112 CA ARG A 112 264.881 287.655 255.274 1.00 0.00 C +ATOM 113 CA SER A 113 264.362 284.983 257.939 1.00 0.00 C +ATOM 114 CA PRO A 114 262.477 281.776 257.116 1.00 0.00 C +ATOM 115 CA GLN A 115 263.121 278.109 257.927 1.00 0.00 C +ATOM 116 CA ASN A 116 265.778 275.699 256.642 1.00 0.00 C +ATOM 117 CA LYS A 117 265.973 272.845 254.125 1.00 0.00 C +ATOM 118 CA ASN A 118 265.785 269.044 253.952 1.00 0.00 C +ATOM 119 CA PHE A 119 267.410 266.359 256.112 1.00 0.00 C +ATOM 120 CA ASP A 120 269.798 263.494 255.331 1.00 0.00 C +ATOM 121 CA ASP A 121 267.605 260.422 254.811 1.00 0.00 C +ATOM 122 CA ASP A 122 265.895 257.294 253.466 1.00 0.00 C +ATOM 123 CA PRO A 123 266.526 254.299 251.198 1.00 0.00 C +ATOM 124 CA LEU A 124 265.626 253.645 247.554 1.00 0.00 C +ATOM 125 CA ALA A 125 263.231 253.414 244.600 1.00 0.00 C +ATOM 126 CA GLU A 126 261.671 250.908 242.190 1.00 0.00 C +ATOM 127 CA GLU A 127 260.175 247.429 241.779 1.00 0.00 C +ATOM 128 CA TYR A 128 256.475 247.036 242.597 1.00 0.00 C +ATOM 129 CA SER A 129 254.023 245.473 245.059 1.00 0.00 C +ATOM 130 CA ARG A 130 250.750 244.371 243.449 1.00 0.00 C +ATOM 131 CA ASN A 131 247.728 246.046 245.054 1.00 0.00 C +ATOM 132 CA ASP A 132 244.252 247.337 244.176 1.00 0.00 C +ATOM 133 CA ASP A 133 242.589 249.125 241.251 1.00 0.00 C +ATOM 134 CA LYS A 134 244.332 250.227 238.047 1.00 0.00 C +ATOM 135 CA SER A 135 243.521 250.328 234.326 1.00 0.00 C +ATOM 136 CA SER A 136 242.164 253.504 232.718 1.00 0.00 C +ATOM 137 CA ASN A 137 238.616 254.562 233.620 1.00 0.00 C +ATOM 138 CA LYS A 138 237.690 255.743 237.122 1.00 0.00 C +ATOM 139 CA ALA A 139 234.036 255.705 238.200 1.00 0.00 C +ATOM 140 CA ASN A 140 230.287 255.042 238.335 1.00 0.00 C +ATOM 141 CA ASP A 141 227.453 254.920 240.880 1.00 0.00 C +ATOM 142 CA ASN A 142 227.082 255.098 244.667 1.00 0.00 C +ATOM 143 CA ASP A 143 227.158 253.884 248.278 1.00 0.00 C +ATOM 144 CA GLY A 144 228.026 255.934 251.370 1.00 0.00 C +ATOM 145 CA GLY A 145 227.103 259.571 250.708 1.00 0.00 C +ATOM 146 CA HIS A 146 223.857 260.223 252.592 1.00 0.00 C +ATOM 147 CA ARG A 147 220.859 258.829 254.486 1.00 0.00 C +ATOM 148 CA SER A 148 220.385 255.056 254.241 1.00 0.00 C +ATOM 149 CA PRO A 149 219.019 252.397 256.602 1.00 0.00 C +ATOM 150 CA GLU A 150 219.644 248.704 255.903 1.00 0.00 C +ATOM 151 CA ASP A 151 221.442 247.542 252.751 1.00 0.00 C +ATOM 152 CA HIS A 152 223.127 248.547 249.486 1.00 0.00 C +ATOM 153 CA VAL A 153 223.357 249.604 245.832 1.00 0.00 C +ATOM 154 CA LYS A 154 220.118 248.368 244.250 1.00 0.00 C +ATOM 155 CA ALA A 155 218.984 251.099 241.848 1.00 0.00 C +ATOM 156 CA ARG A 156 217.880 250.076 238.348 1.00 0.00 C +ATOM 157 CA GLU A 157 215.141 248.880 235.986 1.00 0.00 C +ATOM 158 CA VAL A 158 212.619 246.480 234.437 1.00 0.00 C +ATOM 159 CA SER A 159 209.067 246.576 235.811 1.00 0.00 C +ATOM 160 CA ALA A 160 207.168 249.188 233.789 1.00 0.00 C +ATOM 161 CA TYR A 161 203.788 250.884 233.322 1.00 0.00 C +ATOM 162 CA VAL A 162 201.418 248.999 235.634 1.00 0.00 C +ATOM 163 CA THR A 163 201.466 248.926 239.443 1.00 0.00 C +ATOM 164 CA VAL A 164 202.009 246.787 242.549 1.00 0.00 C +ATOM 165 CA ALA A 165 201.197 243.296 243.840 1.00 0.00 C +ATOM 166 CA THR A 166 202.390 241.195 246.787 1.00 0.00 C +ATOM 167 CA LEU A 167 204.166 237.824 246.801 1.00 0.00 C +ATOM 168 CA GLU A 168 206.700 237.424 243.985 1.00 0.00 C +ATOM 169 CA ALA A 169 207.366 234.354 241.829 1.00 0.00 C +ATOM 170 CA LYS A 170 208.648 231.779 239.331 1.00 0.00 C +ATOM 171 CA PRO A 171 209.895 228.595 241.013 1.00 0.00 C +ATOM 172 CA SER A 172 207.503 227.367 243.712 1.00 0.00 C +ATOM 173 CA SER A 173 205.757 229.299 246.494 1.00 0.00 C +ATOM 174 CA SER A 174 204.336 231.966 248.815 1.00 0.00 C +ATOM 175 CA TRP A 175 201.663 231.100 251.388 1.00 0.00 C +ATOM 176 CA GLU A 176 198.146 231.624 252.756 1.00 0.00 C +ATOM 177 CA GLU A 177 198.165 233.447 256.102 1.00 0.00 C +ATOM 178 CA ALA A 178 201.443 234.890 257.400 1.00 0.00 C +ATOM 179 CA PRO A 179 203.340 231.883 258.769 1.00 0.00 C +ATOM 180 CA THR A 180 202.056 228.312 258.432 1.00 0.00 C +ATOM 181 CA LYS A 181 199.263 225.865 259.283 1.00 0.00 C +ATOM 182 CA SER A 182 197.156 223.668 256.992 1.00 0.00 C +ATOM 183 CA GLU A 183 195.345 221.188 259.248 1.00 0.00 C +ATOM 184 CA LEU A 184 192.683 218.582 260.046 1.00 0.00 C +ATOM 185 CA GLU A 185 189.472 216.614 260.622 1.00 0.00 C +ATOM 186 CA GLU A 186 185.808 216.900 261.627 1.00 0.00 C +ATOM 187 CA LYS A 187 183.024 219.178 262.883 1.00 0.00 C +ATOM 188 CA ALA A 188 180.606 222.055 263.510 1.00 0.00 C +ATOM 189 CA PRO A 189 178.354 224.979 264.454 1.00 0.00 C +ATOM 190 CA HIS A 190 175.430 226.888 262.929 1.00 0.00 C +ATOM 191 CA GLN A 191 173.133 225.268 260.358 1.00 0.00 C +ATOM 192 CA PRO A 192 172.305 226.832 256.984 1.00 0.00 C +ATOM 193 CA PRO A 193 174.958 227.094 254.262 1.00 0.00 C +ATOM 194 CA SER A 194 177.838 229.588 254.323 1.00 0.00 C +ATOM 195 CA SER A 195 181.334 228.448 253.324 1.00 0.00 C +ATOM 196 CA THR A 196 183.709 230.536 251.198 1.00 0.00 C +ATOM 197 CA PRO A 197 187.386 231.264 250.520 1.00 0.00 C +ATOM 198 CA GLU A 198 188.582 233.789 247.930 1.00 0.00 C +ATOM 199 CA GLN A 199 187.424 236.877 246.022 1.00 0.00 C +ATOM 200 CA GLY A 200 186.187 240.423 246.663 1.00 0.00 C +ATOM 201 CA GLN A 201 182.385 240.186 246.606 1.00 0.00 C +ATOM 202 CA PRO A 202 179.701 237.960 245.069 1.00 0.00 C +ATOM 203 CA THR A 203 179.421 238.813 241.366 1.00 0.00 C +ATOM 204 CA GLU A 204 176.016 238.122 239.802 1.00 0.00 C +ATOM 205 CA PRO A 205 173.173 236.346 237.991 1.00 0.00 C +ATOM 206 CA ARG A 206 171.885 233.660 235.615 1.00 0.00 C +ATOM 207 CA LEU A 207 172.220 229.933 234.897 1.00 0.00 C +ATOM 208 CA VAL A 208 173.515 227.910 237.855 1.00 0.00 C +ATOM 209 CA PHE A 209 176.490 227.750 240.228 1.00 0.00 C +ATOM 210 CA ASP A 210 179.040 224.945 239.843 1.00 0.00 C +ATOM 211 CA LYS A 211 182.810 225.261 240.290 1.00 0.00 C +TER 212 LYS A 211 +END diff --git a/Plants/Q8H800/Q8H800.dcd b/Plants/Q8H800/Q8H800.dcd new file mode 100644 index 0000000000000000000000000000000000000000..b17202f2abaa27b53d0930dbf905d621e46089d5 --- /dev/null +++ b/Plants/Q8H800/Q8H800.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2afc67b54b039a65c4017e2a0c7b940429682827b86e14bb866249b8ccb083a6 +size 6320276 diff --git a/Plants/Q8H800/top.pdb b/Plants/Q8H800/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..f6431d4dab28bfe74fd662db63bf60bcd6165af0 --- /dev/null +++ b/Plants/Q8H800/top.pdb @@ -0,0 +1,50 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 232.689 247.039 252.867 1.00 0.00 C +ATOM 2 CA ALA A 2 234.774 243.912 252.237 1.00 0.00 C +ATOM 3 CA GLU A 3 236.845 243.474 249.070 1.00 0.00 C +ATOM 4 CA VAL A 4 240.581 242.746 248.905 1.00 0.00 C +ATOM 5 CA LEU A 5 241.985 244.356 245.750 1.00 0.00 C +ATOM 6 CA ARG A 6 245.298 246.205 245.408 1.00 0.00 C +ATOM 7 CA GLU A 7 248.651 244.708 246.422 1.00 0.00 C +ATOM 8 CA ALA A 8 252.130 243.314 247.107 1.00 0.00 C +ATOM 9 CA GLY A 9 252.482 240.000 248.954 1.00 0.00 C +ATOM 10 CA SER A 10 249.733 238.841 251.324 1.00 0.00 C +ATOM 11 CA ALA A 11 250.463 237.848 254.930 1.00 0.00 C +ATOM 12 CA ALA A 12 247.664 235.727 256.407 1.00 0.00 C +ATOM 13 CA ARG A 13 246.173 233.036 254.159 1.00 0.00 C +ATOM 14 CA TRP A 14 243.522 234.855 252.116 1.00 0.00 C +ATOM 15 CA GLU A 15 240.951 234.882 249.304 1.00 0.00 C +ATOM 16 CA GLY A 16 240.604 235.326 245.536 1.00 0.00 C +ATOM 17 CA SER A 17 242.225 233.198 242.823 1.00 0.00 C +ATOM 18 CA SER A 18 241.785 232.065 239.212 1.00 0.00 C +ATOM 19 CA GLY A 19 241.482 234.335 236.167 1.00 0.00 C +ATOM 20 CA ILE A 20 238.354 235.795 234.554 1.00 0.00 C +ATOM 21 CA LEU A 21 237.640 239.429 233.661 1.00 0.00 C +ATOM 22 CA ASP A 22 239.647 240.833 230.744 1.00 0.00 C +ATOM 23 CA GLY A 23 242.943 242.714 231.085 1.00 0.00 C +ATOM 24 CA SER A 24 246.423 243.712 232.274 1.00 0.00 C +ATOM 25 CA ASP A 25 248.782 245.526 234.652 1.00 0.00 C +ATOM 26 CA GLU A 26 250.539 248.197 236.725 1.00 0.00 C +ATOM 27 CA THR A 27 249.837 248.759 240.427 1.00 0.00 C +ATOM 28 CA ASN A 28 251.591 250.320 243.428 1.00 0.00 C +ATOM 29 CA PHE A 29 254.033 252.458 245.423 1.00 0.00 C +ATOM 30 CA PHE A 30 255.910 251.405 248.567 1.00 0.00 C +ATOM 31 CA GLU A 31 259.712 251.166 248.547 1.00 0.00 C +ATOM 32 CA THR A 32 261.376 254.534 247.913 1.00 0.00 C +ATOM 33 CA SER A 33 260.949 258.219 247.044 1.00 0.00 C +ATOM 34 CA SER A 34 260.113 260.754 249.762 1.00 0.00 C +ATOM 35 CA THR A 35 261.422 262.763 252.723 1.00 0.00 C +ATOM 36 CA GLU A 36 261.604 266.556 253.037 1.00 0.00 C +ATOM 37 CA ARG A 37 264.420 268.764 254.345 1.00 0.00 C +ATOM 38 CA ASP A 38 264.428 270.594 257.687 1.00 0.00 C +ATOM 39 CA PHE A 39 265.106 270.644 261.436 1.00 0.00 C +ATOM 40 CA ASN A 40 262.907 268.309 263.491 1.00 0.00 C +ATOM 41 CA SER A 41 261.601 268.622 267.056 1.00 0.00 C +ATOM 42 CA GLY A 42 259.509 268.024 270.184 1.00 0.00 C +ATOM 43 CA VAL A 43 256.862 269.536 272.469 1.00 0.00 C +ATOM 44 CA GLY A 44 254.106 270.448 274.936 1.00 0.00 C +ATOM 45 CA LYS A 45 251.817 273.484 275.184 1.00 0.00 C +ATOM 46 CA ARG A 46 248.332 272.570 273.945 1.00 0.00 C +TER 47 ARG A 46 +END diff --git a/Plants/Q8H828/Q8H828.dcd b/Plants/Q8H828/Q8H828.dcd new file mode 100644 index 0000000000000000000000000000000000000000..c0bde59d476d3608285aca72ee6f7d733c059f27 --- /dev/null +++ b/Plants/Q8H828/Q8H828.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f7bff1f54d75a68a38ff35a2b8dbcea7e447934ac69cb2529f3a2348519a7c4a +size 53220276 diff --git a/Plants/Q8H828/top.pdb b/Plants/Q8H828/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..65d8e2a67e0be3c4ef97b7b6cd5ea8811cfc7809 --- /dev/null +++ b/Plants/Q8H828/top.pdb @@ -0,0 +1,293 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 246.051 287.595 260.252 1.00 0.00 C +ATOM 2 CA GLN A 2 246.901 283.906 259.823 1.00 0.00 C +ATOM 3 CA ALA A 3 247.576 282.744 256.258 1.00 0.00 C +ATOM 4 CA PRO A 4 249.750 279.645 255.825 1.00 0.00 C +ATOM 5 CA HIS A 5 250.762 277.052 258.426 1.00 0.00 C +ATOM 6 CA VAL A 6 248.822 273.773 258.499 1.00 0.00 C +ATOM 7 CA SER A 7 246.176 271.084 259.033 1.00 0.00 C +ATOM 8 CA GLY A 8 243.229 270.346 256.734 1.00 0.00 C +ATOM 9 CA CYS A 9 239.938 272.107 255.969 1.00 0.00 C +ATOM 10 CA GLY A 10 236.360 272.802 257.081 1.00 0.00 C +ATOM 11 CA ARG A 11 236.460 274.423 260.528 1.00 0.00 C +ATOM 12 CA TRP A 12 237.602 273.052 263.894 1.00 0.00 C +ATOM 13 CA SER A 13 239.079 270.396 266.192 1.00 0.00 C +ATOM 14 CA MET A 14 241.763 267.907 265.134 1.00 0.00 C +ATOM 15 CA VAL A 15 244.959 265.834 265.188 1.00 0.00 C +ATOM 16 CA ASP A 16 246.600 264.452 262.039 1.00 0.00 C +ATOM 17 CA ARG A 17 250.104 265.945 261.934 1.00 0.00 C +ATOM 18 CA VAL A 18 252.669 263.720 263.661 1.00 0.00 C +ATOM 19 CA HIS A 19 254.273 261.195 266.021 1.00 0.00 C +ATOM 20 CA GLY A 20 252.271 258.441 267.731 1.00 0.00 C +ATOM 21 CA PRO A 21 253.368 258.077 271.361 1.00 0.00 C +ATOM 22 CA GLY A 22 254.110 261.503 272.854 1.00 0.00 C +ATOM 23 CA LYS A 23 255.678 264.533 274.550 1.00 0.00 C +ATOM 24 CA ASP A 24 257.056 267.905 275.665 1.00 0.00 C +ATOM 25 CA GLY A 25 257.820 271.501 276.667 1.00 0.00 C +ATOM 26 CA ALA A 26 258.896 275.129 277.111 1.00 0.00 C +ATOM 27 CA PRO A 27 262.424 275.737 278.414 1.00 0.00 C +ATOM 28 CA ARG A 28 262.379 278.589 280.939 1.00 0.00 C +ATOM 29 CA GLY A 29 264.713 278.079 283.907 1.00 0.00 C +ATOM 30 CA ALA A 30 265.334 278.663 287.620 1.00 0.00 C +ATOM 31 CA ASP A 31 265.057 275.419 289.598 1.00 0.00 C +ATOM 32 CA VAL A 32 263.824 271.976 288.530 1.00 0.00 C +ATOM 33 CA ALA A 33 266.677 269.481 288.922 1.00 0.00 C +ATOM 34 CA PRO A 34 266.662 265.839 287.802 1.00 0.00 C +ATOM 35 CA THR A 35 265.607 263.555 290.663 1.00 0.00 C +ATOM 36 CA ARG A 36 262.946 260.933 291.410 1.00 0.00 C +ATOM 37 CA ARG A 37 261.483 259.487 294.617 1.00 0.00 C +ATOM 38 CA PRO A 38 258.118 257.828 295.282 1.00 0.00 C +ATOM 39 CA ARG A 39 257.464 254.282 294.052 1.00 0.00 C +ATOM 40 CA GLY A 40 257.430 251.267 291.723 1.00 0.00 C +ATOM 41 CA SER A 41 257.963 247.583 292.535 1.00 0.00 C +ATOM 42 CA HIS A 42 260.595 244.855 292.919 1.00 0.00 C +ATOM 43 CA VAL A 43 260.142 241.533 291.110 1.00 0.00 C +ATOM 44 CA GLY A 44 257.631 240.247 288.549 1.00 0.00 C +ATOM 45 CA GLY A 45 256.024 240.500 285.104 1.00 0.00 C +ATOM 46 CA ARG A 46 252.376 239.411 285.274 1.00 0.00 C +ATOM 47 CA THR A 47 249.591 241.997 285.003 1.00 0.00 C +ATOM 48 CA GLY A 48 247.123 242.310 282.118 1.00 0.00 C +ATOM 49 CA GLY A 49 247.290 242.732 278.335 1.00 0.00 C +ATOM 50 CA PRO A 50 245.621 241.215 275.264 1.00 0.00 C +ATOM 51 CA ASP A 51 244.818 242.461 271.754 1.00 0.00 C +ATOM 52 CA LEU A 52 241.779 240.859 270.108 1.00 0.00 C +ATOM 53 CA PRO A 53 239.369 238.603 272.009 1.00 0.00 C +ATOM 54 CA LYS A 54 239.426 239.055 275.792 1.00 0.00 C +ATOM 55 CA GLY A 55 236.951 241.032 277.908 1.00 0.00 C +ATOM 56 CA ARG A 56 235.637 242.746 281.047 1.00 0.00 C +ATOM 57 CA SER A 57 235.372 239.969 283.643 1.00 0.00 C +ATOM 58 CA ASP A 58 235.779 237.501 286.516 1.00 0.00 C +ATOM 59 CA GLY A 59 234.765 234.336 288.379 1.00 0.00 C +ATOM 60 CA GLY A 60 237.119 232.770 290.933 1.00 0.00 C +ATOM 61 CA GLY A 61 239.463 232.601 293.932 1.00 0.00 C +ATOM 62 CA GLY A 62 243.067 231.675 293.116 1.00 0.00 C +ATOM 63 CA SER A 63 244.931 234.852 292.142 1.00 0.00 C +ATOM 64 CA ARG A 64 246.697 234.040 288.866 1.00 0.00 C +ATOM 65 CA PRO A 65 245.856 230.709 287.217 1.00 0.00 C +ATOM 66 CA ALA A 66 248.848 228.504 286.381 1.00 0.00 C +ATOM 67 CA ARG A 67 251.542 227.607 283.840 1.00 0.00 C +ATOM 68 CA ALA A 68 255.040 226.397 284.742 1.00 0.00 C +ATOM 69 CA GLY A 69 258.598 225.070 285.051 1.00 0.00 C +ATOM 70 CA THR A 70 262.239 224.155 285.697 1.00 0.00 C +ATOM 71 CA ALA A 71 265.605 224.477 283.940 1.00 0.00 C +ATOM 72 CA GLN A 72 268.792 224.968 281.911 1.00 0.00 C +ATOM 73 CA ALA A 73 270.372 228.295 282.886 1.00 0.00 C +ATOM 74 CA GLY A 74 269.856 231.802 281.490 1.00 0.00 C +ATOM 75 CA PRO A 75 267.943 235.081 281.168 1.00 0.00 C +ATOM 76 CA ALA A 76 266.228 238.186 282.559 1.00 0.00 C +ATOM 77 CA THR A 77 262.421 238.052 282.488 1.00 0.00 C +ATOM 78 CA MET A 78 259.203 237.889 280.453 1.00 0.00 C +ATOM 79 CA ALA A 79 256.726 235.051 281.022 1.00 0.00 C +ATOM 80 CA HIS A 80 254.608 233.820 283.940 1.00 0.00 C +ATOM 81 CA GLY A 81 254.359 232.369 287.454 1.00 0.00 C +ATOM 82 CA GLY A 82 256.911 232.266 290.281 1.00 0.00 C +ATOM 83 CA ALA A 83 256.333 232.914 293.991 1.00 0.00 C +ATOM 84 CA THR A 84 256.430 231.643 297.581 1.00 0.00 C +ATOM 85 CA ARG A 85 254.830 233.366 300.579 1.00 0.00 C +ATOM 86 CA MET A 86 251.390 234.902 301.149 1.00 0.00 C +ATOM 87 CA ARG A 87 248.451 236.407 299.248 1.00 0.00 C +ATOM 88 CA ARG A 88 245.967 239.160 300.124 1.00 0.00 C +ATOM 89 CA TRP A 89 246.743 242.370 302.024 1.00 0.00 C +ATOM 90 CA CYS A 90 250.139 242.545 303.742 1.00 0.00 C +ATOM 91 CA GLY A 91 252.721 245.345 303.624 1.00 0.00 C +ATOM 92 CA THR A 92 250.850 248.614 304.196 1.00 0.00 C +ATOM 93 CA ALA A 93 251.893 252.266 304.496 1.00 0.00 C +ATOM 94 CA THR A 94 251.138 254.665 307.358 1.00 0.00 C +ATOM 95 CA GLY A 95 247.916 253.942 309.259 1.00 0.00 C +ATOM 96 CA GLY A 96 245.732 257.058 309.063 1.00 0.00 C +ATOM 97 CA ASP A 97 246.843 260.702 309.010 1.00 0.00 C +ATOM 98 CA ARG A 98 245.783 262.059 312.409 1.00 0.00 C +ATOM 99 CA PRO A 99 242.032 262.562 312.844 1.00 0.00 C +ATOM 100 CA ALA A 100 239.528 259.855 311.887 1.00 0.00 C +ATOM 101 CA ALA A 101 238.672 257.271 314.552 1.00 0.00 C +ATOM 102 CA GLU A 102 234.988 256.628 315.282 1.00 0.00 C +ATOM 103 CA SER A 103 233.949 253.014 314.670 1.00 0.00 C +ATOM 104 CA GLY A 104 232.381 250.393 316.948 1.00 0.00 C +ATOM 105 CA ILE A 105 230.463 247.914 314.783 1.00 0.00 C +ATOM 106 CA GLU A 106 231.397 244.969 312.552 1.00 0.00 C +ATOM 107 CA ARG A 107 228.547 243.028 310.932 1.00 0.00 C +ATOM 108 CA LYS A 108 225.255 241.122 310.718 1.00 0.00 C +ATOM 109 CA GLY A 109 222.107 239.069 310.095 1.00 0.00 C +ATOM 110 CA LEU A 110 221.563 236.614 312.958 1.00 0.00 C +ATOM 111 CA GLU A 111 217.962 236.963 314.152 1.00 0.00 C +ATOM 112 CA GLY A 112 216.025 237.896 311.006 1.00 0.00 C +ATOM 113 CA GLU A 113 212.379 238.434 310.043 1.00 0.00 C +ATOM 114 CA ARG A 114 211.411 241.402 307.858 1.00 0.00 C +ATOM 115 CA GLN A 115 209.117 243.309 305.488 1.00 0.00 C +ATOM 116 CA ASN A 116 209.079 243.243 301.679 1.00 0.00 C +ATOM 117 CA GLY A 117 211.843 244.774 299.550 1.00 0.00 C +ATOM 118 CA GLU A 118 213.594 244.935 296.170 1.00 0.00 C +ATOM 119 CA GLY A 119 214.825 246.768 293.065 1.00 0.00 C +ATOM 120 CA GLU A 120 217.178 247.984 290.327 1.00 0.00 C +ATOM 121 CA ASP A 121 215.916 249.508 287.071 1.00 0.00 C +ATOM 122 CA ALA A 122 215.212 253.202 287.682 1.00 0.00 C +ATOM 123 CA GLY A 123 212.981 256.275 287.986 1.00 0.00 C +ATOM 124 CA ARG A 124 209.305 256.826 287.149 1.00 0.00 C +ATOM 125 CA ARG A 125 208.894 255.392 283.643 1.00 0.00 C +ATOM 126 CA ARG A 126 207.093 254.953 280.315 1.00 0.00 C +ATOM 127 CA ARG A 127 209.621 254.817 277.467 1.00 0.00 C +ATOM 128 CA PRO A 128 211.681 254.793 274.263 1.00 0.00 C +ATOM 129 CA TRP A 129 210.705 254.217 270.625 1.00 0.00 C +ATOM 130 CA ARG A 130 211.873 254.971 267.078 1.00 0.00 C +ATOM 131 CA CYS A 131 213.446 257.860 265.155 1.00 0.00 C +ATOM 132 CA SER A 132 211.327 258.745 262.114 1.00 0.00 C +ATOM 133 CA PRO A 133 209.925 257.463 258.811 1.00 0.00 C +ATOM 134 CA ALA A 134 207.341 258.339 256.152 1.00 0.00 C +ATOM 135 CA HIS A 135 206.795 259.635 252.612 1.00 0.00 C +ATOM 136 CA GLY A 136 208.775 257.718 249.981 1.00 0.00 C +ATOM 137 CA ALA A 137 211.898 255.695 249.162 1.00 0.00 C +ATOM 138 CA GLU A 138 215.372 254.434 248.235 1.00 0.00 C +ATOM 139 CA TRP A 139 218.300 252.251 247.150 1.00 0.00 C +ATOM 140 CA ARG A 140 218.432 249.648 244.371 1.00 0.00 C +ATOM 141 CA PRO A 141 220.500 246.550 245.171 1.00 0.00 C +ATOM 142 CA THR A 142 221.913 245.243 241.883 1.00 0.00 C +ATOM 143 CA ALA A 143 225.166 244.210 240.191 1.00 0.00 C +ATOM 144 CA ASN A 144 225.611 242.403 236.866 1.00 0.00 C +ATOM 145 CA PHE A 145 228.196 239.725 236.053 1.00 0.00 C +ATOM 146 CA GLY A 146 230.997 239.122 238.564 1.00 0.00 C +ATOM 147 CA GLY A 147 229.445 239.026 242.042 1.00 0.00 C +ATOM 148 CA GLU A 148 230.470 236.672 244.857 1.00 0.00 C +ATOM 149 CA GLY A 149 231.840 237.135 248.382 1.00 0.00 C +ATOM 150 CA VAL A 150 235.632 237.424 248.611 1.00 0.00 C +ATOM 151 CA ASP A 151 238.030 234.728 247.388 1.00 0.00 C +ATOM 152 CA GLY A 152 239.114 231.092 247.730 1.00 0.00 C +ATOM 153 CA THR A 153 240.588 228.384 245.492 1.00 0.00 C +ATOM 154 CA ALA A 154 241.902 228.259 241.918 1.00 0.00 C +ATOM 155 CA ARG A 155 245.525 227.182 241.437 1.00 0.00 C +ATOM 156 CA THR A 156 247.809 228.948 238.951 1.00 0.00 C +ATOM 157 CA THR A 157 251.465 228.304 238.095 1.00 0.00 C +ATOM 158 CA VAL A 158 254.796 230.060 237.513 1.00 0.00 C +ATOM 159 CA ASN A 159 256.161 231.918 234.480 1.00 0.00 C +ATOM 160 CA THR A 160 259.019 230.408 232.463 1.00 0.00 C +ATOM 161 CA THR A 161 262.522 230.630 230.980 1.00 0.00 C +ATOM 162 CA VAL A 162 265.251 231.086 233.600 1.00 0.00 C +ATOM 163 CA SER A 163 268.658 232.764 233.894 1.00 0.00 C +ATOM 164 CA THR A 164 269.828 235.857 235.787 1.00 0.00 C +ATOM 165 CA ALA A 165 273.201 237.229 236.909 1.00 0.00 C +ATOM 166 CA TRP A 166 276.237 235.730 238.657 1.00 0.00 C +ATOM 167 CA LEU A 167 279.197 236.431 236.363 1.00 0.00 C +ATOM 168 CA GLY A 168 282.622 235.327 235.110 1.00 0.00 C +ATOM 169 CA THR A 169 286.131 236.709 235.651 1.00 0.00 C +ATOM 170 CA ALA A 170 287.636 240.209 235.679 1.00 0.00 C +ATOM 171 CA ALA A 171 286.207 243.251 233.884 1.00 0.00 C +ATOM 172 CA SER A 172 284.694 242.479 230.473 1.00 0.00 C +ATOM 173 CA GLY A 173 281.245 241.005 231.139 1.00 0.00 C +ATOM 174 CA ASP A 174 280.106 239.560 227.803 1.00 0.00 C +ATOM 175 CA ASP A 175 280.320 240.132 224.042 1.00 0.00 C +ATOM 176 CA ARG A 176 277.128 241.581 222.547 1.00 0.00 C +ATOM 177 CA GLY A 177 277.536 242.005 218.783 1.00 0.00 C +ATOM 178 CA ARG A 178 279.687 243.846 216.233 1.00 0.00 C +ATOM 179 CA GLU A 179 278.849 244.726 212.622 1.00 0.00 C +ATOM 180 CA GLU A 180 277.224 243.289 209.490 1.00 0.00 C +ATOM 181 CA GLY A 181 273.664 244.338 208.629 1.00 0.00 C +ATOM 182 CA ASP A 182 271.353 245.868 206.014 1.00 0.00 C +ATOM 183 CA GLY A 183 272.773 249.332 205.308 1.00 0.00 C +ATOM 184 CA ALA A 184 272.510 250.122 201.590 1.00 0.00 C +ATOM 185 CA ARG A 185 275.472 252.090 200.223 1.00 0.00 C +ATOM 186 CA ALA A 186 275.605 255.891 200.451 1.00 0.00 C +ATOM 187 CA LEU A 187 276.596 257.817 197.316 1.00 0.00 C +ATOM 188 CA GLU A 188 280.100 259.177 196.690 1.00 0.00 C +ATOM 189 CA GLY A 189 281.812 259.589 193.311 1.00 0.00 C +ATOM 190 CA THR A 190 282.864 262.843 191.631 1.00 0.00 C +ATOM 191 CA ARG A 191 286.111 262.348 189.701 1.00 0.00 C +ATOM 192 CA GLU A 192 288.913 264.539 191.067 1.00 0.00 C +ATOM 193 CA LEU A 193 289.565 266.499 194.269 1.00 0.00 C +ATOM 194 CA GLY A 194 290.289 264.757 197.579 1.00 0.00 C +ATOM 195 CA GLU A 195 289.822 261.248 198.988 1.00 0.00 C +ATOM 196 CA MET A 196 290.892 258.040 200.744 1.00 0.00 C +ATOM 197 CA GLY A 197 291.307 254.983 202.979 1.00 0.00 C +ATOM 198 CA LYS A 198 288.446 253.316 204.864 1.00 0.00 C +ATOM 199 CA LYS A 199 287.016 254.322 208.249 1.00 0.00 C +ATOM 200 CA ARG A 200 286.616 253.445 211.935 1.00 0.00 C +ATOM 201 CA GLU A 201 283.497 251.473 212.884 1.00 0.00 C +ATOM 202 CA GLY A 202 282.566 251.744 216.569 1.00 0.00 C +ATOM 203 CA VAL A 203 283.284 253.915 219.616 1.00 0.00 C +ATOM 204 CA ALA A 204 287.057 253.827 220.133 1.00 0.00 C +ATOM 205 CA ALA A 205 289.727 256.482 219.549 1.00 0.00 C +ATOM 206 CA ARG A 206 292.522 256.176 216.979 1.00 0.00 C +ATOM 207 CA ALA A 207 293.027 259.696 215.612 1.00 0.00 C +ATOM 208 CA GLY A 208 291.690 262.179 213.050 1.00 0.00 C +ATOM 209 CA GLU A 209 291.111 265.397 215.005 1.00 0.00 C +ATOM 210 CA ARG A 210 291.286 268.408 217.333 1.00 0.00 C +ATOM 211 CA GLY A 211 292.351 270.993 219.921 1.00 0.00 C +ATOM 212 CA LYS A 212 289.571 273.560 220.373 1.00 0.00 C +ATOM 213 CA TRP A 213 286.728 272.790 217.957 1.00 0.00 C +ATOM 214 CA VAL A 214 283.048 273.752 217.741 1.00 0.00 C +ATOM 215 CA ARG A 215 281.086 273.065 214.548 1.00 0.00 C +ATOM 216 CA GLY A 216 278.011 270.974 215.378 1.00 0.00 C +ATOM 217 CA ALA A 217 274.880 269.708 217.142 1.00 0.00 C +ATOM 218 CA ARG A 218 271.099 269.497 216.722 1.00 0.00 C +ATOM 219 CA ALA A 219 270.125 265.827 217.030 1.00 0.00 C +ATOM 220 CA ARG A 220 267.351 264.519 214.770 1.00 0.00 C +ATOM 221 CA GLY A 221 263.799 265.331 215.881 1.00 0.00 C +ATOM 222 CA ARG A 222 262.124 268.713 216.405 1.00 0.00 C +ATOM 223 CA ARG A 223 262.957 269.933 219.917 1.00 0.00 C +ATOM 224 CA GLY A 224 261.662 267.619 222.652 1.00 0.00 C +ATOM 225 CA PRO A 225 261.224 264.087 224.013 1.00 0.00 C +ATOM 226 CA GLY A 226 257.960 262.598 225.295 1.00 0.00 C +ATOM 227 CA GLY A 227 256.293 261.078 228.365 1.00 0.00 C +ATOM 228 CA ALA A 228 253.883 261.277 231.310 1.00 0.00 C +ATOM 229 CA GLY A 229 250.163 261.499 232.100 1.00 0.00 C +ATOM 230 CA GLU A 230 247.927 259.123 230.131 1.00 0.00 C +ATOM 231 CA GLY A 231 244.397 259.063 228.701 1.00 0.00 C +ATOM 232 CA ARG A 232 240.890 258.992 227.213 1.00 0.00 C +ATOM 233 CA GLY A 233 238.683 262.071 227.624 1.00 0.00 C +ATOM 234 CA GLY A 234 235.172 263.385 228.302 1.00 0.00 C +ATOM 235 CA GLY A 235 232.779 260.595 229.307 1.00 0.00 C +ATOM 236 CA CYS A 236 232.611 257.148 227.694 1.00 0.00 C +ATOM 237 CA GLY A 237 230.032 254.908 226.007 1.00 0.00 C +ATOM 238 CA ARG A 238 228.108 255.738 222.825 1.00 0.00 C +ATOM 239 CA GLY A 239 229.457 255.857 219.264 1.00 0.00 C +ATOM 240 CA GLY A 240 233.264 255.768 219.381 1.00 0.00 C +ATOM 241 CA ALA A 241 234.222 252.398 217.885 1.00 0.00 C +ATOM 242 CA GLY A 242 235.956 252.016 214.514 1.00 0.00 C +ATOM 243 CA ALA A 243 239.620 250.979 214.371 1.00 0.00 C +ATOM 244 CA ARG A 244 242.152 252.190 216.947 1.00 0.00 C +ATOM 245 CA LYS A 245 244.837 254.838 217.495 1.00 0.00 C +ATOM 246 CA GLY A 246 246.409 257.341 215.091 1.00 0.00 C +ATOM 247 CA THR A 247 248.340 259.758 212.867 1.00 0.00 C +ATOM 248 CA GLY A 248 251.095 260.657 210.394 1.00 0.00 C +ATOM 249 CA PRO A 249 254.520 261.277 211.943 1.00 0.00 C +ATOM 250 CA THR A 250 258.135 260.435 212.802 1.00 0.00 C +ATOM 251 CA GLY A 251 259.083 256.830 213.594 1.00 0.00 C +ATOM 252 CA GLY A 252 257.775 254.321 216.145 1.00 0.00 C +ATOM 253 CA PRO A 253 255.802 254.514 219.399 1.00 0.00 C +ATOM 254 CA HIS A 254 257.446 255.572 222.669 1.00 0.00 C +ATOM 255 CA LEU A 255 255.240 254.957 225.713 1.00 0.00 C +ATOM 256 CA SER A 256 253.936 251.525 226.730 1.00 0.00 C +ATOM 257 CA THR A 257 252.877 248.156 228.161 1.00 0.00 C +ATOM 258 CA THR A 258 249.926 245.836 228.813 1.00 0.00 C +ATOM 259 CA PRO A 259 247.972 243.618 226.410 1.00 0.00 C +ATOM 260 CA GLY A 260 249.327 244.408 222.937 1.00 0.00 C +ATOM 261 CA GLU A 261 247.263 244.206 219.741 1.00 0.00 C +ATOM 262 CA ARG A 262 249.308 243.235 216.676 1.00 0.00 C +ATOM 263 CA ARG A 263 247.408 240.499 214.825 1.00 0.00 C +ATOM 264 CA ARG A 264 244.575 239.308 212.574 1.00 0.00 C +ATOM 265 CA VAL A 265 242.169 241.172 210.282 1.00 0.00 C +ATOM 266 CA ALA A 266 238.997 242.514 208.652 1.00 0.00 C +ATOM 267 CA GLY A 267 237.141 245.719 207.755 1.00 0.00 C +ATOM 268 CA SER A 268 235.947 246.555 204.235 1.00 0.00 C +ATOM 269 CA ALA A 269 234.951 247.365 200.648 1.00 0.00 C +ATOM 270 CA ARG A 270 236.689 247.046 197.273 1.00 0.00 C +ATOM 271 CA MET A 271 235.147 249.414 194.716 1.00 0.00 C +ATOM 272 CA GLY A 272 237.282 250.734 191.850 1.00 0.00 C +ATOM 273 CA LEU A 273 240.877 249.891 190.912 1.00 0.00 C +ATOM 274 CA GLY A 274 243.063 247.876 193.295 1.00 0.00 C +ATOM 275 CA LEU A 275 243.074 244.359 191.830 1.00 0.00 C +ATOM 276 CA PHE A 276 241.825 240.802 192.378 1.00 0.00 C +ATOM 277 CA GLY A 277 238.876 238.876 190.927 1.00 0.00 C +ATOM 278 CA GLY A 278 239.194 235.499 189.191 1.00 0.00 C +ATOM 279 CA LYS A 279 239.286 232.602 191.664 1.00 0.00 C +ATOM 280 CA ARG A 280 237.434 232.717 194.991 1.00 0.00 C +ATOM 281 CA GLU A 281 234.551 232.365 197.457 1.00 0.00 C +ATOM 282 CA ARG A 282 232.318 232.150 200.537 1.00 0.00 C +ATOM 283 CA LYS A 283 230.322 229.288 202.066 1.00 0.00 C +ATOM 284 CA LYS A 284 228.435 226.040 201.428 1.00 0.00 C +ATOM 285 CA LYS A 285 225.666 224.468 199.336 1.00 0.00 C +ATOM 286 CA GLU A 286 223.034 226.781 197.839 1.00 0.00 C +ATOM 287 CA LYS A 287 221.572 229.578 195.704 1.00 0.00 C +ATOM 288 CA GLY A 288 220.979 232.749 193.678 1.00 0.00 C +ATOM 289 CA LYS A 289 218.949 235.967 193.472 1.00 0.00 C +TER 290 LYS A 289 +END diff --git a/Plants/Q8H839/Q8H839.dcd b/Plants/Q8H839/Q8H839.dcd new file mode 100644 index 0000000000000000000000000000000000000000..c355ab206d5fd47a9954a58d13f5d9b842b55d95 --- /dev/null +++ b/Plants/Q8H839/Q8H839.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:25c5e31682248e01cbb07667a808bf9f63fa1014e8c1eaa25e57a246606b399a +size 8600276 diff --git a/Plants/Q8H839/top.pdb b/Plants/Q8H839/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..4bccbbec5e8fb67ba431f5828787e400ef5804e4 --- /dev/null +++ b/Plants/Q8H839/top.pdb @@ -0,0 +1,69 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 242.165 251.998 271.514 1.00 0.00 C +ATOM 2 CA ALA A 2 241.502 255.412 273.068 1.00 0.00 C +ATOM 3 CA ALA A 3 242.203 258.042 270.403 1.00 0.00 C +ATOM 4 CA PRO A 4 244.757 259.050 267.761 1.00 0.00 C +ATOM 5 CA GLU A 5 245.902 255.869 266.003 1.00 0.00 C +ATOM 6 CA GLU A 6 248.758 253.371 266.352 1.00 0.00 C +ATOM 7 CA LEU A 7 250.152 249.831 266.158 1.00 0.00 C +ATOM 8 CA ARG A 8 248.847 247.084 268.453 1.00 0.00 C +ATOM 9 CA LEU A 9 245.760 246.466 270.599 1.00 0.00 C +ATOM 10 CA SER A 10 244.398 243.085 269.491 1.00 0.00 C +ATOM 11 CA GLU A 11 241.987 241.005 271.583 1.00 0.00 C +ATOM 12 CA GLY A 12 239.396 238.461 272.734 1.00 0.00 C +ATOM 13 CA MET A 13 238.370 235.019 271.462 1.00 0.00 C +ATOM 14 CA ALA A 14 235.885 233.285 269.151 1.00 0.00 C +ATOM 15 CA ALA A 15 233.200 234.484 266.728 1.00 0.00 C +ATOM 16 CA ALA A 16 233.732 238.103 265.662 1.00 0.00 C +ATOM 17 CA ALA A 17 234.059 239.755 262.244 1.00 0.00 C +ATOM 18 CA PRO A 18 233.582 242.172 259.338 1.00 0.00 C +ATOM 19 CA HIS A 19 234.045 245.692 257.956 1.00 0.00 C +ATOM 20 CA GLY A 20 236.857 248.260 258.078 1.00 0.00 C +ATOM 21 CA GLY A 21 240.223 246.647 258.843 1.00 0.00 C +ATOM 22 CA ARG A 22 243.767 246.751 257.449 1.00 0.00 C +ATOM 23 CA ARG A 23 247.388 245.585 257.669 1.00 0.00 C +ATOM 24 CA SER A 24 251.105 245.843 256.875 1.00 0.00 C +ATOM 25 CA GLY A 25 252.447 242.277 256.875 1.00 0.00 C +ATOM 26 CA GLY A 26 252.810 240.012 253.834 1.00 0.00 C +ATOM 27 CA SER A 27 252.601 238.226 250.475 1.00 0.00 C +ATOM 28 CA ALA A 28 251.307 236.405 247.388 1.00 0.00 C +ATOM 29 CA GLY A 29 248.714 238.419 245.455 1.00 0.00 C +ATOM 30 CA GLN A 30 245.865 240.597 244.169 1.00 0.00 C +ATOM 31 CA ARG A 31 245.674 241.752 240.544 1.00 0.00 C +ATOM 32 CA THR A 32 247.829 242.230 237.438 1.00 0.00 C +ATOM 33 CA GLU A 33 248.198 244.158 234.173 1.00 0.00 C +ATOM 34 CA GLU A 34 250.316 244.309 231.010 1.00 0.00 C +ATOM 35 CA ARG A 35 252.795 244.137 228.122 1.00 0.00 C +ATOM 36 CA GLN A 36 252.285 244.700 224.388 1.00 0.00 C +ATOM 37 CA ARG A 37 254.691 246.279 221.891 1.00 0.00 C +ATOM 38 CA TRP A 38 258.140 247.427 220.750 1.00 0.00 C +ATOM 39 CA LEU A 39 260.220 249.160 218.070 1.00 0.00 C +ATOM 40 CA ARG A 40 264.005 248.848 218.375 1.00 0.00 C +ATOM 41 CA ALA A 41 265.855 247.807 221.539 1.00 0.00 C +ATOM 42 CA GLY A 42 264.377 249.966 224.309 1.00 0.00 C +ATOM 43 CA GLY A 43 266.158 252.218 226.815 1.00 0.00 C +ATOM 44 CA ALA A 44 269.496 252.844 228.541 1.00 0.00 C +ATOM 45 CA ALA A 45 269.912 251.259 231.980 1.00 0.00 C +ATOM 46 CA SER A 46 266.884 252.278 234.056 1.00 0.00 C +ATOM 47 CA LEU A 47 263.712 254.327 233.548 1.00 0.00 C +ATOM 48 CA GLY A 48 260.816 253.119 235.710 1.00 0.00 C +ATOM 49 CA ARG A 49 257.180 254.255 235.646 1.00 0.00 C +ATOM 50 CA ASN A 50 254.979 254.773 238.712 1.00 0.00 C +ATOM 51 CA GLY A 51 251.642 256.077 240.009 1.00 0.00 C +ATOM 52 CA GLY A 52 251.275 259.013 242.409 1.00 0.00 C +ATOM 53 CA GLY A 53 248.221 259.955 244.483 1.00 0.00 C +ATOM 54 CA CYS A 54 246.239 260.508 247.690 1.00 0.00 C +ATOM 55 CA ALA A 55 246.700 260.666 251.469 1.00 0.00 C +ATOM 56 CA ALA A 56 249.111 262.107 254.043 1.00 0.00 C +ATOM 57 CA ARG A 57 248.283 265.586 255.358 1.00 0.00 C +ATOM 58 CA LYS A 58 246.213 265.126 258.523 1.00 0.00 C +ATOM 59 CA LYS A 59 247.308 262.145 260.627 1.00 0.00 C +ATOM 60 CA GLU A 60 250.597 260.361 259.908 1.00 0.00 C +ATOM 61 CA LYS A 61 254.026 261.953 260.383 1.00 0.00 C +ATOM 62 CA ARG A 62 256.274 262.541 257.364 1.00 0.00 C +ATOM 63 CA ARG A 63 258.710 264.169 254.928 1.00 0.00 C +ATOM 64 CA ARG A 64 260.044 266.550 252.270 1.00 0.00 C +ATOM 65 CA GLY A 65 260.053 270.191 251.146 1.00 0.00 C +TER 66 GLY A 65 +END diff --git a/Plants/Q8H8E6/Q8H8E6.dcd b/Plants/Q8H8E6/Q8H8E6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..ced971758d47229e54375a5dc7c167da15bd169a --- /dev/null +++ b/Plants/Q8H8E6/Q8H8E6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:b23693bbdf1414c47e8b58aa76a0cc8100a0c5716df07e6ccc9608fd6090a155 +size 16760276 diff --git a/Plants/Q8H8E6/top.pdb b/Plants/Q8H8E6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..21996c00e9de5bea9ef49f43d26541e13578b0b9 --- /dev/null +++ b/Plants/Q8H8E6/top.pdb @@ -0,0 +1,137 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 254.176 231.807 238.848 1.00 0.00 C +ATOM 2 CA VAL A 2 255.049 233.393 235.495 1.00 0.00 C +ATOM 3 CA THR A 3 255.039 237.182 235.903 1.00 0.00 C +ATOM 4 CA ALA A 4 253.897 240.009 238.187 1.00 0.00 C +ATOM 5 CA GLY A 5 250.328 241.128 238.917 1.00 0.00 C +ATOM 6 CA ASP A 6 248.986 243.582 236.330 1.00 0.00 C +ATOM 7 CA HIS A 7 247.981 245.821 233.416 1.00 0.00 C +ATOM 8 CA ARG A 8 246.591 246.295 229.900 1.00 0.00 C +ATOM 9 CA ARG A 9 244.428 247.651 227.072 1.00 0.00 C +ATOM 10 CA GLY A 10 245.520 250.252 224.511 1.00 0.00 C +ATOM 11 CA GLY A 11 246.477 253.177 222.264 1.00 0.00 C +ATOM 12 CA ALA A 12 244.461 256.278 221.351 1.00 0.00 C +ATOM 13 CA ALA A 13 241.367 258.160 220.169 1.00 0.00 C +ATOM 14 CA PRO A 14 237.737 257.010 220.052 1.00 0.00 C +ATOM 15 CA GLU A 15 235.978 255.792 216.900 1.00 0.00 C +ATOM 16 CA ARG A 16 232.658 253.927 217.002 1.00 0.00 C +ATOM 17 CA ALA A 17 231.521 254.203 220.628 1.00 0.00 C +ATOM 18 CA GLU A 18 233.309 252.108 223.261 1.00 0.00 C +ATOM 19 CA ARG A 19 235.729 253.136 226.019 1.00 0.00 C +ATOM 20 CA ARG A 20 238.430 252.925 228.698 1.00 0.00 C +ATOM 21 CA GLY A 21 240.336 250.659 231.095 1.00 0.00 C +ATOM 22 CA LYS A 22 243.175 250.520 233.633 1.00 0.00 C +ATOM 23 CA ALA A 23 245.086 250.088 236.900 1.00 0.00 C +ATOM 24 CA ASN A 24 245.776 252.866 239.414 1.00 0.00 C +ATOM 25 CA GLY A 25 243.846 255.301 241.620 1.00 0.00 C +ATOM 26 CA GLY A 26 245.277 258.804 241.175 1.00 0.00 C +ATOM 27 CA LEU A 27 247.906 259.184 243.906 1.00 0.00 C +ATOM 28 CA ARG A 28 250.662 256.744 244.887 1.00 0.00 C +ATOM 29 CA LEU A 29 249.498 253.119 245.022 1.00 0.00 C +ATOM 30 CA THR A 30 252.128 251.175 246.976 1.00 0.00 C +ATOM 31 CA PRO A 31 251.660 248.043 249.094 1.00 0.00 C +ATOM 32 CA GLY A 32 250.921 244.489 247.937 1.00 0.00 C +ATOM 33 CA GLN A 33 251.066 244.503 244.129 1.00 0.00 C +ATOM 34 CA ARG A 34 251.186 247.481 241.757 1.00 0.00 C +ATOM 35 CA ARG A 35 252.865 249.823 239.264 1.00 0.00 C +ATOM 36 CA ARG A 36 255.504 249.938 236.518 1.00 0.00 C +ATOM 37 CA ARG A 37 255.704 246.419 235.072 1.00 0.00 C +ATOM 38 CA GLU A 38 258.507 244.140 236.284 1.00 0.00 C +ATOM 39 CA ARG A 39 261.902 245.394 235.093 1.00 0.00 C +ATOM 40 CA TRP A 40 265.328 245.575 236.750 1.00 0.00 C +ATOM 41 CA PRO A 41 268.643 247.073 237.883 1.00 0.00 C +ATOM 42 CA GLU A 42 271.973 248.257 239.306 1.00 0.00 C +ATOM 43 CA ARG A 43 272.029 251.396 241.465 1.00 0.00 C +ATOM 44 CA ARG A 44 269.707 252.228 244.369 1.00 0.00 C +ATOM 45 CA LYS A 45 268.625 252.096 248.020 1.00 0.00 C +ATOM 46 CA ALA A 46 265.115 251.180 249.184 1.00 0.00 C +ATOM 47 CA ALA A 47 264.311 247.702 247.854 1.00 0.00 C +ATOM 48 CA ALA A 48 266.516 244.602 248.071 1.00 0.00 C +ATOM 49 CA ARG A 49 270.175 243.893 247.281 1.00 0.00 C +ATOM 50 CA LEU A 50 273.498 242.083 247.723 1.00 0.00 C +ATOM 51 CA GLY A 51 273.833 240.990 251.358 1.00 0.00 C +ATOM 52 CA MET A 52 277.128 239.082 251.486 1.00 0.00 C +ATOM 53 CA THR A 53 280.415 239.630 253.334 1.00 0.00 C +ATOM 54 CA MET A 54 283.967 240.851 253.970 1.00 0.00 C +ATOM 55 CA THR A 55 287.141 242.858 253.328 1.00 0.00 C +ATOM 56 CA ALA A 56 289.922 240.839 254.974 1.00 0.00 C +ATOM 57 CA ALA A 57 290.833 238.769 258.040 1.00 0.00 C +ATOM 58 CA LEU A 58 291.537 235.044 257.662 1.00 0.00 C +ATOM 59 CA ARG A 59 291.233 233.995 254.012 1.00 0.00 C +ATOM 60 CA ARG A 60 292.580 236.150 251.173 1.00 0.00 C +ATOM 61 CA SER A 61 294.893 238.539 249.314 1.00 0.00 C +ATOM 62 CA ALA A 62 297.937 240.362 250.703 1.00 0.00 C +ATOM 63 CA SER A 63 299.975 243.439 249.760 1.00 0.00 C +ATOM 64 CA GLU A 64 299.881 247.122 250.730 1.00 0.00 C +ATOM 65 CA THR A 65 300.477 250.103 253.027 1.00 0.00 C +ATOM 66 CA GLU A 66 298.396 253.118 251.983 1.00 0.00 C +ATOM 67 CA ALA A 67 296.577 256.341 251.077 1.00 0.00 C +ATOM 68 CA ARG A 68 293.860 258.357 249.324 1.00 0.00 C +ATOM 69 CA THR A 69 290.117 257.990 249.929 1.00 0.00 C +ATOM 70 CA ARG A 70 288.257 254.676 249.655 1.00 0.00 C +ATOM 71 CA SER A 71 286.257 252.690 247.091 1.00 0.00 C +ATOM 72 CA THR A 72 284.134 249.655 246.199 1.00 0.00 C +ATOM 73 CA ALA A 73 282.612 247.401 248.868 1.00 0.00 C +ATOM 74 CA MET A 74 278.825 247.205 249.239 1.00 0.00 C +ATOM 75 CA ARG A 75 276.130 249.689 248.198 1.00 0.00 C +ATOM 76 CA ARG A 76 275.241 251.843 251.212 1.00 0.00 C +ATOM 77 CA CYS A 77 275.134 251.581 255.012 1.00 0.00 C +ATOM 78 CA ARG A 78 272.683 251.060 257.881 1.00 0.00 C +ATOM 79 CA GLY A 79 270.055 253.777 258.361 1.00 0.00 C +ATOM 80 CA ARG A 80 266.771 253.844 260.292 1.00 0.00 C +ATOM 81 CA TRP A 81 266.323 254.257 264.053 1.00 0.00 C +ATOM 82 CA ARG A 82 266.911 254.583 267.803 1.00 0.00 C +ATOM 83 CA ARG A 83 268.514 256.672 270.556 1.00 0.00 C +ATOM 84 CA ALA A 84 267.777 260.212 271.757 1.00 0.00 C +ATOM 85 CA GLY A 85 264.875 261.480 273.875 1.00 0.00 C +ATOM 86 CA ARG A 86 262.246 258.726 273.710 1.00 0.00 C +ATOM 87 CA LYS A 87 259.161 256.931 272.378 1.00 0.00 C +ATOM 88 CA THR A 88 255.949 258.755 271.445 1.00 0.00 C +ATOM 89 CA GLY A 89 254.179 256.421 269.008 1.00 0.00 C +ATOM 90 CA ALA A 90 252.830 252.862 268.836 1.00 0.00 C +ATOM 91 CA THR A 91 251.094 249.547 269.550 1.00 0.00 C +ATOM 92 CA THR A 92 252.172 246.725 267.229 1.00 0.00 C +ATOM 93 CA ALA A 93 251.322 243.019 267.481 1.00 0.00 C +ATOM 94 CA ALA A 94 247.747 242.333 266.357 1.00 0.00 C +ATOM 95 CA ASN A 95 246.528 243.095 262.828 1.00 0.00 C +ATOM 96 CA ARG A 96 245.295 246.698 262.705 1.00 0.00 C +ATOM 97 CA ARG A 97 244.507 250.342 263.493 1.00 0.00 C +ATOM 98 CA SER A 98 241.614 252.102 265.238 1.00 0.00 C +ATOM 99 CA ALA A 99 238.544 249.873 264.888 1.00 0.00 C +ATOM 100 CA ALA A 100 237.820 246.340 266.115 1.00 0.00 C +ATOM 101 CA THR A 101 235.783 243.252 267.027 1.00 0.00 C +ATOM 102 CA ALA A 102 232.936 241.373 268.725 1.00 0.00 C +ATOM 103 CA GLU A 103 230.321 239.309 266.877 1.00 0.00 C +ATOM 104 CA ARG A 104 227.139 237.593 268.080 1.00 0.00 C +ATOM 105 CA GLU A 105 223.447 237.244 267.208 1.00 0.00 C +ATOM 106 CA GLU A 106 220.981 238.255 269.930 1.00 0.00 C +ATOM 107 CA HIS A 107 218.374 240.470 268.253 1.00 0.00 C +ATOM 108 CA GLY A 108 218.183 243.276 265.683 1.00 0.00 C +ATOM 109 CA ALA A 109 218.885 246.689 264.142 1.00 0.00 C +ATOM 110 CA SER A 110 217.288 249.803 262.636 1.00 0.00 C +ATOM 111 CA THR A 111 217.124 253.297 261.124 1.00 0.00 C +ATOM 112 CA ASP A 112 215.600 255.660 263.696 1.00 0.00 C +ATOM 113 CA PRO A 113 218.006 258.426 264.732 1.00 0.00 C +ATOM 114 CA THR A 114 219.686 257.430 268.004 1.00 0.00 C +ATOM 115 CA ALA A 115 217.137 256.087 270.496 1.00 0.00 C +ATOM 116 CA ARG A 116 213.723 254.398 270.592 1.00 0.00 C +ATOM 117 CA ALA A 117 210.894 256.837 269.840 1.00 0.00 C +ATOM 118 CA SER A 118 211.950 259.493 267.320 1.00 0.00 C +ATOM 119 CA GLY A 119 210.367 261.855 264.785 1.00 0.00 C +ATOM 120 CA GLU A 120 210.181 261.721 260.982 1.00 0.00 C +ATOM 121 CA ARG A 121 207.767 261.372 258.056 1.00 0.00 C +ATOM 122 CA ARG A 122 204.195 260.094 258.412 1.00 0.00 C +ATOM 123 CA LYS A 123 202.580 258.989 255.143 1.00 0.00 C +ATOM 124 CA ARG A 124 205.194 257.580 252.755 1.00 0.00 C +ATOM 125 CA LYS A 125 206.682 259.087 249.588 1.00 0.00 C +ATOM 126 CA SER A 126 206.538 258.581 245.814 1.00 0.00 C +ATOM 127 CA GLY A 127 203.094 259.454 244.438 1.00 0.00 C +ATOM 128 CA ALA A 128 200.132 261.171 242.767 1.00 0.00 C +ATOM 129 CA ARG A 129 199.586 259.844 239.237 1.00 0.00 C +ATOM 130 CA GLY A 130 196.280 258.429 237.977 1.00 0.00 C +ATOM 131 CA ALA A 131 195.192 260.224 234.797 1.00 0.00 C +ATOM 132 CA ILE A 132 192.771 259.417 231.968 1.00 0.00 C +ATOM 133 CA ILE A 133 191.189 256.705 229.809 1.00 0.00 C +TER 134 ILE A 133 +END diff --git a/Plants/Q8H8P6/Q8H8P6.dcd b/Plants/Q8H8P6/Q8H8P6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..bc9c3d5d6f310ed42831a51777ec0a73c533bd40 --- /dev/null +++ b/Plants/Q8H8P6/Q8H8P6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5266764e8c57b30efb5516fc1841f4784ee7f8e93feacf84299188b986a7bed0 +size 23360276 diff --git a/Plants/Q8H8P6/top.pdb b/Plants/Q8H8P6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..20ae92ca5aaa30bb232dc5640ac10f568b29a032 --- /dev/null +++ b/Plants/Q8H8P6/top.pdb @@ -0,0 +1,192 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 291.273 263.358 278.199 1.00 0.00 C +ATOM 2 CA VAL A 2 291.174 263.760 281.987 1.00 0.00 C +ATOM 3 CA ALA A 3 292.391 266.135 284.707 1.00 0.00 C +ATOM 4 CA ALA A 4 293.627 267.686 287.959 1.00 0.00 C +ATOM 5 CA GLY A 5 292.124 271.187 288.012 1.00 0.00 C +ATOM 6 CA ASP A 6 289.325 271.260 290.596 1.00 0.00 C +ATOM 7 CA HIS A 7 286.766 273.688 289.156 1.00 0.00 C +ATOM 8 CA ARG A 8 284.927 273.718 285.819 1.00 0.00 C +ATOM 9 CA ARG A 9 281.292 274.175 284.775 1.00 0.00 C +ATOM 10 CA ASP A 10 280.532 277.065 282.412 1.00 0.00 C +ATOM 11 CA GLY A 11 278.145 279.803 283.561 1.00 0.00 C +ATOM 12 CA ALA A 12 279.810 282.274 285.936 1.00 0.00 C +ATOM 13 CA ALA A 13 282.791 282.635 288.281 1.00 0.00 C +ATOM 14 CA PRO A 14 286.427 283.564 287.624 1.00 0.00 C +ATOM 15 CA GLU A 15 289.087 285.788 289.204 1.00 0.00 C +ATOM 16 CA ARG A 16 288.980 289.596 289.267 1.00 0.00 C +ATOM 17 CA GLY A 17 292.368 291.336 289.169 1.00 0.00 C +ATOM 18 CA GLU A 18 293.722 294.042 286.854 1.00 0.00 C +ATOM 19 CA GLY A 19 296.857 295.119 284.975 1.00 0.00 C +ATOM 20 CA ARG A 20 296.242 298.667 283.730 1.00 0.00 C +ATOM 21 CA GLY A 21 295.606 302.418 283.924 1.00 0.00 C +ATOM 22 CA LYS A 22 292.921 304.926 284.933 1.00 0.00 C +ATOM 23 CA ARG A 23 292.158 306.507 288.314 1.00 0.00 C +ATOM 24 CA ASN A 24 290.628 306.067 291.776 1.00 0.00 C +ATOM 25 CA GLY A 25 287.322 304.479 292.810 1.00 0.00 C +ATOM 26 CA ARG A 26 286.073 301.523 294.863 1.00 0.00 C +ATOM 27 CA SER A 27 283.154 301.954 297.274 1.00 0.00 C +ATOM 28 CA THR A 28 281.676 298.863 298.939 1.00 0.00 C +ATOM 29 CA ALA A 29 278.159 298.030 297.734 1.00 0.00 C +ATOM 30 CA HIS A 30 276.942 294.471 298.340 1.00 0.00 C +ATOM 31 CA PRO A 31 276.373 290.735 297.856 1.00 0.00 C +ATOM 32 CA GLY A 32 272.923 289.175 298.276 1.00 0.00 C +ATOM 33 CA SER A 33 271.350 285.853 297.272 1.00 0.00 C +ATOM 34 CA THR A 34 272.040 282.350 298.603 1.00 0.00 C +ATOM 35 CA ALA A 35 272.800 279.114 296.741 1.00 0.00 C +ATOM 36 CA THR A 36 272.447 275.420 295.878 1.00 0.00 C +ATOM 37 CA THR A 37 273.705 272.075 294.557 1.00 0.00 C +ATOM 38 CA GLU A 38 275.772 268.875 294.473 1.00 0.00 C +ATOM 39 CA MET A 39 276.845 265.679 292.699 1.00 0.00 C +ATOM 40 CA ALA A 40 279.935 264.152 291.075 1.00 0.00 C +ATOM 41 CA THR A 41 282.848 262.238 289.538 1.00 0.00 C +ATOM 42 CA LYS A 42 281.925 259.043 287.678 1.00 0.00 C +ATOM 43 CA ALA A 43 280.563 256.096 285.685 1.00 0.00 C +ATOM 44 CA GLU A 44 283.597 254.190 284.387 1.00 0.00 C +ATOM 45 CA ARG A 45 283.982 250.541 285.415 1.00 0.00 C +ATOM 46 CA GLY A 46 287.570 249.650 284.493 1.00 0.00 C +ATOM 47 CA GLY A 47 288.233 246.332 286.245 1.00 0.00 C +ATOM 48 CA GLY A 48 290.939 244.343 284.446 1.00 0.00 C +ATOM 49 CA ALA A 49 292.390 245.536 281.132 1.00 0.00 C +ATOM 50 CA ALA A 50 290.335 245.185 277.943 1.00 0.00 C +ATOM 51 CA ARG A 51 286.798 244.886 276.558 1.00 0.00 C +ATOM 52 CA VAL A 52 283.718 244.424 274.363 1.00 0.00 C +ATOM 53 CA ASP A 53 280.946 247.025 274.112 1.00 0.00 C +ATOM 54 CA GLU A 54 280.217 250.503 272.737 1.00 0.00 C +ATOM 55 CA ASP A 55 278.177 249.861 269.584 1.00 0.00 C +ATOM 56 CA GLY A 56 275.057 252.034 269.821 1.00 0.00 C +ATOM 57 CA GLY A 57 271.465 251.528 270.986 1.00 0.00 C +ATOM 58 CA VAL A 58 268.180 252.086 272.833 1.00 0.00 C +ATOM 59 CA PRO A 59 266.317 250.861 275.923 1.00 0.00 C +ATOM 60 CA ALA A 60 267.112 248.582 278.871 1.00 0.00 C +ATOM 61 CA VAL A 61 269.866 248.293 281.488 1.00 0.00 C +ATOM 62 CA GLY A 62 272.835 245.925 281.788 1.00 0.00 C +ATOM 63 CA GLY A 63 272.889 242.115 281.773 1.00 0.00 C +ATOM 64 CA GLN A 64 275.792 240.840 279.662 1.00 0.00 C +ATOM 65 CA ASN A 65 276.558 240.675 275.933 1.00 0.00 C +ATOM 66 CA GLU A 66 274.209 243.080 274.140 1.00 0.00 C +ATOM 67 CA GLY A 67 272.119 245.511 272.081 1.00 0.00 C +ATOM 68 CA VAL A 68 273.126 246.068 268.449 1.00 0.00 C +ATOM 69 CA ASP A 69 274.052 243.868 265.480 1.00 0.00 C +ATOM 70 CA GLU A 70 272.525 244.474 262.042 1.00 0.00 C +ATOM 71 CA VAL A 71 271.957 247.097 259.338 1.00 0.00 C +ATOM 72 CA GLY A 72 272.774 250.643 258.208 1.00 0.00 C +ATOM 73 CA GLU A 73 271.600 253.687 260.174 1.00 0.00 C +ATOM 74 CA ASP A 74 273.927 256.543 259.201 1.00 0.00 C +ATOM 75 CA ALA A 75 273.507 259.753 261.209 1.00 0.00 C +ATOM 76 CA ALA A 76 273.233 260.826 264.855 1.00 0.00 C +ATOM 77 CA LYS A 77 276.319 261.454 266.999 1.00 0.00 C +ATOM 78 CA PRO A 78 274.919 262.639 270.338 1.00 0.00 C +ATOM 79 CA LYS A 79 271.232 263.580 270.147 1.00 0.00 C +ATOM 80 CA GLU A 80 267.899 262.259 268.858 1.00 0.00 C +ATOM 81 CA ALA A 81 266.305 263.348 265.573 1.00 0.00 C +ATOM 82 CA MET A 82 265.934 262.928 261.804 1.00 0.00 C +ATOM 83 CA PRO A 83 266.576 260.936 258.621 1.00 0.00 C +ATOM 84 CA LYS A 84 267.098 261.917 254.976 1.00 0.00 C +ATOM 85 CA ARG A 85 267.199 259.423 252.098 1.00 0.00 C +ATOM 86 CA GLU A 86 265.505 256.545 250.264 1.00 0.00 C +ATOM 87 CA GLU A 87 261.823 255.565 250.285 1.00 0.00 C +ATOM 88 CA VAL A 88 259.711 252.547 249.311 1.00 0.00 C +ATOM 89 CA ARG A 89 256.511 251.802 247.383 1.00 0.00 C +ATOM 90 CA GLY A 90 253.255 253.751 247.721 1.00 0.00 C +ATOM 91 CA ASP A 91 250.684 253.479 244.922 1.00 0.00 C +ATOM 92 CA ASP A 92 247.641 251.256 245.486 1.00 0.00 C +ATOM 93 CA GLY A 93 244.289 249.839 244.357 1.00 0.00 C +ATOM 94 CA GLY A 94 241.908 247.044 245.372 1.00 0.00 C +ATOM 95 CA GLY A 95 239.761 243.905 245.597 1.00 0.00 C +ATOM 96 CA PRO A 96 237.581 241.847 247.949 1.00 0.00 C +ATOM 97 CA LYS A 97 233.939 242.704 247.231 1.00 0.00 C +ATOM 98 CA LEU A 98 233.549 242.393 243.454 1.00 0.00 C +ATOM 99 CA GLY A 99 233.253 245.236 240.935 1.00 0.00 C +ATOM 100 CA GLY A 100 231.122 248.109 239.624 1.00 0.00 C +ATOM 101 CA ASP A 101 231.398 251.183 237.389 1.00 0.00 C +ATOM 102 CA GLY A 102 229.420 253.444 235.045 1.00 0.00 C +ATOM 103 CA GLY A 103 225.978 253.403 233.413 1.00 0.00 C +ATOM 104 CA GLU A 104 223.786 255.995 235.142 1.00 0.00 C +ATOM 105 CA ARG A 105 220.474 257.698 234.335 1.00 0.00 C +ATOM 106 CA GLY A 106 217.121 258.918 235.669 1.00 0.00 C +ATOM 107 CA ARG A 107 214.957 261.243 233.565 1.00 0.00 C +ATOM 108 CA ARG A 108 211.833 261.936 231.497 1.00 0.00 C +ATOM 109 CA ARG A 109 209.157 263.046 229.023 1.00 0.00 C +ATOM 110 CA GLU A 110 211.025 264.218 225.916 1.00 0.00 C +ATOM 111 CA LEU A 111 211.907 263.124 222.375 1.00 0.00 C +ATOM 112 CA ASP A 112 212.243 261.804 218.817 1.00 0.00 C +ATOM 113 CA SER A 113 212.013 260.118 215.408 1.00 0.00 C +ATOM 114 CA ASP A 114 212.357 262.322 212.320 1.00 0.00 C +ATOM 115 CA GLY A 115 215.715 262.497 210.529 1.00 0.00 C +ATOM 116 CA GLU A 116 219.148 263.379 209.132 1.00 0.00 C +ATOM 117 CA ARG A 117 222.165 261.290 208.108 1.00 0.00 C +ATOM 118 CA GLU A 118 223.777 259.535 205.135 1.00 0.00 C +ATOM 119 CA ARG A 119 223.386 256.916 202.395 1.00 0.00 C +ATOM 120 CA ARG A 120 220.219 254.800 202.332 1.00 0.00 C +ATOM 121 CA ALA A 121 216.472 255.213 201.775 1.00 0.00 C +ATOM 122 CA ALA A 122 214.476 252.169 200.650 1.00 0.00 C +ATOM 123 CA GLU A 123 210.958 251.993 202.102 1.00 0.00 C +ATOM 124 CA THR A 124 208.472 249.725 200.315 1.00 0.00 C +ATOM 125 CA GLU A 125 208.443 246.589 198.151 1.00 0.00 C +ATOM 126 CA GLU A 126 209.807 243.032 198.132 1.00 0.00 C +ATOM 127 CA GLY A 127 212.410 242.100 200.754 1.00 0.00 C +ATOM 128 CA GLY A 128 212.379 244.461 203.744 1.00 0.00 C +ATOM 129 CA THR A 129 215.528 245.819 205.404 1.00 0.00 C +ATOM 130 CA GLY A 130 219.064 244.407 205.562 1.00 0.00 C +ATOM 131 CA SER A 131 221.121 241.350 204.594 1.00 0.00 C +ATOM 132 CA VAL A 132 219.823 240.016 201.269 1.00 0.00 C +ATOM 133 CA TYR A 133 217.526 237.136 200.298 1.00 0.00 C +ATOM 134 CA ILE A 134 215.337 235.837 203.133 1.00 0.00 C +ATOM 135 CA ALA A 135 215.784 232.126 203.872 1.00 0.00 C +ATOM 136 CA LEU A 136 216.590 228.938 205.796 1.00 0.00 C +ATOM 137 CA GLY A 137 214.971 227.832 209.063 1.00 0.00 C +ATOM 138 CA GLY A 138 213.438 225.305 211.467 1.00 0.00 C +ATOM 139 CA GLY A 139 213.784 221.531 211.071 1.00 0.00 C +ATOM 140 CA GLU A 140 216.753 219.156 211.322 1.00 0.00 C +ATOM 141 CA ASN A 141 219.811 219.285 213.591 1.00 0.00 C +ATOM 142 CA GLY A 142 223.105 218.262 215.208 1.00 0.00 C +ATOM 143 CA ARG A 143 222.662 218.966 218.926 1.00 0.00 C +ATOM 144 CA MET A 144 224.618 222.158 219.638 1.00 0.00 C +ATOM 145 CA ARG A 145 223.443 225.049 217.453 1.00 0.00 C +ATOM 146 CA GLY A 146 223.583 225.479 213.670 1.00 0.00 C +ATOM 147 CA ASN A 147 223.372 228.245 211.058 1.00 0.00 C +ATOM 148 CA ARG A 148 223.989 228.250 207.298 1.00 0.00 C +ATOM 149 CA PRO A 149 224.417 227.789 203.541 1.00 0.00 C +ATOM 150 CA ARG A 150 226.569 226.100 200.889 1.00 0.00 C +ATOM 151 CA LYS A 151 230.325 226.056 201.529 1.00 0.00 C +ATOM 152 CA ILE A 152 233.476 225.328 203.543 1.00 0.00 C +ATOM 153 CA ARG A 153 235.873 227.064 205.942 1.00 0.00 C +ATOM 154 CA PRO A 154 239.251 226.153 207.451 1.00 0.00 C +ATOM 155 CA PRO A 155 240.248 223.742 210.227 1.00 0.00 C +ATOM 156 CA LEU A 156 238.210 222.778 213.299 1.00 0.00 C +ATOM 157 CA MET A 157 237.312 220.682 216.351 1.00 0.00 C +ATOM 158 CA ARG A 158 234.592 218.029 216.072 1.00 0.00 C +ATOM 159 CA ARG A 159 231.248 219.852 215.959 1.00 0.00 C +ATOM 160 CA ARG A 160 231.484 222.857 218.290 1.00 0.00 C +ATOM 161 CA GLY A 161 233.948 223.245 221.169 1.00 0.00 C +ATOM 162 CA LEU A 162 232.694 222.497 224.688 1.00 0.00 C +ATOM 163 CA GLY A 163 230.241 221.544 227.443 1.00 0.00 C +ATOM 164 CA GLY A 164 227.751 223.582 229.484 1.00 0.00 C +ATOM 165 CA ASN A 165 225.146 223.491 232.263 1.00 0.00 C +ATOM 166 CA VAL A 166 222.844 223.200 235.285 1.00 0.00 C +ATOM 167 CA SER A 167 219.288 222.484 234.120 1.00 0.00 C +ATOM 168 CA GLU A 168 217.422 221.308 237.227 1.00 0.00 C +ATOM 169 CA GLN A 169 215.749 218.296 238.854 1.00 0.00 C +ATOM 170 CA ILE A 170 217.830 217.527 241.951 1.00 0.00 C +ATOM 171 CA ARG A 171 216.843 216.613 245.516 1.00 0.00 C +ATOM 172 CA GLY A 172 218.080 216.908 249.108 1.00 0.00 C +ATOM 173 CA ARG A 173 220.512 214.332 250.511 1.00 0.00 C +ATOM 174 CA GLU A 174 220.835 211.475 248.012 1.00 0.00 C +ATOM 175 CA ARG A 175 220.303 210.394 244.398 1.00 0.00 C +ATOM 176 CA GLY A 176 219.740 206.742 243.472 1.00 0.00 C +ATOM 177 CA LYS A 177 219.446 204.276 240.583 1.00 0.00 C +ATOM 178 CA SER A 178 221.069 205.914 237.550 1.00 0.00 C +ATOM 179 CA GLY A 179 219.891 209.536 237.431 1.00 0.00 C +ATOM 180 CA GLY A 180 220.192 213.159 238.569 1.00 0.00 C +ATOM 181 CA LYS A 181 223.136 214.908 240.241 1.00 0.00 C +ATOM 182 CA GLY A 182 224.826 218.292 240.692 1.00 0.00 C +ATOM 183 CA ARG A 183 227.009 218.543 243.804 1.00 0.00 C +ATOM 184 CA GLY A 184 229.667 221.154 244.602 1.00 0.00 C +ATOM 185 CA ASN A 185 232.204 223.983 244.328 1.00 0.00 C +ATOM 186 CA HIS A 186 233.635 227.477 243.815 1.00 0.00 C +ATOM 187 CA GLY A 187 231.239 229.659 241.812 1.00 0.00 C +ATOM 188 CA GLU A 188 227.613 229.359 240.682 1.00 0.00 C +TER 189 GLU A 188 +END diff --git a/Plants/Q8H8Q5/Q8H8Q5.dcd b/Plants/Q8H8Q5/Q8H8Q5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..20ccd49ef795bac48f8c8ed123007377e2b661a3 --- /dev/null +++ b/Plants/Q8H8Q5/Q8H8Q5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:1f83daab9bd1d5008fca999da0e5f92b15500b21275145c5275835ffafc897a3 +size 53760276 diff --git a/Plants/Q8H8Q5/top.pdb b/Plants/Q8H8Q5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..ce878e087cbce484469075d24bd5cb33afffc353 --- /dev/null +++ b/Plants/Q8H8Q5/top.pdb @@ -0,0 +1,296 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 214.559 217.527 285.034 1.00 0.00 C +ATOM 2 CA VAL A 2 215.253 213.918 284.031 1.00 0.00 C +ATOM 3 CA THR A 3 212.423 212.133 282.209 1.00 0.00 C +ATOM 4 CA THR A 4 209.244 210.609 283.653 1.00 0.00 C +ATOM 5 CA ARG A 5 205.597 211.580 284.174 1.00 0.00 C +ATOM 6 CA THR A 6 205.175 214.186 286.922 1.00 0.00 C +ATOM 7 CA SER A 7 201.902 214.897 288.737 1.00 0.00 C +ATOM 8 CA GLU A 8 198.593 213.467 287.502 1.00 0.00 C +ATOM 9 CA ARG A 9 196.098 211.637 289.725 1.00 0.00 C +ATOM 10 CA LEU A 10 197.002 211.315 293.412 1.00 0.00 C +ATOM 11 CA PRO A 11 197.106 213.073 296.791 1.00 0.00 C +ATOM 12 CA THR A 12 196.423 216.820 296.724 1.00 0.00 C +ATOM 13 CA PRO A 13 199.498 219.043 297.069 1.00 0.00 C +ATOM 14 CA VAL A 14 202.732 220.481 295.657 1.00 0.00 C +ATOM 15 CA HIS A 15 202.908 223.984 294.169 1.00 0.00 C +ATOM 16 CA GLY A 16 206.520 224.697 293.187 1.00 0.00 C +ATOM 17 CA TYR A 17 208.701 227.255 291.395 1.00 0.00 C +ATOM 18 CA ARG A 18 210.988 228.950 288.863 1.00 0.00 C +ATOM 19 CA GLY A 19 214.761 228.415 288.876 1.00 0.00 C +ATOM 20 CA ARG A 20 218.401 227.907 287.873 1.00 0.00 C +ATOM 21 CA GLN A 21 218.845 225.201 285.228 1.00 0.00 C +ATOM 22 CA GLY A 22 217.246 222.664 282.878 1.00 0.00 C +ATOM 23 CA GLY A 23 217.955 220.807 279.628 1.00 0.00 C +ATOM 24 CA ASN A 24 217.957 219.629 276.004 1.00 0.00 C +ATOM 25 CA VAL A 25 215.191 218.252 273.776 1.00 0.00 C +ATOM 26 CA GLY A 26 212.701 215.492 274.611 1.00 0.00 C +ATOM 27 CA SER A 27 208.957 215.824 275.236 1.00 0.00 C +ATOM 28 CA ARG A 28 205.647 213.988 274.796 1.00 0.00 C +ATOM 29 CA GLN A 29 202.529 216.145 275.172 1.00 0.00 C +ATOM 30 CA ARG A 30 200.588 218.586 277.361 1.00 0.00 C +ATOM 31 CA LEU A 31 199.811 222.111 278.580 1.00 0.00 C +ATOM 32 CA HIS A 32 200.645 225.622 279.801 1.00 0.00 C +ATOM 33 CA GLY A 33 200.729 229.177 281.170 1.00 0.00 C +ATOM 34 CA ASP A 34 198.357 232.155 281.310 1.00 0.00 C +ATOM 35 CA GLU A 35 195.052 231.708 279.468 1.00 0.00 C +ATOM 36 CA ASP A 36 192.943 231.190 276.337 1.00 0.00 C +ATOM 37 CA GLY A 37 192.731 230.384 272.620 1.00 0.00 C +ATOM 38 CA VAL A 38 194.625 230.972 269.366 1.00 0.00 C +ATOM 39 CA GLU A 39 195.860 233.272 266.591 1.00 0.00 C +ATOM 40 CA HIS A 40 196.716 233.091 262.883 1.00 0.00 C +ATOM 41 CA ALA A 41 199.750 231.436 261.280 1.00 0.00 C +ATOM 42 CA ALA A 42 200.967 232.117 257.735 1.00 0.00 C +ATOM 43 CA VAL A 43 203.403 233.308 255.058 1.00 0.00 C +ATOM 44 CA ASN A 44 203.418 236.041 252.404 1.00 0.00 C +ATOM 45 CA PRO A 45 205.365 238.165 249.912 1.00 0.00 C +ATOM 46 CA THR A 46 205.528 240.191 246.689 1.00 0.00 C +ATOM 47 CA THR A 47 207.156 242.045 243.786 1.00 0.00 C +ATOM 48 CA GLU A 48 206.496 245.230 241.801 1.00 0.00 C +ATOM 49 CA ALA A 49 206.850 247.401 238.690 1.00 0.00 C +ATOM 50 CA ALA A 50 203.909 249.022 236.890 1.00 0.00 C +ATOM 51 CA PRO A 51 202.174 247.546 233.836 1.00 0.00 C +ATOM 52 CA ARG A 52 202.377 245.236 230.812 1.00 0.00 C +ATOM 53 CA ASP A 53 199.335 243.070 230.060 1.00 0.00 C +ATOM 54 CA ASP A 54 199.446 239.351 229.237 1.00 0.00 C +ATOM 55 CA GLU A 55 198.501 238.706 225.603 1.00 0.00 C +ATOM 56 CA PRO A 56 201.446 236.811 224.102 1.00 0.00 C +ATOM 57 CA ALA A 57 204.585 236.843 221.943 1.00 0.00 C +ATOM 58 CA ARG A 58 207.316 234.722 223.543 1.00 0.00 C +ATOM 59 CA ARG A 59 210.377 233.748 225.592 1.00 0.00 C +ATOM 60 CA ASN A 60 212.298 230.471 225.887 1.00 0.00 C +ATOM 61 CA GLY A 61 215.019 228.312 224.321 1.00 0.00 C +ATOM 62 CA ARG A 62 218.564 227.062 223.700 1.00 0.00 C +ATOM 63 CA PRO A 63 219.083 223.430 224.725 1.00 0.00 C +ATOM 64 CA GLU A 64 222.291 222.646 226.625 1.00 0.00 C +ATOM 65 CA GLU A 65 225.045 224.803 228.134 1.00 0.00 C +ATOM 66 CA GLY A 66 226.095 224.425 231.777 1.00 0.00 C +ATOM 67 CA MET A 67 227.904 227.548 232.997 1.00 0.00 C +ATOM 68 CA ALA A 68 231.318 228.524 231.618 1.00 0.00 C +ATOM 69 CA MET A 69 234.448 228.864 229.471 1.00 0.00 C +ATOM 70 CA SER A 70 236.910 230.802 227.304 1.00 0.00 C +ATOM 71 CA ALA A 71 236.543 234.513 226.523 1.00 0.00 C +ATOM 72 CA SER A 72 237.328 238.115 227.485 1.00 0.00 C +ATOM 73 CA PRO A 73 240.932 238.266 228.712 1.00 0.00 C +ATOM 74 CA ARG A 74 243.805 240.673 228.026 1.00 0.00 C +ATOM 75 CA ALA A 75 245.942 243.398 226.439 1.00 0.00 C +ATOM 76 CA ARG A 76 246.509 245.298 223.185 1.00 0.00 C +ATOM 77 CA ARG A 77 249.779 247.170 223.753 1.00 0.00 C +ATOM 78 CA LYS A 78 253.035 249.146 223.664 1.00 0.00 C +ATOM 79 CA GLY A 79 253.818 252.199 221.523 1.00 0.00 C +ATOM 80 CA LEU A 80 251.838 255.067 223.061 1.00 0.00 C +ATOM 81 CA PRO A 81 248.036 254.891 222.887 1.00 0.00 C +ATOM 82 CA LYS A 82 246.093 254.897 226.164 1.00 0.00 C +ATOM 83 CA ALA A 83 248.106 253.348 229.004 1.00 0.00 C +ATOM 84 CA THR A 84 245.907 251.570 231.557 1.00 0.00 C +ATOM 85 CA SER A 85 244.563 248.184 230.440 1.00 0.00 C +ATOM 86 CA THR A 86 240.941 248.889 229.493 1.00 0.00 C +ATOM 87 CA ARG A 87 239.782 251.653 231.846 1.00 0.00 C +ATOM 88 CA ARG A 88 237.534 251.643 234.921 1.00 0.00 C +ATOM 89 CA LYS A 89 234.700 250.473 237.183 1.00 0.00 C +ATOM 90 CA LYS A 90 233.650 251.372 240.734 1.00 0.00 C +ATOM 91 CA ARG A 91 233.320 253.784 243.665 1.00 0.00 C +ATOM 92 CA LEU A 92 235.284 256.998 244.234 1.00 0.00 C +ATOM 93 CA ALA A 93 235.589 258.930 247.504 1.00 0.00 C +ATOM 94 CA ARG A 94 237.063 262.427 247.170 1.00 0.00 C +ATOM 95 CA ARG A 95 239.598 262.965 249.963 1.00 0.00 C +ATOM 96 CA TRP A 96 240.792 260.454 252.568 1.00 0.00 C +ATOM 97 CA TRP A 97 243.543 258.035 251.520 1.00 0.00 C +ATOM 98 CA SER A 98 244.636 254.603 252.763 1.00 0.00 C +ATOM 99 CA PRO A 99 247.154 255.242 255.550 1.00 0.00 C +ATOM 100 CA ASP A 100 250.496 253.650 256.453 1.00 0.00 C +ATOM 101 CA GLU A 101 252.367 250.444 255.596 1.00 0.00 C +ATOM 102 CA ASP A 102 255.793 249.729 257.100 1.00 0.00 C +ATOM 103 CA GLY A 103 259.470 250.273 257.938 1.00 0.00 C +ATOM 104 CA ARG A 104 263.190 250.813 257.320 1.00 0.00 C +ATOM 105 CA GLY A 105 263.777 249.571 253.767 1.00 0.00 C +ATOM 106 CA GLU A 106 264.747 248.583 250.217 1.00 0.00 C +ATOM 107 CA ARG A 107 264.596 244.825 249.611 1.00 0.00 C +ATOM 108 CA PRO A 108 263.561 242.908 252.737 1.00 0.00 C +ATOM 109 CA MET A 109 263.729 239.620 254.655 1.00 0.00 C +ATOM 110 CA GLY A 110 266.522 237.540 253.110 1.00 0.00 C +ATOM 111 CA GLY A 111 269.348 239.706 251.754 1.00 0.00 C +ATOM 112 CA GLY A 112 272.437 241.632 250.629 1.00 0.00 C +ATOM 113 CA ALA A 113 276.084 242.614 251.127 1.00 0.00 C +ATOM 114 CA VAL A 114 279.507 242.245 249.494 1.00 0.00 C +ATOM 115 CA ALA A 115 282.430 243.683 247.518 1.00 0.00 C +ATOM 116 CA ALA A 116 284.223 245.344 244.596 1.00 0.00 C +ATOM 117 CA MET A 117 286.725 247.924 243.330 1.00 0.00 C +ATOM 118 CA PRO A 118 285.331 251.247 244.567 1.00 0.00 C +ATOM 119 CA LEU A 119 282.397 252.659 242.589 1.00 0.00 C +ATOM 120 CA ASP A 120 278.968 251.697 241.235 1.00 0.00 C +ATOM 121 CA ALA A 121 277.043 250.421 238.204 1.00 0.00 C +ATOM 122 CA GLY A 122 278.891 247.293 237.057 1.00 0.00 C +ATOM 123 CA GLY A 123 281.767 244.836 237.519 1.00 0.00 C +ATOM 124 CA ASN A 124 285.066 244.188 235.727 1.00 0.00 C +ATOM 125 CA MET A 125 287.136 245.289 232.724 1.00 0.00 C +ATOM 126 CA PRO A 126 287.914 247.383 229.638 1.00 0.00 C +ATOM 127 CA PRO A 127 290.211 247.470 226.600 1.00 0.00 C +ATOM 128 CA VAL A 128 288.970 245.804 223.406 1.00 0.00 C +ATOM 129 CA VAL A 129 286.007 244.962 221.164 1.00 0.00 C +ATOM 130 CA SER A 130 287.354 244.573 217.621 1.00 0.00 C +ATOM 131 CA ALA A 131 284.387 244.022 215.295 1.00 0.00 C +ATOM 132 CA ARG A 132 282.377 241.875 212.873 1.00 0.00 C +ATOM 133 CA ASN A 133 280.703 244.350 210.510 1.00 0.00 C +ATOM 134 CA GLY A 134 279.940 243.652 206.843 1.00 0.00 C +ATOM 135 CA GLY A 135 280.706 242.414 203.321 1.00 0.00 C +ATOM 136 CA ASP A 136 280.217 243.429 199.682 1.00 0.00 C +ATOM 137 CA ALA A 137 280.717 245.336 196.421 1.00 0.00 C +ATOM 138 CA GLY A 138 279.803 249.034 196.473 1.00 0.00 C +ATOM 139 CA GLY A 139 280.644 252.324 198.202 1.00 0.00 C +ATOM 140 CA GLY A 140 281.685 251.412 201.752 1.00 0.00 C +ATOM 141 CA GLU A 141 283.334 248.014 202.252 1.00 0.00 C +ATOM 142 CA ALA A 142 286.078 245.376 202.423 1.00 0.00 C +ATOM 143 CA VAL A 143 289.427 246.944 201.508 1.00 0.00 C +ATOM 144 CA ALA A 144 291.731 249.111 203.633 1.00 0.00 C +ATOM 145 CA THR A 145 291.729 249.512 207.422 1.00 0.00 C +ATOM 146 CA PRO A 146 291.114 253.074 208.628 1.00 0.00 C +ATOM 147 CA ARG A 147 290.132 252.776 212.297 1.00 0.00 C +ATOM 148 CA GLU A 148 289.060 250.512 215.168 1.00 0.00 C +ATOM 149 CA GLU A 149 285.876 250.643 217.257 1.00 0.00 C +ATOM 150 CA THR A 150 282.892 250.328 219.605 1.00 0.00 C +ATOM 151 CA ALA A 151 279.295 249.643 218.553 1.00 0.00 C +ATOM 152 CA ARG A 152 276.453 249.759 216.019 1.00 0.00 C +ATOM 153 CA SER A 153 275.930 247.662 212.881 1.00 0.00 C +ATOM 154 CA ALA A 154 272.697 247.098 210.945 1.00 0.00 C +ATOM 155 CA ASP A 155 270.141 244.513 212.082 1.00 0.00 C +ATOM 156 CA ALA A 156 266.507 244.839 213.180 1.00 0.00 C +ATOM 157 CA ARG A 157 264.003 242.778 211.182 1.00 0.00 C +ATOM 158 CA ALA A 158 260.221 242.559 210.770 1.00 0.00 C +ATOM 159 CA ARG A 159 257.907 245.573 210.496 1.00 0.00 C +ATOM 160 CA GLN A 160 254.245 246.584 210.784 1.00 0.00 C +ATOM 161 CA GLN A 161 252.953 249.679 212.591 1.00 0.00 C +ATOM 162 CA ARG A 162 252.699 253.091 214.267 1.00 0.00 C +ATOM 163 CA ARG A 163 251.389 255.593 216.825 1.00 0.00 C +ATOM 164 CA LEU A 164 249.250 258.742 216.691 1.00 0.00 C +ATOM 165 CA LYS A 165 250.729 261.917 218.190 1.00 0.00 C +ATOM 166 CA VAL A 166 252.436 264.942 219.756 1.00 0.00 C +ATOM 167 CA ALA A 167 251.598 267.436 222.512 1.00 0.00 C +ATOM 168 CA GLY A 168 252.474 266.232 226.019 1.00 0.00 C +ATOM 169 CA ALA A 169 254.482 263.741 228.088 1.00 0.00 C +ATOM 170 CA ARG A 170 254.716 261.440 231.116 1.00 0.00 C +ATOM 171 CA ARG A 171 257.562 258.974 230.536 1.00 0.00 C +ATOM 172 CA GLU A 172 258.912 255.412 230.570 1.00 0.00 C +ATOM 173 CA ARG A 173 261.257 255.189 233.564 1.00 0.00 C +ATOM 174 CA GLY A 174 264.713 255.959 232.156 1.00 0.00 C +ATOM 175 CA ARG A 175 266.668 259.229 232.171 1.00 0.00 C +ATOM 176 CA ARG A 176 264.778 261.499 234.578 1.00 0.00 C +ATOM 177 CA ARG A 177 261.974 264.054 234.228 1.00 0.00 C +ATOM 178 CA GLY A 178 259.193 266.029 232.530 1.00 0.00 C +ATOM 179 CA GLY A 179 258.762 269.792 232.121 1.00 0.00 C +ATOM 180 CA VAL A 180 255.205 270.874 231.287 1.00 0.00 C +ATOM 181 CA GLY A 181 254.210 272.956 228.256 1.00 0.00 C +ATOM 182 CA GLU A 182 257.011 273.967 225.879 1.00 0.00 C +ATOM 183 CA GLU A 183 260.794 274.420 225.810 1.00 0.00 C +ATOM 184 CA ALA A 184 262.885 276.675 223.561 1.00 0.00 C +ATOM 185 CA VAL A 185 262.415 280.447 223.305 1.00 0.00 C +ATOM 186 CA TRP A 186 264.919 282.948 221.896 1.00 0.00 C +ATOM 187 CA GLU A 187 268.456 281.742 221.155 1.00 0.00 C +ATOM 188 CA GLU A 188 271.614 279.627 220.887 1.00 0.00 C +ATOM 189 CA GLU A 189 273.467 277.610 223.535 1.00 0.00 C +ATOM 190 CA ASP A 190 272.891 277.074 227.263 1.00 0.00 C +ATOM 191 CA ASP A 191 274.448 279.634 229.616 1.00 0.00 C +ATOM 192 CA LEU A 192 272.952 282.076 232.129 1.00 0.00 C +ATOM 193 CA GLY A 193 274.203 281.482 235.678 1.00 0.00 C +ATOM 194 CA VAL A 194 274.161 279.649 239.018 1.00 0.00 C +ATOM 195 CA GLY A 195 272.661 281.302 242.106 1.00 0.00 C +ATOM 196 CA PRO A 196 272.970 284.362 244.355 1.00 0.00 C +ATOM 197 CA THR A 197 273.993 283.040 247.778 1.00 0.00 C +ATOM 198 CA TRP A 198 275.336 283.022 251.344 1.00 0.00 C +ATOM 199 CA GLY A 199 274.045 283.699 254.864 1.00 0.00 C +ATOM 200 CA ALA A 200 275.481 283.351 258.376 1.00 0.00 C +ATOM 201 CA ARG A 201 275.245 282.513 262.085 1.00 0.00 C +ATOM 202 CA ALA A 202 271.665 281.858 263.211 1.00 0.00 C +ATOM 203 CA ALA A 203 269.109 279.467 261.705 1.00 0.00 C +ATOM 204 CA ARG A 204 268.750 275.985 263.209 1.00 0.00 C +ATOM 205 CA ALA A 205 268.675 273.292 265.903 1.00 0.00 C +ATOM 206 CA HIS A 206 269.855 270.089 267.595 1.00 0.00 C +ATOM 207 CA VAL A 207 270.156 266.513 266.313 1.00 0.00 C +ATOM 208 CA GLY A 208 271.752 266.431 262.854 1.00 0.00 C +ATOM 209 CA GLY A 209 271.884 270.057 261.694 1.00 0.00 C +ATOM 210 CA ARG A 210 272.972 270.636 258.088 1.00 0.00 C +ATOM 211 CA LEU A 211 276.519 271.971 257.697 1.00 0.00 C +ATOM 212 CA GLY A 212 278.141 274.298 255.153 1.00 0.00 C +ATOM 213 CA GLN A 213 276.241 276.342 252.560 1.00 0.00 C +ATOM 214 CA GLY A 214 272.486 275.695 252.558 1.00 0.00 C +ATOM 215 CA GLY A 215 268.917 274.832 251.543 1.00 0.00 C +ATOM 216 CA ALA A 216 267.659 271.848 253.550 1.00 0.00 C +ATOM 217 CA ALA A 217 266.135 272.691 256.939 1.00 0.00 C +ATOM 218 CA TRP A 218 262.651 271.941 258.286 1.00 0.00 C +ATOM 219 CA ALA A 219 259.158 270.421 258.212 1.00 0.00 C +ATOM 220 CA GLY A 220 255.581 271.013 259.383 1.00 0.00 C +ATOM 221 CA ARG A 221 254.586 269.594 262.776 1.00 0.00 C +ATOM 222 CA LEU A 222 255.051 267.096 265.615 1.00 0.00 C +ATOM 223 CA ALA A 223 257.382 266.540 268.577 1.00 0.00 C +ATOM 224 CA LYS A 224 260.595 264.584 269.186 1.00 0.00 C +ATOM 225 CA GLU A 225 263.664 266.801 269.613 1.00 0.00 C +ATOM 226 CA GLU A 226 266.743 265.798 271.619 1.00 0.00 C +ATOM 227 CA ARG A 227 265.950 263.201 274.292 1.00 0.00 C +ATOM 228 CA ARG A 228 266.002 259.518 275.267 1.00 0.00 C +ATOM 229 CA GLU A 229 262.981 258.681 277.433 1.00 0.00 C +ATOM 230 CA ARG A 230 259.753 257.269 278.882 1.00 0.00 C +ATOM 231 CA ARG A 231 259.065 254.166 276.781 1.00 0.00 C +ATOM 232 CA PRO A 232 257.486 250.856 277.813 1.00 0.00 C +ATOM 233 CA GLY A 233 254.365 248.683 278.043 1.00 0.00 C +ATOM 234 CA GLY A 234 251.448 246.269 277.619 1.00 0.00 C +ATOM 235 CA GLU A 235 249.147 244.092 275.501 1.00 0.00 C +ATOM 236 CA ARG A 236 249.244 244.701 271.741 1.00 0.00 C +ATOM 237 CA GLU A 237 247.906 242.347 269.061 1.00 0.00 C +ATOM 238 CA GLU A 238 246.515 244.018 265.931 1.00 0.00 C +ATOM 239 CA GLU A 239 244.039 243.226 263.146 1.00 0.00 C +ATOM 240 CA GLY A 240 242.317 245.632 260.746 1.00 0.00 C +ATOM 241 CA ALA A 241 244.196 248.750 259.624 1.00 0.00 C +ATOM 242 CA GLY A 242 248.004 248.636 259.636 1.00 0.00 C +ATOM 243 CA PRO A 243 250.530 245.874 260.350 1.00 0.00 C +ATOM 244 CA ARG A 244 253.172 244.957 262.938 1.00 0.00 C +ATOM 245 CA GLY A 245 256.882 244.360 263.566 1.00 0.00 C +ATOM 246 CA LYS A 246 258.244 247.778 264.555 1.00 0.00 C +ATOM 247 CA GLY A 247 258.695 249.224 268.051 1.00 0.00 C +ATOM 248 CA ARG A 248 255.437 248.880 269.997 1.00 0.00 C +ATOM 249 CA PRO A 249 253.252 251.925 270.682 1.00 0.00 C +ATOM 250 CA LYS A 250 252.476 255.385 269.288 1.00 0.00 C +ATOM 251 CA ARG A 251 249.246 256.883 270.644 1.00 0.00 C +ATOM 252 CA ARG A 252 250.024 260.150 272.443 1.00 0.00 C +ATOM 253 CA ARG A 253 252.805 262.658 273.147 1.00 0.00 C +ATOM 254 CA GLU A 254 254.382 265.897 274.389 1.00 0.00 C +ATOM 255 CA ARG A 255 254.364 265.905 278.199 1.00 0.00 C +ATOM 256 CA ARG A 256 258.040 265.731 279.185 1.00 0.00 C +ATOM 257 CA ARG A 257 259.220 264.176 282.457 1.00 0.00 C +ATOM 258 CA GLY A 258 258.293 265.747 285.801 1.00 0.00 C +ATOM 259 CA ARG A 259 255.081 267.163 287.282 1.00 0.00 C +ATOM 260 CA GLU A 260 251.567 265.696 287.173 1.00 0.00 C +ATOM 261 CA ARG A 261 248.470 263.701 286.202 1.00 0.00 C +ATOM 262 CA GLU A 262 246.988 261.135 283.806 1.00 0.00 C +ATOM 263 CA GLY A 263 246.638 257.351 284.083 1.00 0.00 C +ATOM 264 CA GLY A 264 249.752 255.519 282.873 1.00 0.00 C +ATOM 265 CA ARG A 265 252.383 253.937 285.131 1.00 0.00 C +ATOM 266 CA GLU A 266 255.955 252.695 284.673 1.00 0.00 C +ATOM 267 CA ASP A 267 258.870 251.089 286.527 1.00 0.00 C +ATOM 268 CA PHE A 268 262.659 250.705 286.393 1.00 0.00 C +ATOM 269 CA GLY A 269 264.125 249.738 289.774 1.00 0.00 C +ATOM 270 CA ARG A 270 266.639 250.775 292.442 1.00 0.00 C +ATOM 271 CA GLY A 271 269.736 252.926 291.896 1.00 0.00 C +ATOM 272 CA PRO A 272 272.752 255.254 291.884 1.00 0.00 C +ATOM 273 CA ARG A 273 275.546 255.309 289.294 1.00 0.00 C +ATOM 274 CA GLU A 274 277.652 255.411 286.121 1.00 0.00 C +ATOM 275 CA ARG A 275 276.743 257.460 283.040 1.00 0.00 C +ATOM 276 CA GLU A 276 275.661 259.870 280.295 1.00 0.00 C +ATOM 277 CA ARG A 277 272.823 259.888 277.753 1.00 0.00 C +ATOM 278 CA THR A 278 274.502 260.076 274.338 1.00 0.00 C +ATOM 279 CA PHE A 279 274.588 261.123 270.675 1.00 0.00 C +ATOM 280 CA GLY A 280 271.651 259.401 268.965 1.00 0.00 C +ATOM 281 CA PRO A 281 269.950 258.811 265.607 1.00 0.00 C +ATOM 282 CA HIS A 282 267.907 259.806 262.549 1.00 0.00 C +ATOM 283 CA LEU A 283 267.220 256.917 260.163 1.00 0.00 C +ATOM 284 CA ALA A 284 263.980 255.293 261.340 1.00 0.00 C +ATOM 285 CA GLN A 285 260.187 255.477 261.643 1.00 0.00 C +ATOM 286 CA ARG A 286 257.894 257.450 259.326 1.00 0.00 C +ATOM 287 CA ARG A 287 258.769 259.867 256.515 1.00 0.00 C +ATOM 288 CA LYS A 288 258.601 261.558 253.105 1.00 0.00 C +ATOM 289 CA GLU A 289 257.741 261.326 249.400 1.00 0.00 C +ATOM 290 CA ASP A 290 259.545 263.828 247.164 1.00 0.00 C +ATOM 291 CA TYR A 291 260.119 267.447 246.121 1.00 0.00 C +ATOM 292 CA PHE A 292 263.420 268.896 247.355 1.00 0.00 C +TER 293 PHE A 292 +END diff --git a/Plants/Q8H8Q8/Q8H8Q8.dcd b/Plants/Q8H8Q8/Q8H8Q8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..ce871d6abb22448ed41c5823cb54b01521ce307a --- /dev/null +++ b/Plants/Q8H8Q8/Q8H8Q8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:0c46fcb0274af5cd42489cd531d4d10b1ffec5b7946a0eef17d56275793c5e43 +size 9680276 diff --git a/Plants/Q8H8Q8/top.pdb b/Plants/Q8H8Q8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..3a6ac1c1696daec2294b2362f30f5518e03beb32 --- /dev/null +++ b/Plants/Q8H8Q8/top.pdb @@ -0,0 +1,78 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 263.664 229.305 270.696 1.00 0.00 C +ATOM 2 CA ASN A 2 262.349 230.973 273.859 1.00 0.00 C +ATOM 3 CA GLY A 3 263.923 234.442 273.830 1.00 0.00 C +ATOM 4 CA ARG A 4 263.744 235.519 270.179 1.00 0.00 C +ATOM 5 CA ARG A 5 261.053 237.948 269.008 1.00 0.00 C +ATOM 6 CA ARG A 6 257.573 236.620 268.204 1.00 0.00 C +ATOM 7 CA ARG A 7 256.536 237.953 264.789 1.00 0.00 C +ATOM 8 CA ARG A 8 254.974 241.225 263.619 1.00 0.00 C +ATOM 9 CA GLY A 9 253.445 241.312 260.130 1.00 0.00 C +ATOM 10 CA LYS A 10 251.156 243.863 258.467 1.00 0.00 C +ATOM 11 CA GLY A 11 250.768 246.976 260.628 1.00 0.00 C +ATOM 12 CA GLY A 12 248.200 249.161 258.854 1.00 0.00 C +ATOM 13 CA GLY A 13 244.534 250.004 259.459 1.00 0.00 C +ATOM 14 CA SER A 14 243.433 252.252 256.587 1.00 0.00 C +ATOM 15 CA LEU A 15 243.292 252.582 252.794 1.00 0.00 C +ATOM 16 CA ARG A 16 240.502 254.052 250.656 1.00 0.00 C +ATOM 17 CA LEU A 17 238.505 254.685 247.473 1.00 0.00 C +ATOM 18 CA ASP A 18 236.714 252.403 245.004 1.00 0.00 C +ATOM 19 CA ASP A 19 236.291 249.549 242.515 1.00 0.00 C +ATOM 20 CA GLY A 20 232.725 248.976 241.301 1.00 0.00 C +ATOM 21 CA ASP A 21 232.211 245.201 241.227 1.00 0.00 C +ATOM 22 CA SER A 22 229.306 242.964 240.193 1.00 0.00 C +ATOM 23 CA ALA A 23 226.484 245.389 239.374 1.00 0.00 C +ATOM 24 CA PRO A 24 225.846 248.625 237.467 1.00 0.00 C +ATOM 25 CA ALA A 25 227.686 251.960 237.386 1.00 0.00 C +ATOM 26 CA VAL A 26 227.629 255.273 235.504 1.00 0.00 C +ATOM 27 CA ASN A 27 229.598 258.167 237.009 1.00 0.00 C +ATOM 28 CA SER A 28 228.618 261.594 238.353 1.00 0.00 C +ATOM 29 CA ASP A 29 229.301 265.342 238.444 1.00 0.00 C +ATOM 30 CA GLY A 30 232.946 266.193 237.733 1.00 0.00 C +ATOM 31 CA GLU A 31 236.497 265.356 238.834 1.00 0.00 C +ATOM 32 CA GLY A 32 237.073 266.649 242.371 1.00 0.00 C +ATOM 33 CA VAL A 33 238.693 268.018 245.536 1.00 0.00 C +ATOM 34 CA ASP A 34 241.780 269.568 247.144 1.00 0.00 C +ATOM 35 CA GLU A 35 241.975 273.165 245.903 1.00 0.00 C +ATOM 36 CA ASP A 36 243.913 275.568 248.136 1.00 0.00 C +ATOM 37 CA GLY A 37 245.921 278.070 246.080 1.00 0.00 C +ATOM 38 CA ASP A 38 248.360 280.995 245.975 1.00 0.00 C +ATOM 39 CA ALA A 39 252.164 280.889 245.802 1.00 0.00 C +ATOM 40 CA THR A 40 253.573 277.350 245.874 1.00 0.00 C +ATOM 41 CA ALA A 41 255.806 275.606 248.421 1.00 0.00 C +ATOM 42 CA THR A 42 257.979 273.107 250.305 1.00 0.00 C +ATOM 43 CA LYS A 43 258.424 270.657 253.189 1.00 0.00 C +ATOM 44 CA MET A 44 259.490 268.077 255.781 1.00 0.00 C +ATOM 45 CA ALA A 45 258.188 264.678 254.654 1.00 0.00 C +ATOM 46 CA VAL A 46 254.756 263.928 253.178 1.00 0.00 C +ATOM 47 CA PHE A 47 252.783 262.506 250.245 1.00 0.00 C +ATOM 48 CA PRO A 48 253.363 258.972 248.946 1.00 0.00 C +ATOM 49 CA SER A 49 256.461 256.796 248.515 1.00 0.00 C +ATOM 50 CA ASP A 50 255.813 253.534 246.655 1.00 0.00 C +ATOM 51 CA GLY A 51 259.087 252.186 245.250 1.00 0.00 C +ATOM 52 CA ASP A 52 261.162 249.086 244.474 1.00 0.00 C +ATOM 53 CA ASN A 53 263.821 246.857 246.048 1.00 0.00 C +ATOM 54 CA TRP A 54 265.329 243.391 245.569 1.00 0.00 C +ATOM 55 CA SER A 55 264.491 241.297 248.640 1.00 0.00 C +ATOM 56 CA ASP A 56 260.818 240.480 249.238 1.00 0.00 C +ATOM 57 CA GLY A 57 259.375 237.043 248.451 1.00 0.00 C +ATOM 58 CA GLY A 58 259.811 235.503 244.994 1.00 0.00 C +ATOM 59 CA ALA A 59 260.542 232.813 242.396 1.00 0.00 C +ATOM 60 CA ARG A 60 258.586 231.836 239.276 1.00 0.00 C +ATOM 61 CA LEU A 61 255.140 230.797 238.026 1.00 0.00 C +ATOM 62 CA GLU A 62 251.916 232.424 239.241 1.00 0.00 C +ATOM 63 CA ARG A 63 250.238 235.431 240.871 1.00 0.00 C +ATOM 64 CA ARG A 64 250.611 236.510 244.506 1.00 0.00 C +ATOM 65 CA ARG A 65 250.754 233.769 247.149 1.00 0.00 C +ATOM 66 CA ARG A 66 250.846 234.714 250.839 1.00 0.00 C +ATOM 67 CA GLN A 67 251.694 231.790 253.129 1.00 0.00 C +ATOM 68 CA ARG A 68 254.741 231.930 255.412 1.00 0.00 C +ATOM 69 CA ARG A 69 258.408 231.079 256.003 1.00 0.00 C +ATOM 70 CA GLU A 70 261.699 232.869 256.694 1.00 0.00 C +ATOM 71 CA VAL A 71 265.250 234.163 257.173 1.00 0.00 C +ATOM 72 CA THR A 72 265.708 237.834 256.260 1.00 0.00 C +ATOM 73 CA ARG A 73 263.349 240.250 258.023 1.00 0.00 C +ATOM 74 CA CYS A 74 260.609 241.953 260.050 1.00 0.00 C +TER 75 CYS A 74 +END diff --git a/Plants/Q8H8U3/Q8H8U3.dcd b/Plants/Q8H8U3/Q8H8U3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..86e0c9ce2ba07808677a5f0385c329200bcefa9c --- /dev/null +++ b/Plants/Q8H8U3/Q8H8U3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:b3f427759452697bb283fddcf1d105ef91a466dd10d8ca56e42a57a1825ecb97 +size 22040276 diff --git a/Plants/Q8H8U3/top.pdb b/Plants/Q8H8U3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..278b9eafec32d137134e6cbd106136d1e615da4f --- /dev/null +++ b/Plants/Q8H8U3/top.pdb @@ -0,0 +1,181 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 241.735 222.631 268.178 1.00 0.00 C +ATOM 2 CA ALA A 2 241.866 223.673 264.516 1.00 0.00 C +ATOM 3 CA SER A 3 240.339 221.476 261.803 1.00 0.00 C +ATOM 4 CA GLN A 4 238.925 218.922 259.354 1.00 0.00 C +ATOM 5 CA SER A 5 236.914 219.740 256.223 1.00 0.00 C +ATOM 6 CA THR A 6 238.205 222.890 254.511 1.00 0.00 C +ATOM 7 CA LYS A 7 238.899 226.635 254.436 1.00 0.00 C +ATOM 8 CA PRO A 8 239.404 229.933 252.597 1.00 0.00 C +ATOM 9 CA ALA A 9 240.460 233.526 253.303 1.00 0.00 C +ATOM 10 CA GLN A 10 241.434 237.139 254.019 1.00 0.00 C +ATOM 11 CA ALA A 11 243.220 240.240 255.325 1.00 0.00 C +ATOM 12 CA ALA A 12 243.005 243.999 255.913 1.00 0.00 C +ATOM 13 CA ALA A 13 241.082 247.089 257.038 1.00 0.00 C +ATOM 14 CA GLU A 14 238.469 249.681 256.052 1.00 0.00 C +ATOM 15 CA PRO A 15 235.765 251.614 254.189 1.00 0.00 C +ATOM 16 CA SER A 16 235.317 254.192 251.420 1.00 0.00 C +ATOM 17 CA PRO A 17 238.839 255.422 250.642 1.00 0.00 C +ATOM 18 CA PRO A 18 242.239 253.783 250.123 1.00 0.00 C +ATOM 19 CA ALA A 19 243.842 255.593 247.178 1.00 0.00 C +ATOM 20 CA ALA A 20 242.856 257.825 244.252 1.00 0.00 C +ATOM 21 CA THR A 21 242.532 261.603 244.620 1.00 0.00 C +ATOM 22 CA ALA A 22 241.726 265.325 244.740 1.00 0.00 C +ATOM 23 CA ALA A 23 242.291 268.315 242.447 1.00 0.00 C +ATOM 24 CA ALA A 24 245.663 269.883 243.275 1.00 0.00 C +ATOM 25 CA GLY A 25 249.306 269.796 244.389 1.00 0.00 C +ATOM 26 CA GLU A 26 250.664 273.033 245.868 1.00 0.00 C +ATOM 27 CA ALA A 27 250.956 276.493 247.437 1.00 0.00 C +ATOM 28 CA PRO A 28 249.455 279.797 248.596 1.00 0.00 C +ATOM 29 CA PRO A 29 247.445 279.913 251.830 1.00 0.00 C +ATOM 30 CA ALA A 30 245.219 278.215 254.415 1.00 0.00 C +ATOM 31 CA PRO A 31 241.580 277.094 254.273 1.00 0.00 C +ATOM 32 CA ASN A 32 240.790 275.640 257.704 1.00 0.00 C +ATOM 33 CA PRO A 33 240.624 274.235 261.242 1.00 0.00 C +ATOM 34 CA ALA A 34 237.118 274.721 262.652 1.00 0.00 C +ATOM 35 CA SER A 35 234.843 275.920 259.841 1.00 0.00 C +ATOM 36 CA ALA A 36 233.014 276.290 256.519 1.00 0.00 C +ATOM 37 CA ALA A 37 230.252 276.823 253.949 1.00 0.00 C +ATOM 38 CA THR A 38 230.359 277.913 250.299 1.00 0.00 C +ATOM 39 CA PRO A 39 227.168 276.786 248.549 1.00 0.00 C +ATOM 40 CA ALA A 40 226.338 273.905 246.198 1.00 0.00 C +ATOM 41 CA GLN A 41 228.502 271.972 243.729 1.00 0.00 C +ATOM 42 CA ASN A 42 229.085 268.613 242.027 1.00 0.00 C +ATOM 43 CA PRO A 43 230.510 265.832 244.206 1.00 0.00 C +ATOM 44 CA THR A 44 232.596 262.871 243.024 1.00 0.00 C +ATOM 45 CA ALA A 45 233.741 261.138 239.829 1.00 0.00 C +ATOM 46 CA ALA A 46 233.611 257.869 237.876 1.00 0.00 C +ATOM 47 CA ALA A 47 235.387 258.516 234.568 1.00 0.00 C +ATOM 48 CA GLY A 48 238.694 256.640 234.812 1.00 0.00 C +ATOM 49 CA ALA A 49 242.093 258.152 233.988 1.00 0.00 C +ATOM 50 CA ALA A 50 244.007 261.442 234.159 1.00 0.00 C +ATOM 51 CA ALA A 51 246.046 264.200 235.817 1.00 0.00 C +ATOM 52 CA GLY A 52 247.787 267.563 236.241 1.00 0.00 C +ATOM 53 CA GLY A 53 250.093 269.492 233.901 1.00 0.00 C +ATOM 54 CA ALA A 54 249.946 267.733 230.525 1.00 0.00 C +ATOM 55 CA THR A 55 246.678 267.399 228.594 1.00 0.00 C +ATOM 56 CA ASP A 56 246.876 269.558 225.461 1.00 0.00 C +ATOM 57 CA LEU A 57 247.558 272.350 222.961 1.00 0.00 C +ATOM 58 CA GLU A 58 245.987 271.655 219.560 1.00 0.00 C +ATOM 59 CA LYS A 59 242.823 272.230 217.517 1.00 0.00 C +ATOM 60 CA LYS A 60 239.826 270.750 219.347 1.00 0.00 C +ATOM 61 CA MET A 61 237.808 268.212 221.347 1.00 0.00 C +ATOM 62 CA ARG A 62 237.606 268.319 225.150 1.00 0.00 C +ATOM 63 CA ARG A 63 239.681 265.730 227.023 1.00 0.00 C +ATOM 64 CA ALA A 64 241.506 262.646 228.317 1.00 0.00 C +ATOM 65 CA GLU A 65 244.241 261.820 225.796 1.00 0.00 C +ATOM 66 CA ARG A 66 248.013 261.285 225.809 1.00 0.00 C +ATOM 67 CA PHE A 67 250.463 259.405 228.040 1.00 0.00 C +ATOM 68 CA GLY A 68 254.104 259.656 229.134 1.00 0.00 C +ATOM 69 CA THR A 69 254.990 263.342 228.756 1.00 0.00 C +ATOM 70 CA ALA A 70 255.503 265.662 231.734 1.00 0.00 C +ATOM 71 CA VAL A 71 256.281 265.438 235.457 1.00 0.00 C +ATOM 72 CA VAL A 72 254.220 263.901 238.270 1.00 0.00 C +ATOM 73 CA MET A 73 256.126 262.780 241.373 1.00 0.00 C +ATOM 74 CA SER A 74 256.014 258.974 241.224 1.00 0.00 C +ATOM 75 CA GLU A 75 257.689 258.134 237.907 1.00 0.00 C +ATOM 76 CA GLU A 76 255.792 255.467 235.956 1.00 0.00 C +ATOM 77 CA GLU A 77 252.729 255.224 233.704 1.00 0.00 C +ATOM 78 CA LYS A 78 253.048 253.691 230.231 1.00 0.00 C +ATOM 79 CA ARG A 79 254.673 250.917 228.186 1.00 0.00 C +ATOM 80 CA SER A 80 257.871 249.242 229.403 1.00 0.00 C +ATOM 81 CA SER A 81 258.601 245.701 230.605 1.00 0.00 C +ATOM 82 CA ARG A 82 255.424 243.681 230.022 1.00 0.00 C +ATOM 83 CA ALA A 83 255.588 241.966 226.624 1.00 0.00 C +ATOM 84 CA GLU A 84 257.980 239.049 226.092 1.00 0.00 C +ATOM 85 CA ARG A 85 256.361 235.632 226.565 1.00 0.00 C +ATOM 86 CA PHE A 86 253.283 233.857 227.939 1.00 0.00 C +ATOM 87 CA GLY A 87 250.589 236.473 228.584 1.00 0.00 C +ATOM 88 CA THR A 88 247.832 237.224 231.104 1.00 0.00 C +ATOM 89 CA GLY A 89 246.971 240.414 233.000 1.00 0.00 C +ATOM 90 CA SER A 90 248.550 243.729 234.018 1.00 0.00 C +ATOM 91 CA SER A 91 247.131 246.536 236.168 1.00 0.00 C +ATOM 92 CA ASN A 92 243.546 247.138 237.308 1.00 0.00 C +ATOM 93 CA GLU A 93 240.077 246.707 235.792 1.00 0.00 C +ATOM 94 CA LYS A 94 238.599 243.207 236.076 1.00 0.00 C +ATOM 95 CA ALA A 95 239.352 240.429 238.573 1.00 0.00 C +ATOM 96 CA GLU A 96 238.862 237.680 241.164 1.00 0.00 C +ATOM 97 CA GLU A 97 238.724 234.180 239.666 1.00 0.00 C +ATOM 98 CA GLN A 98 239.566 230.625 240.746 1.00 0.00 C +ATOM 99 CA LYS A 99 241.815 227.940 242.246 1.00 0.00 C +ATOM 100 CA ARG A 100 245.299 227.162 240.915 1.00 0.00 C +ATOM 101 CA LYS A 101 246.364 223.723 242.162 1.00 0.00 C +ATOM 102 CA SER A 102 247.396 220.180 241.216 1.00 0.00 C +ATOM 103 CA ARG A 103 248.082 219.043 237.645 1.00 0.00 C +ATOM 104 CA ALA A 104 249.738 219.139 234.215 1.00 0.00 C +ATOM 105 CA GLU A 105 251.710 221.546 232.017 1.00 0.00 C +ATOM 106 CA ARG A 106 254.518 222.150 229.514 1.00 0.00 C +ATOM 107 CA PHE A 107 254.885 221.586 225.763 1.00 0.00 C +ATOM 108 CA GLY A 108 257.775 220.036 223.824 1.00 0.00 C +ATOM 109 CA LEU A 109 260.757 222.408 223.760 1.00 0.00 C +ATOM 110 CA ALA A 110 263.755 224.758 223.823 1.00 0.00 C +ATOM 111 CA SER A 111 265.935 226.728 221.398 1.00 0.00 C +ATOM 112 CA SER A 112 267.510 229.992 222.574 1.00 0.00 C +ATOM 113 CA SER A 113 265.306 232.205 224.756 1.00 0.00 C +ATOM 114 CA ALA A 114 264.770 233.345 228.352 1.00 0.00 C +ATOM 115 CA ASP A 115 261.532 233.095 230.346 1.00 0.00 C +ATOM 116 CA GLU A 116 260.699 234.781 233.659 1.00 0.00 C +ATOM 117 CA ASP A 117 262.614 236.564 236.428 1.00 0.00 C +ATOM 118 CA ALA A 118 262.318 239.664 238.623 1.00 0.00 C +ATOM 119 CA LYS A 119 258.752 240.937 239.046 1.00 0.00 C +ATOM 120 CA LYS A 120 255.975 242.273 236.805 1.00 0.00 C +ATOM 121 CA LYS A 121 254.659 245.775 236.085 1.00 0.00 C +ATOM 122 CA ALA A 122 254.545 247.464 239.498 1.00 0.00 C +ATOM 123 CA ARG A 123 255.022 251.081 240.596 1.00 0.00 C +ATOM 124 CA LEU A 124 254.459 251.805 244.294 1.00 0.00 C +ATOM 125 CA GLU A 125 251.672 253.633 246.139 1.00 0.00 C +ATOM 126 CA ARG A 126 251.836 254.751 249.778 1.00 0.00 C +ATOM 127 CA PHE A 127 254.901 254.320 251.999 1.00 0.00 C +ATOM 128 CA GLY A 128 256.110 254.163 255.609 1.00 0.00 C +ATOM 129 CA GLN A 129 259.688 255.469 255.542 1.00 0.00 C +ATOM 130 CA SER A 130 262.501 255.265 252.980 1.00 0.00 C +ATOM 131 CA THR A 131 263.053 257.202 249.747 1.00 0.00 C +ATOM 132 CA ASN A 132 260.462 255.992 247.228 1.00 0.00 C +ATOM 133 CA VAL A 133 260.491 252.612 245.471 1.00 0.00 C +ATOM 134 CA ASP A 134 259.798 248.988 244.521 1.00 0.00 C +ATOM 135 CA LYS A 135 262.798 247.001 243.269 1.00 0.00 C +ATOM 136 CA GLY A 136 265.520 246.674 245.914 1.00 0.00 C +ATOM 137 CA GLU A 137 263.786 247.208 249.265 1.00 0.00 C +ATOM 138 CA GLU A 138 266.310 247.986 252.011 1.00 0.00 C +ATOM 139 CA GLU A 139 265.072 246.740 255.392 1.00 0.00 C +ATOM 140 CA LYS A 140 261.505 247.336 256.589 1.00 0.00 C +ATOM 141 CA ARG A 141 259.436 248.209 253.511 1.00 0.00 C +ATOM 142 CA LYS A 142 255.650 247.867 253.762 1.00 0.00 C +ATOM 143 CA ALA A 143 253.617 246.590 256.721 1.00 0.00 C +ATOM 144 CA ARG A 144 251.336 243.591 256.159 1.00 0.00 C +ATOM 145 CA ALA A 145 248.744 241.600 258.117 1.00 0.00 C +ATOM 146 CA LEU A 146 248.411 242.487 261.807 1.00 0.00 C +ATOM 147 CA ARG A 147 250.578 243.490 264.775 1.00 0.00 C +ATOM 148 CA PHE A 148 251.779 246.868 266.066 1.00 0.00 C +ATOM 149 CA ALA A 149 249.991 250.049 267.161 1.00 0.00 C +ATOM 150 CA GLU A 150 250.100 252.743 269.853 1.00 0.00 C +ATOM 151 CA THR A 151 249.211 253.263 273.521 1.00 0.00 C +ATOM 152 CA SER A 152 249.836 254.509 277.067 1.00 0.00 C +ATOM 153 CA SER A 153 248.626 258.061 277.726 1.00 0.00 C +ATOM 154 CA GLY A 154 246.997 258.863 281.076 1.00 0.00 C +ATOM 155 CA PRO A 155 246.333 257.215 284.446 1.00 0.00 C +ATOM 156 CA SER A 156 245.450 254.669 287.140 1.00 0.00 C +ATOM 157 CA GLN A 157 244.857 251.108 285.922 1.00 0.00 C +ATOM 158 CA GLU A 158 244.597 248.050 288.180 1.00 0.00 C +ATOM 159 CA ASN A 159 245.796 245.033 290.173 1.00 0.00 C +ATOM 160 CA GLY A 160 249.505 245.084 291.043 1.00 0.00 C +ATOM 161 CA LYS A 161 253.096 245.651 292.184 1.00 0.00 C +ATOM 162 CA ASP A 162 256.840 245.035 292.522 1.00 0.00 C +ATOM 163 CA SER A 163 257.288 242.335 295.173 1.00 0.00 C +ATOM 164 CA SER A 164 254.915 239.395 295.663 1.00 0.00 C +ATOM 165 CA LYS A 165 254.428 236.699 298.311 1.00 0.00 C +ATOM 166 CA PRO A 166 256.043 235.637 301.594 1.00 0.00 C +ATOM 167 CA THR A 167 259.840 235.833 301.345 1.00 0.00 C +ATOM 168 CA GLN A 168 263.616 236.271 301.607 1.00 0.00 C +ATOM 169 CA ASP A 169 267.349 236.904 302.034 1.00 0.00 C +ATOM 170 CA ALA A 170 267.908 238.480 305.457 1.00 0.00 C +ATOM 171 CA ALA A 171 271.313 240.170 305.720 1.00 0.00 C +ATOM 172 CA THR A 172 273.253 243.376 305.028 1.00 0.00 C +ATOM 173 CA VAL A 173 275.040 244.160 308.301 1.00 0.00 C +ATOM 174 CA ALA A 174 277.056 247.297 307.522 1.00 0.00 C +ATOM 175 CA GLY A 175 278.027 250.447 305.612 1.00 0.00 C +ATOM 176 CA THR A 176 281.439 252.077 306.078 1.00 0.00 C +ATOM 177 CA ALA A 177 282.614 252.418 309.686 1.00 0.00 C +TER 178 ALA A 177 +END diff --git a/Plants/Q8HS18/Q8HS18.dcd b/Plants/Q8HS18/Q8HS18.dcd new file mode 100644 index 0000000000000000000000000000000000000000..0fc13814cb39ae1d80da9ad8f433b41ee1493586 --- /dev/null +++ b/Plants/Q8HS18/Q8HS18.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:071f592cc590404edce247ca793abe5a558bfd9535f900b8efe886bce92fb4b7 +size 5120276 diff --git a/Plants/Q8HS18/top.pdb b/Plants/Q8HS18/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..fe2a38261475f6c18591d73f91e5ab86db496fc1 --- /dev/null +++ b/Plants/Q8HS18/top.pdb @@ -0,0 +1,40 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 260.280 250.116 252.455 1.00 0.00 C +ATOM 2 CA ALA A 2 263.966 249.388 251.826 1.00 0.00 C +ATOM 3 CA THR A 3 265.476 246.706 254.071 1.00 0.00 C +ATOM 4 CA GLN A 4 264.932 243.016 254.850 1.00 0.00 C +ATOM 5 CA THR A 5 263.586 239.641 253.703 1.00 0.00 C +ATOM 6 CA VAL A 6 259.808 239.395 254.123 1.00 0.00 C +ATOM 7 CA GLU A 7 257.025 237.637 252.204 1.00 0.00 C +ATOM 8 CA GLY A 8 255.513 235.814 249.219 1.00 0.00 C +ATOM 9 CA GLY A 9 253.415 238.218 247.136 1.00 0.00 C +ATOM 10 CA SER A 10 252.493 241.275 249.215 1.00 0.00 C +ATOM 11 CA ARG A 11 251.010 244.533 247.911 1.00 0.00 C +ATOM 12 CA SER A 12 249.074 246.200 250.737 1.00 0.00 C +ATOM 13 CA GLY A 13 249.078 247.005 254.461 1.00 0.00 C +ATOM 14 CA PRO A 14 251.412 244.795 256.507 1.00 0.00 C +ATOM 15 CA ARG A 15 254.083 244.646 259.221 1.00 0.00 C +ATOM 16 CA ARG A 16 254.630 247.777 261.321 1.00 0.00 C +ATOM 17 CA THR A 17 251.561 250.005 260.957 1.00 0.00 C +ATOM 18 CA ASN A 18 249.046 252.547 262.272 1.00 0.00 C +ATOM 19 CA VAL A 19 245.618 252.919 260.649 1.00 0.00 C +ATOM 20 CA GLY A 20 243.184 251.726 257.973 1.00 0.00 C +ATOM 21 CA SER A 21 242.257 254.716 255.801 1.00 0.00 C +ATOM 22 CA LEU A 22 244.627 256.088 253.153 1.00 0.00 C +ATOM 23 CA LEU A 23 247.633 258.093 254.361 1.00 0.00 C +ATOM 24 CA LYS A 24 251.433 257.826 254.425 1.00 0.00 C +ATOM 25 CA PRO A 25 253.596 259.098 251.559 1.00 0.00 C +ATOM 26 CA LEU A 26 253.739 257.192 248.264 1.00 0.00 C +ATOM 27 CA ASN A 27 252.392 257.509 244.714 1.00 0.00 C +ATOM 28 CA SER A 28 248.892 256.543 243.560 1.00 0.00 C +ATOM 29 CA GLU A 29 245.925 258.107 241.752 1.00 0.00 C +ATOM 30 CA TYR A 30 242.697 259.900 242.689 1.00 0.00 C +ATOM 31 CA GLY A 31 239.296 258.183 242.720 1.00 0.00 C +ATOM 32 CA LYS A 32 238.243 255.493 240.237 1.00 0.00 C +ATOM 33 CA VAL A 33 235.498 255.408 237.596 1.00 0.00 C +ATOM 34 CA ALA A 34 235.169 252.316 235.393 1.00 0.00 C +ATOM 35 CA PRO A 35 235.182 251.196 231.752 1.00 0.00 C +ATOM 36 CA GLY A 36 238.229 248.974 231.213 1.00 0.00 C +TER 37 GLY A 36 +END diff --git a/Plants/Q8HS31/Q8HS31.dcd b/Plants/Q8HS31/Q8HS31.dcd new file mode 100644 index 0000000000000000000000000000000000000000..17fa205b13fa44ab920456b0ab9b3f635d0ff1e4 --- /dev/null +++ b/Plants/Q8HS31/Q8HS31.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:6b83851fde06ac4cf0a7ed56e6b62b090f90d61e3dca90d2176dc9fb9f65112b +size 5120276 diff --git a/Plants/Q8HS31/top.pdb b/Plants/Q8HS31/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..8d23a0e2cda7d3441481c89b67413ba35f66b505 --- /dev/null +++ b/Plants/Q8HS31/top.pdb @@ -0,0 +1,40 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 261.535 252.519 243.750 1.00 0.00 C +ATOM 2 CA ALA A 2 258.429 252.377 241.548 1.00 0.00 C +ATOM 3 CA THR A 3 254.792 253.436 241.145 1.00 0.00 C +ATOM 4 CA GLN A 4 251.196 254.169 242.171 1.00 0.00 C +ATOM 5 CA THR A 5 247.586 253.644 241.072 1.00 0.00 C +ATOM 6 CA VAL A 6 246.537 250.878 238.672 1.00 0.00 C +ATOM 7 CA GLU A 7 246.672 247.087 238.315 1.00 0.00 C +ATOM 8 CA ASP A 8 246.255 244.703 241.258 1.00 0.00 C +ATOM 9 CA SER A 9 244.418 246.671 243.954 1.00 0.00 C +ATOM 10 CA SER A 10 241.785 248.395 246.103 1.00 0.00 C +ATOM 11 CA LYS A 11 241.749 251.665 248.056 1.00 0.00 C +ATOM 12 CA SER A 12 238.938 253.785 249.512 1.00 0.00 C +ATOM 13 CA ARG A 13 235.568 255.032 248.244 1.00 0.00 C +ATOM 14 CA PRO A 14 234.881 258.779 248.285 1.00 0.00 C +ATOM 15 CA ARG A 15 233.576 260.851 251.204 1.00 0.00 C +ATOM 16 CA GLN A 16 235.466 259.725 254.314 1.00 0.00 C +ATOM 17 CA THR A 17 238.358 258.003 256.101 1.00 0.00 C +ATOM 18 CA ASN A 18 240.844 260.470 257.602 1.00 0.00 C +ATOM 19 CA ILE A 19 244.248 258.823 258.061 1.00 0.00 C +ATOM 20 CA GLY A 20 244.100 255.258 259.397 1.00 0.00 C +ATOM 21 CA SER A 21 243.759 252.113 261.520 1.00 0.00 C +ATOM 22 CA LEU A 22 247.044 250.234 261.077 1.00 0.00 C +ATOM 23 CA LEU A 23 246.496 246.496 260.591 1.00 0.00 C +ATOM 24 CA LYS A 24 248.499 243.341 261.336 1.00 0.00 C +ATOM 25 CA PRO A 25 249.460 240.631 258.837 1.00 0.00 C +ATOM 26 CA LEU A 26 253.105 240.114 257.856 1.00 0.00 C +ATOM 27 CA ASN A 27 254.736 239.620 254.448 1.00 0.00 C +ATOM 28 CA SER A 28 256.349 237.877 251.469 1.00 0.00 C +ATOM 29 CA GLU A 29 258.664 239.544 248.944 1.00 0.00 C +ATOM 30 CA TYR A 30 257.952 242.472 246.613 1.00 0.00 C +ATOM 31 CA GLY A 31 258.562 245.588 248.719 1.00 0.00 C +ATOM 32 CA LYS A 32 261.225 248.306 248.518 1.00 0.00 C +ATOM 33 CA VAL A 33 264.791 247.408 247.520 1.00 0.00 C +ATOM 34 CA ALA A 34 268.335 248.238 248.643 1.00 0.00 C +ATOM 35 CA PRO A 35 271.762 249.030 247.179 1.00 0.00 C +ATOM 36 CA GLY A 36 272.324 252.716 247.965 1.00 0.00 C +TER 37 GLY A 36 +END diff --git a/Plants/Q8HS38/Q8HS38.dcd b/Plants/Q8HS38/Q8HS38.dcd new file mode 100644 index 0000000000000000000000000000000000000000..e05c21e8a835a05d6f81c69815962a1b2439e3d8 --- /dev/null +++ b/Plants/Q8HS38/Q8HS38.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5df2ac63460fb2d5c1d640260f10b5ac0bb1478a51b6cd6101ec800ba662f4a6 +size 5120276 diff --git a/Plants/Q8HS38/top.pdb b/Plants/Q8HS38/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..c11013c799e761b0a6ad0ce06852d1f21839ce48 --- /dev/null +++ b/Plants/Q8HS38/top.pdb @@ -0,0 +1,40 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 257.835 272.450 240.481 1.00 0.00 C +ATOM 2 CA ALA A 2 255.996 274.890 242.757 1.00 0.00 C +ATOM 3 CA THR A 3 253.020 275.059 245.130 1.00 0.00 C +ATOM 4 CA GLN A 4 253.949 272.901 248.129 1.00 0.00 C +ATOM 5 CA THR A 5 254.191 269.438 249.700 1.00 0.00 C +ATOM 6 CA VAL A 6 252.927 269.544 253.293 1.00 0.00 C +ATOM 7 CA ASN A 7 249.626 269.610 255.195 1.00 0.00 C +ATOM 8 CA ASP A 8 247.352 268.902 258.169 1.00 0.00 C +ATOM 9 CA THR A 9 247.120 265.993 260.619 1.00 0.00 C +ATOM 10 CA SER A 10 247.777 262.384 259.590 1.00 0.00 C +ATOM 11 CA ARG A 11 247.066 259.523 257.177 1.00 0.00 C +ATOM 12 CA THR A 12 249.701 256.845 257.807 1.00 0.00 C +ATOM 13 CA ARG A 13 249.742 254.212 255.053 1.00 0.00 C +ATOM 14 CA PRO A 14 249.697 254.964 251.318 1.00 0.00 C +ATOM 15 CA ARG A 15 248.753 253.080 248.144 1.00 0.00 C +ATOM 16 CA LYS A 16 246.561 254.502 245.371 1.00 0.00 C +ATOM 17 CA THR A 17 246.304 255.348 241.665 1.00 0.00 C +ATOM 18 CA GLY A 18 248.379 252.807 239.729 1.00 0.00 C +ATOM 19 CA VAL A 19 247.276 249.264 238.863 1.00 0.00 C +ATOM 20 CA GLY A 20 249.544 246.213 238.600 1.00 0.00 C +ATOM 21 CA SER A 21 250.745 242.991 236.960 1.00 0.00 C +ATOM 22 CA TYR A 22 249.258 240.039 238.855 1.00 0.00 C +ATOM 23 CA LEU A 23 249.048 236.258 238.437 1.00 0.00 C +ATOM 24 CA LYS A 24 248.556 232.870 240.110 1.00 0.00 C +ATOM 25 CA PRO A 25 251.965 231.405 240.975 1.00 0.00 C +ATOM 26 CA LEU A 26 253.116 229.082 243.767 1.00 0.00 C +ATOM 27 CA ASN A 27 250.590 228.104 246.446 1.00 0.00 C +ATOM 28 CA ARG A 28 251.326 226.115 249.612 1.00 0.00 C +ATOM 29 CA GLU A 29 251.504 228.130 252.841 1.00 0.00 C +ATOM 30 CA TYR A 30 253.036 230.946 254.900 1.00 0.00 C +ATOM 31 CA GLY A 31 250.577 231.981 257.620 1.00 0.00 C +ATOM 32 CA LYS A 32 249.880 234.619 260.279 1.00 0.00 C +ATOM 33 CA VAL A 33 247.820 237.258 262.097 1.00 0.00 C +ATOM 34 CA ALA A 34 246.120 240.631 262.597 1.00 0.00 C +ATOM 35 CA PRO A 35 246.430 244.428 262.620 1.00 0.00 C +ATOM 36 CA GLY A 36 247.215 247.216 265.095 1.00 0.00 C +TER 37 GLY A 36 +END diff --git a/Plants/Q8L4I9/Q8L4I9.dcd b/Plants/Q8L4I9/Q8L4I9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..248df875e14dd185748609f505a38d4a05a2dee5 --- /dev/null +++ b/Plants/Q8L4I9/Q8L4I9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:26a3ef4f9139376701357276f573df55156d02958b14a48a3945551e18c36a6d +size 17120276 diff --git a/Plants/Q8L4I9/top.pdb b/Plants/Q8L4I9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..61b8704ad06ac6859fd8b69124144ae7613b30fe --- /dev/null +++ b/Plants/Q8L4I9/top.pdb @@ -0,0 +1,140 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 204.235 280.457 239.593 1.00 0.00 C +ATOM 2 CA ALA A 2 202.338 277.171 239.935 1.00 0.00 C +ATOM 3 CA ASP A 3 204.785 274.260 239.688 1.00 0.00 C +ATOM 4 CA ARG A 4 208.314 274.485 241.105 1.00 0.00 C +ATOM 5 CA VAL A 5 211.466 273.013 239.551 1.00 0.00 C +ATOM 6 CA HIS A 6 215.257 273.388 239.470 1.00 0.00 C +ATOM 7 CA PRO A 7 217.883 274.666 241.916 1.00 0.00 C +ATOM 8 CA MET A 8 219.150 273.419 245.286 1.00 0.00 C +ATOM 9 CA PRO A 9 219.480 269.869 246.628 1.00 0.00 C +ATOM 10 CA ALA A 10 222.545 268.164 245.141 1.00 0.00 C +ATOM 11 CA PRO A 11 223.122 264.994 247.174 1.00 0.00 C +ATOM 12 CA PRO A 12 224.615 261.783 248.581 1.00 0.00 C +ATOM 13 CA LEU A 13 225.315 258.208 247.466 1.00 0.00 C +ATOM 14 CA PRO A 14 225.002 254.667 248.836 1.00 0.00 C +ATOM 15 CA SER A 15 226.879 252.158 251.002 1.00 0.00 C +ATOM 16 CA SER A 16 225.626 249.278 253.160 1.00 0.00 C +ATOM 17 CA SER A 17 223.000 246.864 254.498 1.00 0.00 C +ATOM 18 CA PRO A 18 220.042 247.760 256.727 1.00 0.00 C +ATOM 19 CA PRO A 19 217.178 246.983 259.116 1.00 0.00 C +ATOM 20 CA PRO A 20 218.327 247.822 262.650 1.00 0.00 C +ATOM 21 CA GLY A 21 221.628 247.203 264.449 1.00 0.00 C +ATOM 22 CA HIS A 22 225.242 248.406 264.520 1.00 0.00 C +ATOM 23 CA ASP A 23 226.735 248.740 261.030 1.00 0.00 C +ATOM 24 CA ALA A 24 230.209 249.979 260.076 1.00 0.00 C +ATOM 25 CA ALA A 25 233.696 248.514 259.620 1.00 0.00 C +ATOM 26 CA THR A 26 234.118 244.825 258.767 1.00 0.00 C +ATOM 27 CA ALA A 27 233.299 241.288 259.920 1.00 0.00 C +ATOM 28 CA ALA A 28 231.779 241.197 263.412 1.00 0.00 C +ATOM 29 CA ALA A 29 232.034 241.106 267.213 1.00 0.00 C +ATOM 30 CA ALA A 30 231.606 240.490 270.948 1.00 0.00 C +ATOM 31 CA THR A 31 232.925 243.291 273.169 1.00 0.00 C +ATOM 32 CA GLY A 32 236.455 244.673 272.782 1.00 0.00 C +ATOM 33 CA THR A 33 239.020 244.839 269.970 1.00 0.00 C +ATOM 34 CA THR A 34 240.493 241.877 268.080 1.00 0.00 C +ATOM 35 CA PRO A 35 241.829 240.595 264.751 1.00 0.00 C +ATOM 36 CA LEU A 36 244.262 237.665 264.629 1.00 0.00 C +ATOM 37 CA HIS A 37 248.011 237.423 265.262 1.00 0.00 C +ATOM 38 CA PRO A 38 249.724 236.091 262.130 1.00 0.00 C +ATOM 39 CA SER A 39 253.107 235.388 260.525 1.00 0.00 C +ATOM 40 CA PHE A 40 254.550 232.417 258.626 1.00 0.00 C +ATOM 41 CA ARG A 41 255.615 230.615 255.442 1.00 0.00 C +ATOM 42 CA GLY A 42 252.982 228.979 253.227 1.00 0.00 C +ATOM 43 CA ALA A 43 253.635 227.256 249.893 1.00 0.00 C +ATOM 44 CA PRO A 44 253.309 223.648 248.713 1.00 0.00 C +ATOM 45 CA PRO A 45 254.694 222.732 245.283 1.00 0.00 C +ATOM 46 CA PRO A 46 256.103 225.202 242.748 1.00 0.00 C +ATOM 47 CA SER A 47 259.832 224.455 242.530 1.00 0.00 C +ATOM 48 CA PRO A 48 262.169 223.235 239.779 1.00 0.00 C +ATOM 49 CA SER A 49 260.836 223.158 236.210 1.00 0.00 C +ATOM 50 CA THR A 50 261.057 221.546 232.765 1.00 0.00 C +ATOM 51 CA TYR A 51 260.712 220.439 229.136 1.00 0.00 C +ATOM 52 CA ILE A 52 257.254 221.523 227.959 1.00 0.00 C +ATOM 53 CA ILE A 53 255.431 223.166 230.873 1.00 0.00 C +ATOM 54 CA GLN A 54 254.605 225.318 233.906 1.00 0.00 C +ATOM 55 CA ILE A 55 256.545 228.218 235.437 1.00 0.00 C +ATOM 56 CA PRO A 56 257.703 231.733 234.531 1.00 0.00 C +ATOM 57 CA LYS A 57 256.295 235.080 235.685 1.00 0.00 C +ATOM 58 CA ASP A 58 253.033 236.459 237.090 1.00 0.00 C +ATOM 59 CA GLN A 59 252.964 238.980 239.946 1.00 0.00 C +ATOM 60 CA VAL A 60 255.845 241.057 241.327 1.00 0.00 C +ATOM 61 CA LEU A 61 254.672 244.305 242.937 1.00 0.00 C +ATOM 62 CA ARG A 62 251.253 244.722 244.565 1.00 0.00 C +ATOM 63 CA VAL A 63 250.680 246.998 247.567 1.00 0.00 C +ATOM 64 CA PRO A 64 247.107 246.859 248.881 1.00 0.00 C +ATOM 65 CA PRO A 65 245.813 250.344 249.715 1.00 0.00 C +ATOM 66 CA PRO A 66 243.369 250.842 252.594 1.00 0.00 C +ATOM 67 CA ASP A 67 243.073 253.652 255.150 1.00 0.00 C +ATOM 68 CA ARG A 68 240.438 256.004 253.720 1.00 0.00 C +ATOM 69 CA ALA A 69 238.563 259.069 252.454 1.00 0.00 C +ATOM 70 CA ALA A 70 235.694 257.858 250.261 1.00 0.00 C +ATOM 71 CA ARG A 71 233.742 258.082 246.996 1.00 0.00 C +ATOM 72 CA LYS A 72 233.370 255.119 244.630 1.00 0.00 C +ATOM 73 CA PRO A 73 234.670 256.390 241.281 1.00 0.00 C +ATOM 74 CA PRO A 74 237.699 257.050 239.066 1.00 0.00 C +ATOM 75 CA PRO A 75 240.986 258.973 238.963 1.00 0.00 C +ATOM 76 CA ALA A 76 243.964 256.597 238.898 1.00 0.00 C +ATOM 77 CA PRO A 77 246.951 257.253 241.171 1.00 0.00 C +ATOM 78 CA PRO A 78 249.414 258.965 243.519 1.00 0.00 C +ATOM 79 CA ARG A 79 251.219 256.132 245.317 1.00 0.00 C +ATOM 80 CA VAL A 80 252.073 252.520 244.455 1.00 0.00 C +ATOM 81 CA LEU A 81 253.506 252.339 240.929 1.00 0.00 C +ATOM 82 CA CYS A 82 250.824 251.833 238.270 1.00 0.00 C +ATOM 83 CA ARG A 83 247.951 250.724 236.027 1.00 0.00 C +ATOM 84 CA LEU A 84 248.546 249.792 232.381 1.00 0.00 C +ATOM 85 CA GLN A 85 250.759 247.607 230.180 1.00 0.00 C +ATOM 86 CA ARG A 86 254.155 248.857 228.987 1.00 0.00 C +ATOM 87 CA VAL A 87 257.544 247.514 227.879 1.00 0.00 C +ATOM 88 CA PRO A 88 261.199 248.587 227.861 1.00 0.00 C +ATOM 89 CA PRO A 89 264.871 249.137 228.716 1.00 0.00 C +ATOM 90 CA PRO A 90 267.249 250.347 231.436 1.00 0.00 C +ATOM 91 CA GLY A 91 268.298 251.384 234.949 1.00 0.00 C +ATOM 92 CA PRO A 92 266.575 254.237 236.794 1.00 0.00 C +ATOM 93 CA PRO A 93 263.787 253.683 239.331 1.00 0.00 C +ATOM 94 CA ARG A 94 264.194 252.107 242.776 1.00 0.00 C +ATOM 95 CA ARG A 95 262.047 252.062 245.923 1.00 0.00 C +ATOM 96 CA ARG A 96 258.470 251.823 247.214 1.00 0.00 C +ATOM 97 CA PRO A 97 256.397 252.973 250.196 1.00 0.00 C +ATOM 98 CA VAL A 98 252.796 252.417 251.311 1.00 0.00 C +ATOM 99 CA ALA A 99 250.090 254.254 253.265 1.00 0.00 C +ATOM 100 CA ARG A 100 250.118 258.014 252.648 1.00 0.00 C +ATOM 101 CA VAL A 101 251.398 260.347 249.921 1.00 0.00 C +ATOM 102 CA PRO A 102 253.926 262.400 247.944 1.00 0.00 C +ATOM 103 CA PRO A 103 256.253 264.878 249.663 1.00 0.00 C +ATOM 104 CA GLY A 104 257.299 267.117 252.564 1.00 0.00 C +ATOM 105 CA ALA A 105 258.287 270.416 250.936 1.00 0.00 C +ATOM 106 CA GLU A 106 260.913 272.050 248.710 1.00 0.00 C +ATOM 107 CA GLU A 107 263.130 271.373 245.687 1.00 0.00 C +ATOM 108 CA ARG A 108 262.403 267.915 244.263 1.00 0.00 C +ATOM 109 CA ASP A 109 261.429 264.852 242.216 1.00 0.00 C +ATOM 110 CA GLY A 110 263.875 263.113 239.870 1.00 0.00 C +ATOM 111 CA VAL A 111 265.645 260.076 241.339 1.00 0.00 C +ATOM 112 CA LEU A 112 269.389 260.558 241.856 1.00 0.00 C +ATOM 113 CA ASP A 113 271.282 257.692 243.503 1.00 0.00 C +ATOM 114 CA GLY A 114 270.219 254.234 244.701 1.00 0.00 C +ATOM 115 CA VAL A 115 270.482 250.838 246.407 1.00 0.00 C +ATOM 116 CA ASP A 116 269.320 247.380 247.506 1.00 0.00 C +ATOM 117 CA ARG A 117 268.391 246.381 251.063 1.00 0.00 C +ATOM 118 CA ARG A 118 264.968 246.727 252.699 1.00 0.00 C +ATOM 119 CA ARG A 119 264.408 247.969 256.257 1.00 0.00 C +ATOM 120 CA ARG A 120 266.497 249.698 258.934 1.00 0.00 C +ATOM 121 CA GLU A 121 266.758 248.517 262.546 1.00 0.00 C +ATOM 122 CA LEU A 122 267.848 248.675 266.194 1.00 0.00 C +ATOM 123 CA HIS A 123 270.719 246.595 267.590 1.00 0.00 C +ATOM 124 CA GLY A 124 272.717 246.370 270.826 1.00 0.00 C +ATOM 125 CA GLY A 125 272.743 246.813 274.610 1.00 0.00 C +ATOM 126 CA VAL A 126 275.987 246.911 276.606 1.00 0.00 C +ATOM 127 CA GLU A 127 276.975 250.522 277.310 1.00 0.00 C +ATOM 128 CA GLU A 128 279.332 253.515 277.392 1.00 0.00 C +ATOM 129 CA ALA A 129 281.951 255.094 275.119 1.00 0.00 C +ATOM 130 CA ALA A 130 284.537 255.265 272.327 1.00 0.00 C +ATOM 131 CA ARG A 131 283.408 252.741 269.706 1.00 0.00 C +ATOM 132 CA SER A 132 286.190 252.455 267.118 1.00 0.00 C +ATOM 133 CA ALA A 133 287.666 255.170 264.889 1.00 0.00 C +ATOM 134 CA ARG A 134 288.654 258.337 263.016 1.00 0.00 C +ATOM 135 CA CYS A 135 292.274 258.963 264.023 1.00 0.00 C +ATOM 136 CA PRO A 136 292.697 262.405 265.600 1.00 0.00 C +TER 137 PRO A 136 +END diff --git a/Plants/Q8L4P7/Q8L4P7.dcd b/Plants/Q8L4P7/Q8L4P7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..767e934c9764006320c5287a6a9bf0cf9971bb79 --- /dev/null +++ b/Plants/Q8L4P7/Q8L4P7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:fa90ced56ab7ae819bd388b28be2ca7c6a66cf964f860c714055e97a47b65dad +size 9920276 diff --git a/Plants/Q8L4P7/top.pdb b/Plants/Q8L4P7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..949af3957bd3f6abd90058edbb2d13cb59cb9618 --- /dev/null +++ b/Plants/Q8L4P7/top.pdb @@ -0,0 +1,80 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 280.772 274.048 245.343 1.00 0.00 C +ATOM 2 CA ARG A 2 278.084 272.004 243.578 1.00 0.00 C +ATOM 3 CA ARG A 3 275.253 271.907 241.030 1.00 0.00 C +ATOM 4 CA ARG A 4 273.116 270.777 238.085 1.00 0.00 C +ATOM 5 CA VAL A 5 272.876 270.479 234.294 1.00 0.00 C +ATOM 6 CA THR A 6 274.090 270.253 230.690 1.00 0.00 C +ATOM 7 CA GLN A 7 277.694 269.029 230.853 1.00 0.00 C +ATOM 8 CA MET A 8 280.373 269.797 233.451 1.00 0.00 C +ATOM 9 CA LYS A 9 282.810 270.284 236.338 1.00 0.00 C +ATOM 10 CA SER A 10 285.667 272.411 237.690 1.00 0.00 C +ATOM 11 CA THR A 11 286.863 272.291 241.306 1.00 0.00 C +ATOM 12 CA ALA A 12 287.063 271.749 245.072 1.00 0.00 C +ATOM 13 CA ALA A 13 286.165 271.853 248.773 1.00 0.00 C +ATOM 14 CA ALA A 14 284.114 271.605 251.974 1.00 0.00 C +ATOM 15 CA ALA A 15 286.375 270.106 254.650 1.00 0.00 C +ATOM 16 CA ALA A 16 285.967 270.205 258.436 1.00 0.00 C +ATOM 17 CA GLY A 17 285.391 266.601 259.527 1.00 0.00 C +ATOM 18 CA ASP A 18 284.338 264.288 256.688 1.00 0.00 C +ATOM 19 CA ALA A 19 281.747 261.724 257.794 1.00 0.00 C +ATOM 20 CA GLU A 20 278.059 261.531 256.859 1.00 0.00 C +ATOM 21 CA ALA A 21 275.262 259.007 257.427 1.00 0.00 C +ATOM 22 CA ALA A 22 272.364 259.023 259.900 1.00 0.00 C +ATOM 23 CA THR A 23 271.144 258.179 263.410 1.00 0.00 C +ATOM 24 CA GLU A 24 269.853 255.401 265.675 1.00 0.00 C +ATOM 25 CA GLY A 25 266.791 253.408 264.592 1.00 0.00 C +ATOM 26 CA ASP A 26 264.284 253.183 261.732 1.00 0.00 C +ATOM 27 CA ASP A 27 260.554 253.826 262.162 1.00 0.00 C +ATOM 28 CA GLU A 28 257.409 252.741 260.304 1.00 0.00 C +ATOM 29 CA ASP A 29 256.925 249.992 257.711 1.00 0.00 C +ATOM 30 CA ASP A 30 254.686 247.419 259.409 1.00 0.00 C +ATOM 31 CA ASP A 31 253.167 244.175 260.708 1.00 0.00 C +ATOM 32 CA GLU A 32 253.082 240.440 259.960 1.00 0.00 C +ATOM 33 CA ASP A 33 252.962 237.538 257.494 1.00 0.00 C +ATOM 34 CA GLY A 34 252.116 234.379 259.449 1.00 0.00 C +ATOM 35 CA ASP A 35 249.164 233.733 261.768 1.00 0.00 C +ATOM 36 CA GLY A 36 246.360 233.727 264.348 1.00 0.00 C +ATOM 37 CA GLY A 37 243.557 234.782 266.704 1.00 0.00 C +ATOM 38 CA VAL A 38 240.398 234.064 268.709 1.00 0.00 C +ATOM 39 CA GLU A 39 237.175 233.157 270.527 1.00 0.00 C +ATOM 40 CA ASP A 40 235.133 230.097 269.536 1.00 0.00 C +ATOM 41 CA ASP A 41 233.326 227.447 267.481 1.00 0.00 C +ATOM 42 CA ASP A 42 234.883 225.922 264.356 1.00 0.00 C +ATOM 43 CA GLU A 43 237.497 226.067 261.587 1.00 0.00 C +ATOM 44 CA ASP A 44 237.399 225.405 257.836 1.00 0.00 C +ATOM 45 CA ASP A 45 234.238 226.861 256.286 1.00 0.00 C +ATOM 46 CA GLY A 46 233.551 230.408 257.496 1.00 0.00 C +ATOM 47 CA CYS A 47 232.039 233.855 258.080 1.00 0.00 C +ATOM 48 CA GLY A 48 229.941 236.947 258.825 1.00 0.00 C +ATOM 49 CA GLY A 49 230.832 240.369 257.407 1.00 0.00 C +ATOM 50 CA HIS A 50 227.743 242.222 256.166 1.00 0.00 C +ATOM 51 CA GLY A 51 227.379 245.994 256.559 1.00 0.00 C +ATOM 52 CA GLY A 52 228.509 249.578 257.187 1.00 0.00 C +ATOM 53 CA GLU A 53 230.992 251.782 255.318 1.00 0.00 C +ATOM 54 CA ALA A 54 233.461 250.658 252.642 1.00 0.00 C +ATOM 55 CA GLU A 55 232.387 248.897 249.439 1.00 0.00 C +ATOM 56 CA ARG A 56 229.840 247.251 247.132 1.00 0.00 C +ATOM 57 CA GLY A 57 228.062 246.161 243.944 1.00 0.00 C +ATOM 58 CA GLU A 58 229.740 243.361 241.979 1.00 0.00 C +ATOM 59 CA ASP A 59 228.892 240.245 239.958 1.00 0.00 C +ATOM 60 CA ALA A 60 227.905 240.519 236.288 1.00 0.00 C +ATOM 61 CA ALA A 61 228.267 239.684 232.588 1.00 0.00 C +ATOM 62 CA ALA A 62 231.253 241.082 230.680 1.00 0.00 C +ATOM 63 CA ALA A 63 233.336 244.155 229.820 1.00 0.00 C +ATOM 64 CA GLY A 64 236.642 245.917 229.124 1.00 0.00 C +ATOM 65 CA GLY A 65 236.366 249.619 229.979 1.00 0.00 C +ATOM 66 CA ALA A 66 234.189 249.846 233.098 1.00 0.00 C +ATOM 67 CA GLU A 67 230.619 248.528 232.913 1.00 0.00 C +ATOM 68 CA GLU A 68 227.871 248.359 235.547 1.00 0.00 C +ATOM 69 CA VAL A 69 225.896 249.466 238.611 1.00 0.00 C +ATOM 70 CA ALA A 70 224.291 252.784 239.574 1.00 0.00 C +ATOM 71 CA GLU A 71 220.628 252.089 240.358 1.00 0.00 C +ATOM 72 CA ARG A 72 219.642 248.420 240.641 1.00 0.00 C +ATOM 73 CA ARG A 73 219.428 244.676 241.313 1.00 0.00 C +ATOM 74 CA GLY A 74 220.280 241.230 239.930 1.00 0.00 C +ATOM 75 CA GLY A 75 222.001 238.373 238.088 1.00 0.00 C +ATOM 76 CA GLY A 76 221.471 234.610 237.814 1.00 0.00 C +TER 77 GLY A 76 +END diff --git a/Plants/Q8L522/Q8L522.dcd b/Plants/Q8L522/Q8L522.dcd new file mode 100644 index 0000000000000000000000000000000000000000..c33908fb681edc98fcdeb869faed0fc7adafcac1 --- /dev/null +++ b/Plants/Q8L522/Q8L522.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:1f7403b954f3c7408401daed7f90911333dffb32c11955068b476f868864d77c +size 13520276 diff --git a/Plants/Q8L522/top.pdb b/Plants/Q8L522/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..e7f2619814c9effadd9d3001cf58cdae5656339a --- /dev/null +++ b/Plants/Q8L522/top.pdb @@ -0,0 +1,110 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 307.785 271.953 281.665 1.00 0.00 C +ATOM 2 CA ASP A 2 311.069 272.637 283.472 1.00 0.00 C +ATOM 3 CA PRO A 3 310.704 274.817 286.575 1.00 0.00 C +ATOM 4 CA ALA A 4 308.094 277.522 287.200 1.00 0.00 C +ATOM 5 CA ALA A 5 305.000 276.030 288.851 1.00 0.00 C +ATOM 6 CA ALA A 6 305.475 272.431 290.005 1.00 0.00 C +ATOM 7 CA ARG A 7 303.264 269.521 288.927 1.00 0.00 C +ATOM 8 CA PRO A 8 302.578 269.167 285.196 1.00 0.00 C +ATOM 9 CA SER A 9 299.595 271.082 283.800 1.00 0.00 C +ATOM 10 CA ALA A 10 298.956 272.732 280.426 1.00 0.00 C +ATOM 11 CA PRO A 11 296.035 274.129 278.418 1.00 0.00 C +ATOM 12 CA GLY A 12 294.036 275.168 275.346 1.00 0.00 C +ATOM 13 CA CYS A 13 290.818 273.211 274.770 1.00 0.00 C +ATOM 14 CA ARG A 14 290.479 269.455 274.224 1.00 0.00 C +ATOM 15 CA ARG A 15 288.080 268.755 271.348 1.00 0.00 C +ATOM 16 CA SER A 16 284.554 270.189 271.179 1.00 0.00 C +ATOM 17 CA GLY A 17 283.486 270.193 267.521 1.00 0.00 C +ATOM 18 CA THR A 18 283.459 267.167 265.206 1.00 0.00 C +ATOM 19 CA GLY A 19 285.250 264.046 263.955 1.00 0.00 C +ATOM 20 CA PRO A 20 287.285 260.933 264.785 1.00 0.00 C +ATOM 21 CA ALA A 21 286.821 257.342 263.600 1.00 0.00 C +ATOM 22 CA ALA A 22 288.930 255.329 261.148 1.00 0.00 C +ATOM 23 CA ILE A 23 288.480 251.661 260.220 1.00 0.00 C +ATOM 24 CA ALA A 24 285.606 251.123 257.777 1.00 0.00 C +ATOM 25 CA PRO A 25 283.350 250.713 254.735 1.00 0.00 C +ATOM 26 CA HIS A 26 280.747 251.864 252.202 1.00 0.00 C +ATOM 27 CA GLY A 27 277.036 252.397 252.880 1.00 0.00 C +ATOM 28 CA PRO A 28 273.324 252.159 252.058 1.00 0.00 C +ATOM 29 CA GLY A 29 272.050 248.585 252.398 1.00 0.00 C +ATOM 30 CA ARG A 30 269.570 247.729 249.635 1.00 0.00 C +ATOM 31 CA CYS A 31 267.653 247.380 246.361 1.00 0.00 C +ATOM 32 CA ARG A 32 265.063 244.738 245.453 1.00 0.00 C +ATOM 33 CA PRO A 33 262.591 242.256 243.953 1.00 0.00 C +ATOM 34 CA SER A 34 260.930 241.917 240.541 1.00 0.00 C +ATOM 35 CA PRO A 35 260.898 245.097 238.443 1.00 0.00 C +ATOM 36 CA ALA A 36 258.993 244.280 235.247 1.00 0.00 C +ATOM 37 CA GLN A 37 255.701 246.194 235.376 1.00 0.00 C +ATOM 38 CA ALA A 38 253.526 246.753 238.454 1.00 0.00 C +ATOM 39 CA ARG A 39 251.924 244.094 240.663 1.00 0.00 C +ATOM 40 CA PRO A 40 248.219 243.558 239.957 1.00 0.00 C +ATOM 41 CA PRO A 41 247.294 239.864 239.861 1.00 0.00 C +ATOM 42 CA PRO A 42 243.631 238.989 239.282 1.00 0.00 C +ATOM 43 CA PRO A 43 240.180 240.210 238.227 1.00 0.00 C +ATOM 44 CA PRO A 44 237.933 242.630 240.128 1.00 0.00 C +ATOM 45 CA PRO A 45 235.368 244.634 238.147 1.00 0.00 C +ATOM 46 CA GLY A 46 231.878 246.011 238.806 1.00 0.00 C +ATOM 47 CA MET A 47 229.672 246.601 235.756 1.00 0.00 C +ATOM 48 CA ALA A 48 228.289 250.039 234.871 1.00 0.00 C +ATOM 49 CA PRO A 49 228.021 251.922 238.172 1.00 0.00 C +ATOM 50 CA PRO A 50 225.379 253.128 240.638 1.00 0.00 C +ATOM 51 CA PRO A 51 223.388 250.306 242.245 1.00 0.00 C +ATOM 52 CA LEU A 52 224.507 246.878 241.014 1.00 0.00 C +ATOM 53 CA PRO A 53 222.572 245.186 238.201 1.00 0.00 C +ATOM 54 CA LEU A 54 218.898 246.191 238.101 1.00 0.00 C +ATOM 55 CA LEU A 55 216.630 248.502 240.109 1.00 0.00 C +ATOM 56 CA GLY A 56 216.703 249.467 243.794 1.00 0.00 C +ATOM 57 CA THR A 57 216.422 246.247 245.812 1.00 0.00 C +ATOM 58 CA GLY A 58 213.989 243.422 245.028 1.00 0.00 C +ATOM 59 CA PRO A 59 212.473 242.101 248.264 1.00 0.00 C +ATOM 60 CA ALA A 60 210.682 243.580 251.284 1.00 0.00 C +ATOM 61 CA ALA A 61 209.613 244.798 254.733 1.00 0.00 C +ATOM 62 CA ALA A 62 210.564 247.467 257.280 1.00 0.00 C +ATOM 63 CA ALA A 63 208.994 248.124 260.688 1.00 0.00 C +ATOM 64 CA PRO A 64 207.370 245.562 262.994 1.00 0.00 C +ATOM 65 CA ALA A 65 204.182 243.477 262.905 1.00 0.00 C +ATOM 66 CA GLN A 66 202.722 243.707 259.394 1.00 0.00 C +ATOM 67 CA HIS A 67 203.013 240.950 256.781 1.00 0.00 C +ATOM 68 CA GLY A 68 206.450 239.507 255.992 1.00 0.00 C +ATOM 69 CA PRO A 69 209.329 237.289 254.847 1.00 0.00 C +ATOM 70 CA GLY A 70 211.943 235.521 252.714 1.00 0.00 C +ATOM 71 CA ARG A 71 214.365 234.716 249.884 1.00 0.00 C +ATOM 72 CA CYS A 72 217.398 233.598 247.868 1.00 0.00 C +ATOM 73 CA LEU A 73 219.877 231.929 250.231 1.00 0.00 C +ATOM 74 CA GLY A 74 223.660 231.548 250.473 1.00 0.00 C +ATOM 75 CA CYS A 75 226.846 232.606 248.673 1.00 0.00 C +ATOM 76 CA PHE A 76 229.878 234.907 248.832 1.00 0.00 C +ATOM 77 CA SER A 77 231.201 238.472 249.079 1.00 0.00 C +ATOM 78 CA ARG A 78 234.812 239.436 249.819 1.00 0.00 C +ATOM 79 CA ARG A 79 238.442 238.534 250.543 1.00 0.00 C +ATOM 80 CA SER A 80 241.899 236.945 250.739 1.00 0.00 C +ATOM 81 CA GLU A 81 243.248 234.996 247.756 1.00 0.00 C +ATOM 82 CA GLU A 82 245.381 233.876 244.804 1.00 0.00 C +ATOM 83 CA GLU A 83 246.285 230.478 243.338 1.00 0.00 C +ATOM 84 CA LYS A 84 249.684 229.545 241.892 1.00 0.00 C +ATOM 85 CA ARG A 85 250.312 230.252 238.201 1.00 0.00 C +ATOM 86 CA GLY A 86 250.556 231.377 234.569 1.00 0.00 C +ATOM 87 CA LYS A 87 251.476 234.861 233.330 1.00 0.00 C +ATOM 88 CA LEU A 88 249.536 235.317 230.083 1.00 0.00 C +ATOM 89 CA ASP A 89 245.804 236.056 230.291 1.00 0.00 C +ATOM 90 CA GLN A 90 244.378 239.386 231.470 1.00 0.00 C +ATOM 91 CA MET A 91 240.602 239.755 231.130 1.00 0.00 C +ATOM 92 CA TRP A 92 239.020 243.180 230.595 1.00 0.00 C +ATOM 93 CA LYS A 93 237.318 246.582 230.378 1.00 0.00 C +ATOM 94 CA ARG A 94 238.191 249.872 232.089 1.00 0.00 C +ATOM 95 CA LYS A 95 237.201 250.443 235.724 1.00 0.00 C +ATOM 96 CA GLY A 96 234.464 252.760 237.011 1.00 0.00 C +ATOM 97 CA ARG A 97 233.784 254.259 240.448 1.00 0.00 C +ATOM 98 CA GLY A 98 235.747 257.482 240.972 1.00 0.00 C +ATOM 99 CA ARG A 99 237.461 258.079 237.622 1.00 0.00 C +ATOM 100 CA ASP A 100 235.151 259.245 234.825 1.00 0.00 C +ATOM 101 CA GLU A 101 237.040 261.173 232.135 1.00 0.00 C +ATOM 102 CA SER A 102 239.883 262.515 229.984 1.00 0.00 C +ATOM 103 CA GLU A 103 241.189 264.221 226.838 1.00 0.00 C +ATOM 104 CA ARG A 104 241.787 263.263 223.198 1.00 0.00 C +ATOM 105 CA GLY A 105 245.026 261.657 221.999 1.00 0.00 C +ATOM 106 CA ARG A 106 245.593 258.066 223.139 1.00 0.00 C +TER 107 ARG A 106 +END diff --git a/Plants/Q8L5H5/Q8L5H5.dcd b/Plants/Q8L5H5/Q8L5H5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..a899f524e9ff38a095a99cd27c926bebd0a194f1 --- /dev/null +++ b/Plants/Q8L5H5/Q8L5H5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:61ed7ec34f7070f91ae0493651e99cc266ca5d4ffd996d7657ec72b7ba4cef6a +size 22040276 diff --git a/Plants/Q8L5H5/top.pdb b/Plants/Q8L5H5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..f65542e14dde673d352950aba7ddc46e32fdef67 --- /dev/null +++ b/Plants/Q8L5H5/top.pdb @@ -0,0 +1,181 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 258.328 198.204 252.540 1.00 0.00 C +ATOM 2 CA ALA A 2 260.743 200.062 250.253 1.00 0.00 C +ATOM 3 CA THR A 3 264.295 201.349 250.746 1.00 0.00 C +ATOM 4 CA ALA A 4 267.877 202.618 251.016 1.00 0.00 C +ATOM 5 CA GLU A 5 269.496 202.194 254.439 1.00 0.00 C +ATOM 6 CA VAL A 6 270.629 205.480 256.000 1.00 0.00 C +ATOM 7 CA VAL A 7 272.114 208.547 254.297 1.00 0.00 C +ATOM 8 CA THR A 8 273.930 210.821 256.757 1.00 0.00 C +ATOM 9 CA ALA A 9 276.559 212.786 258.691 1.00 0.00 C +ATOM 10 CA GLN A 10 275.662 216.478 258.407 1.00 0.00 C +ATOM 11 CA THR A 11 275.414 220.157 257.449 1.00 0.00 C +ATOM 12 CA ALA A 12 277.811 222.469 255.598 1.00 0.00 C +ATOM 13 CA LEU A 13 277.058 226.087 254.669 1.00 0.00 C +ATOM 14 CA PRO A 14 278.573 229.582 254.607 1.00 0.00 C +ATOM 15 CA GLU A 15 278.844 233.367 254.266 1.00 0.00 C +ATOM 16 CA GLU A 16 279.874 236.093 256.720 1.00 0.00 C +ATOM 17 CA LYS A 17 280.849 237.294 260.202 1.00 0.00 C +ATOM 18 CA PRO A 18 283.262 238.395 262.937 1.00 0.00 C +ATOM 19 CA ALA A 19 285.031 236.278 265.564 1.00 0.00 C +ATOM 20 CA GLU A 20 286.450 232.789 264.994 1.00 0.00 C +ATOM 21 CA GLU A 21 286.464 230.625 268.130 1.00 0.00 C +ATOM 22 CA VAL A 22 289.292 230.530 270.681 1.00 0.00 C +ATOM 23 CA LYS A 23 291.262 230.982 273.911 1.00 0.00 C +ATOM 24 CA VAL A 24 294.766 229.776 274.798 1.00 0.00 C +ATOM 25 CA SER A 25 296.642 226.602 273.839 1.00 0.00 C +ATOM 26 CA GLU A 26 296.351 222.852 274.444 1.00 0.00 C +ATOM 27 CA ILE A 27 298.261 220.769 277.000 1.00 0.00 C +ATOM 28 CA VAL A 28 297.389 217.143 276.221 1.00 0.00 C +ATOM 29 CA THR A 29 295.939 215.394 273.162 1.00 0.00 C +ATOM 30 CA GLU A 30 296.366 213.466 269.903 1.00 0.00 C +ATOM 31 CA GLU A 31 293.681 212.440 267.402 1.00 0.00 C +ATOM 32 CA ALA A 32 293.866 213.956 263.911 1.00 0.00 C +ATOM 33 CA ALA A 33 296.405 213.916 261.072 1.00 0.00 C +ATOM 34 CA PRO A 34 298.097 213.738 257.662 1.00 0.00 C +ATOM 35 CA ALA A 35 300.524 216.412 256.449 1.00 0.00 C +ATOM 36 CA VAL A 36 300.459 219.074 259.175 1.00 0.00 C +ATOM 37 CA GLU A 37 301.780 222.509 260.162 1.00 0.00 C +ATOM 38 CA PRO A 38 300.756 225.514 262.269 1.00 0.00 C +ATOM 39 CA VAL A 39 301.054 224.757 265.992 1.00 0.00 C +ATOM 40 CA ALA A 40 298.612 222.046 267.088 1.00 0.00 C +ATOM 41 CA GLU A 41 296.990 219.716 264.547 1.00 0.00 C +ATOM 42 CA GLU A 42 293.450 220.249 263.241 1.00 0.00 C +ATOM 43 CA PRO A 43 289.884 219.249 264.134 1.00 0.00 C +ATOM 44 CA LYS A 44 287.522 222.029 263.033 1.00 0.00 C +ATOM 45 CA GLU A 45 285.897 224.680 265.235 1.00 0.00 C +ATOM 46 CA ALA A 46 282.519 225.587 266.748 1.00 0.00 C +ATOM 47 CA GLU A 47 279.407 224.239 265.011 1.00 0.00 C +ATOM 48 CA PRO A 48 275.965 225.776 265.559 1.00 0.00 C +ATOM 49 CA VAL A 49 275.333 227.371 268.961 1.00 0.00 C +ATOM 50 CA ALA A 50 273.328 225.001 271.170 1.00 0.00 C +ATOM 51 CA VAL A 51 270.317 222.667 271.088 1.00 0.00 C +ATOM 52 CA SER A 52 271.434 219.252 272.356 1.00 0.00 C +ATOM 53 CA GLU A 53 272.065 215.853 270.754 1.00 0.00 C +ATOM 54 CA GLU A 54 271.282 212.341 272.006 1.00 0.00 C +ATOM 55 CA PRO A 55 272.004 209.802 269.258 1.00 0.00 C +ATOM 56 CA LYS A 56 271.437 211.210 265.764 1.00 0.00 C +ATOM 57 CA GLU A 57 268.436 212.509 263.808 1.00 0.00 C +ATOM 58 CA ALA A 58 266.003 215.135 262.505 1.00 0.00 C +ATOM 59 CA ASP A 59 263.912 217.514 260.388 1.00 0.00 C +ATOM 60 CA ASP A 60 261.827 220.373 261.801 1.00 0.00 C +ATOM 61 CA ALA A 61 262.885 222.618 264.693 1.00 0.00 C +ATOM 62 CA PRO A 62 262.991 223.695 268.346 1.00 0.00 C +ATOM 63 CA ALA A 63 261.809 226.318 270.844 1.00 0.00 C +ATOM 64 CA GLU A 64 259.191 227.474 273.360 1.00 0.00 C +ATOM 65 CA VAL A 65 257.425 230.850 273.381 1.00 0.00 C +ATOM 66 CA ALA A 66 258.367 234.405 274.374 1.00 0.00 C +ATOM 67 CA VAL A 67 258.144 237.736 272.537 1.00 0.00 C +ATOM 68 CA GLU A 68 261.206 239.904 271.876 1.00 0.00 C +ATOM 69 CA THR A 69 264.046 241.882 270.284 1.00 0.00 C +ATOM 70 CA LYS A 70 263.378 245.486 271.322 1.00 0.00 C +ATOM 71 CA GLU A 71 260.699 245.815 274.011 1.00 0.00 C +ATOM 72 CA VAL A 72 257.116 246.160 272.760 1.00 0.00 C +ATOM 73 CA VAL A 73 254.971 243.691 274.715 1.00 0.00 C +ATOM 74 CA GLU A 74 251.445 245.123 274.539 1.00 0.00 C +ATOM 75 CA VAL A 75 249.590 244.676 271.241 1.00 0.00 C +ATOM 76 CA GLU A 76 250.300 246.593 268.026 1.00 0.00 C +ATOM 77 CA GLU A 77 250.362 247.328 264.288 1.00 0.00 C +ATOM 78 CA ALA A 78 249.557 246.965 260.581 1.00 0.00 C +ATOM 79 CA LYS A 79 250.714 247.215 256.960 1.00 0.00 C +ATOM 80 CA THR A 80 252.535 246.843 253.634 1.00 0.00 C +ATOM 81 CA VAL A 81 256.272 246.414 254.244 1.00 0.00 C +ATOM 82 CA THR A 82 257.445 249.883 255.295 1.00 0.00 C +ATOM 83 CA GLU A 83 255.638 251.790 258.054 1.00 0.00 C +ATOM 84 CA GLU A 84 254.339 253.348 261.279 1.00 0.00 C +ATOM 85 CA PRO A 85 255.397 256.519 263.107 1.00 0.00 C +ATOM 86 CA THR A 86 257.298 259.756 263.761 1.00 0.00 C +ATOM 87 CA VAL A 87 257.793 262.681 261.370 1.00 0.00 C +ATOM 88 CA GLU A 88 255.206 262.825 258.577 1.00 0.00 C +ATOM 89 CA LYS A 89 256.894 264.615 255.668 1.00 0.00 C +ATOM 90 CA THR A 90 256.394 267.678 253.457 1.00 0.00 C +ATOM 91 CA GLU A 91 255.003 268.823 250.100 1.00 0.00 C +ATOM 92 CA GLU A 92 251.589 267.880 248.695 1.00 0.00 C +ATOM 93 CA GLU A 93 248.906 269.137 246.300 1.00 0.00 C +ATOM 94 CA GLU A 94 246.593 272.081 245.597 1.00 0.00 C +ATOM 95 CA GLU A 95 244.099 274.787 246.587 1.00 0.00 C +ATOM 96 CA THR A 96 240.473 275.351 245.563 1.00 0.00 C +ATOM 97 CA PRO A 97 238.032 272.474 245.032 1.00 0.00 C +ATOM 98 CA LYS A 98 239.049 269.650 247.378 1.00 0.00 C +ATOM 99 CA GLU A 99 240.525 267.055 249.745 1.00 0.00 C +ATOM 100 CA GLU A 100 238.593 264.287 251.513 1.00 0.00 C +ATOM 101 CA THR A 101 236.243 266.074 253.922 1.00 0.00 C +ATOM 102 CA PRO A 102 237.270 269.448 255.362 1.00 0.00 C +ATOM 103 CA GLU A 103 234.917 272.361 256.065 1.00 0.00 C +ATOM 104 CA PRO A 104 231.225 273.303 256.031 1.00 0.00 C +ATOM 105 CA VAL A 105 229.388 271.788 253.057 1.00 0.00 C +ATOM 106 CA VAL A 106 226.065 269.979 253.499 1.00 0.00 C +ATOM 107 CA VAL A 107 222.776 268.366 254.546 1.00 0.00 C +ATOM 108 CA LYS A 108 219.884 268.988 252.146 1.00 0.00 C +ATOM 109 CA GLU A 109 217.578 271.937 251.434 1.00 0.00 C +ATOM 110 CA THR A 110 216.889 275.679 251.631 1.00 0.00 C +ATOM 111 CA PRO A 111 219.157 277.709 249.339 1.00 0.00 C +ATOM 112 CA LYS A 112 219.215 281.423 248.490 1.00 0.00 C +ATOM 113 CA GLU A 113 216.169 283.708 248.366 1.00 0.00 C +ATOM 114 CA GLU A 114 214.939 283.681 244.761 1.00 0.00 C +ATOM 115 CA PRO A 115 217.088 281.466 242.527 1.00 0.00 C +ATOM 116 CA ALA A 116 220.536 283.087 242.552 1.00 0.00 C +ATOM 117 CA ALA A 117 222.390 283.915 239.328 1.00 0.00 C +ATOM 118 CA GLU A 118 223.709 287.071 237.651 1.00 0.00 C +ATOM 119 CA THR A 119 224.876 289.516 234.972 1.00 0.00 C +ATOM 120 CA VAL A 120 225.833 289.911 231.306 1.00 0.00 C +ATOM 121 CA VAL A 121 225.920 286.999 228.850 1.00 0.00 C +ATOM 122 CA VAL A 122 227.234 285.271 225.719 1.00 0.00 C +ATOM 123 CA GLU A 123 225.369 285.020 222.406 1.00 0.00 C +ATOM 124 CA ALA A 124 223.041 288.008 221.998 1.00 0.00 C +ATOM 125 CA PRO A 125 220.851 290.135 224.278 1.00 0.00 C +ATOM 126 CA LYS A 126 217.242 288.957 224.598 1.00 0.00 C +ATOM 127 CA GLU A 127 215.827 289.635 228.070 1.00 0.00 C +ATOM 128 CA THR A 128 216.237 288.464 231.673 1.00 0.00 C +ATOM 129 CA THR A 129 216.746 284.712 232.096 1.00 0.00 C +ATOM 130 CA GLU A 130 220.080 283.711 230.546 1.00 0.00 C +ATOM 131 CA ALA A 131 220.915 280.894 228.120 1.00 0.00 C +ATOM 132 CA ALA A 132 220.929 279.999 224.417 1.00 0.00 C +ATOM 133 CA THR A 133 219.136 277.492 222.178 1.00 0.00 C +ATOM 134 CA GLU A 134 220.192 277.091 218.539 1.00 0.00 C +ATOM 135 CA ALA A 135 223.749 277.202 217.178 1.00 0.00 C +ATOM 136 CA GLU A 136 226.844 276.974 219.388 1.00 0.00 C +ATOM 137 CA ALA A 137 228.703 273.654 219.181 1.00 0.00 C +ATOM 138 CA PRO A 138 229.707 270.026 218.596 1.00 0.00 C +ATOM 139 CA ALA A 139 233.054 268.211 218.451 1.00 0.00 C +ATOM 140 CA PRO A 140 233.737 265.325 220.843 1.00 0.00 C +ATOM 141 CA GLU A 141 230.671 264.156 222.779 1.00 0.00 C +ATOM 142 CA SER A 142 230.507 260.358 223.036 1.00 0.00 C +ATOM 143 CA ALA A 143 230.987 258.165 219.957 1.00 0.00 C +ATOM 144 CA PRO A 144 229.558 258.746 216.474 1.00 0.00 C +ATOM 145 CA ALA A 145 228.266 261.298 213.957 1.00 0.00 C +ATOM 146 CA SER A 146 224.700 262.628 213.794 1.00 0.00 C +ATOM 147 CA ALA A 147 220.924 262.787 213.312 1.00 0.00 C +ATOM 148 CA SER A 148 217.583 263.595 214.957 1.00 0.00 C +ATOM 149 CA GLU A 149 216.751 267.160 216.011 1.00 0.00 C +ATOM 150 CA THR A 150 215.974 268.270 219.572 1.00 0.00 C +ATOM 151 CA PRO A 151 218.843 268.399 222.075 1.00 0.00 C +ATOM 152 CA ALA A 152 221.878 266.114 222.359 1.00 0.00 C +ATOM 153 CA GLU A 153 223.983 267.428 225.250 1.00 0.00 C +ATOM 154 CA GLU A 154 225.013 269.922 227.940 1.00 0.00 C +ATOM 155 CA GLU A 155 223.454 273.362 228.438 1.00 0.00 C +ATOM 156 CA VAL A 156 219.707 273.363 229.125 1.00 0.00 C +ATOM 157 CA PRO A 157 218.162 270.975 231.660 1.00 0.00 C +ATOM 158 CA LYS A 158 214.410 271.375 231.134 1.00 0.00 C +ATOM 159 CA GLU A 159 213.782 273.192 227.844 1.00 0.00 C +ATOM 160 CA GLU A 160 213.494 276.915 227.090 1.00 0.00 C +ATOM 161 CA GLU A 161 212.028 278.490 230.234 1.00 0.00 C +ATOM 162 CA GLY A 162 213.008 277.964 233.878 1.00 0.00 C +ATOM 163 CA ASP A 163 216.790 277.506 233.920 1.00 0.00 C +ATOM 164 CA GLU A 164 217.750 275.465 236.991 1.00 0.00 C +ATOM 165 CA LYS A 165 218.825 274.457 240.504 1.00 0.00 C +ATOM 166 CA LYS A 166 220.551 273.766 243.830 1.00 0.00 C +ATOM 167 CA SER A 167 223.799 271.934 243.049 1.00 0.00 C +ATOM 168 CA GLU A 168 226.514 269.362 243.776 1.00 0.00 C +ATOM 169 CA ALA A 169 228.031 266.148 245.150 1.00 0.00 C +ATOM 170 CA GLU A 170 228.679 262.884 243.294 1.00 0.00 C +ATOM 171 CA VAL A 171 227.471 259.289 242.931 1.00 0.00 C +ATOM 172 CA GLU A 172 226.876 257.589 246.289 1.00 0.00 C +ATOM 173 CA ALA A 173 228.258 254.058 245.923 1.00 0.00 C +ATOM 174 CA GLU A 174 225.332 251.641 246.260 1.00 0.00 C +ATOM 175 CA LYS A 175 221.600 250.921 246.521 1.00 0.00 C +ATOM 176 CA THR A 176 220.909 247.312 245.513 1.00 0.00 C +ATOM 177 CA GLU A 177 221.223 243.899 247.177 1.00 0.00 C +TER 178 GLU A 177 +END diff --git a/Plants/Q8L652/Q8L652.dcd b/Plants/Q8L652/Q8L652.dcd new file mode 100644 index 0000000000000000000000000000000000000000..f8a3e70de626ed9853ec11f68333013220413a73 --- /dev/null +++ b/Plants/Q8L652/Q8L652.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2bfc3d0f2340c2f2e4bb0b690ddcc24aae249ef5b2170ef62dd360aa425e3340 +size 9920276 diff --git a/Plants/Q8L652/top.pdb b/Plants/Q8L652/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..4a3085ab987b6c5457d07a713f64b9b634285c03 --- /dev/null +++ b/Plants/Q8L652/top.pdb @@ -0,0 +1,80 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 261.704 217.154 217.469 1.00 0.00 C +ATOM 2 CA SER A 2 261.444 214.555 220.242 1.00 0.00 C +ATOM 3 CA ASN A 3 261.071 214.762 224.028 1.00 0.00 C +ATOM 4 CA GLN A 4 261.115 217.785 226.345 1.00 0.00 C +ATOM 5 CA GLY A 5 263.187 217.986 229.536 1.00 0.00 C +ATOM 6 CA THR A 6 262.768 218.588 233.275 1.00 0.00 C +ATOM 7 CA PRO A 7 259.418 219.200 234.983 1.00 0.00 C +ATOM 8 CA ARG A 8 256.044 219.702 236.681 1.00 0.00 C +ATOM 9 CA PRO A 9 253.678 219.912 239.661 1.00 0.00 C +ATOM 10 CA HIS A 10 253.781 217.812 242.838 1.00 0.00 C +ATOM 11 CA ASN A 11 254.751 219.957 245.834 1.00 0.00 C +ATOM 12 CA ARG A 12 254.183 223.463 247.214 1.00 0.00 C +ATOM 13 CA ASP A 13 254.364 226.355 244.741 1.00 0.00 C +ATOM 14 CA ASP A 14 256.197 226.943 241.452 1.00 0.00 C +ATOM 15 CA ASP A 15 258.446 225.555 238.708 1.00 0.00 C +ATOM 16 CA ASP A 16 260.496 227.135 235.912 1.00 0.00 C +ATOM 17 CA ASP A 17 263.449 229.203 234.678 1.00 0.00 C +ATOM 18 CA ARG A 18 264.201 231.569 237.567 1.00 0.00 C +ATOM 19 CA THR A 19 265.386 233.876 240.359 1.00 0.00 C +ATOM 20 CA GLY A 20 266.331 235.599 243.623 1.00 0.00 C +ATOM 21 CA ASP A 21 265.543 234.867 247.278 1.00 0.00 C +ATOM 22 CA PRO A 22 268.458 232.748 248.515 1.00 0.00 C +ATOM 23 CA ALA A 23 268.088 231.562 252.117 1.00 0.00 C +ATOM 24 CA ASP A 24 266.421 233.547 254.910 1.00 0.00 C +ATOM 25 CA ALA A 25 262.617 233.746 254.904 1.00 0.00 C +ATOM 26 CA ARG A 26 259.835 235.198 257.065 1.00 0.00 C +ATOM 27 CA GLY A 27 257.331 236.869 259.402 1.00 0.00 C +ATOM 28 CA ARG A 28 253.825 235.918 260.550 1.00 0.00 C +ATOM 29 CA ARG A 29 251.416 238.836 260.995 1.00 0.00 C +ATOM 30 CA ALA A 30 248.812 240.871 262.889 1.00 0.00 C +ATOM 31 CA PRO A 31 247.483 243.121 265.662 1.00 0.00 C +ATOM 32 CA THR A 32 245.174 245.949 264.574 1.00 0.00 C +ATOM 33 CA MET A 33 243.401 245.359 261.254 1.00 0.00 C +ATOM 34 CA ARG A 34 241.605 248.023 259.207 1.00 0.00 C +ATOM 35 CA ARG A 35 238.732 246.673 257.099 1.00 0.00 C +ATOM 36 CA PRO A 36 235.481 245.077 255.918 1.00 0.00 C +ATOM 37 CA ASP A 37 232.435 244.345 258.088 1.00 0.00 C +ATOM 38 CA PRO A 38 229.917 245.299 260.783 1.00 0.00 C +ATOM 39 CA ILE A 39 228.541 248.781 260.077 1.00 0.00 C +ATOM 40 CA PRO A 40 229.984 252.055 258.768 1.00 0.00 C +ATOM 41 CA PRO A 41 227.782 255.060 259.567 1.00 0.00 C +ATOM 42 CA ALA A 42 226.462 258.597 259.058 1.00 0.00 C +ATOM 43 CA THR A 43 227.710 261.851 260.597 1.00 0.00 C +ATOM 44 CA PRO A 44 229.871 264.977 260.873 1.00 0.00 C +ATOM 45 CA ALA A 45 229.815 268.778 260.618 1.00 0.00 C +ATOM 46 CA ALA A 46 232.322 271.258 262.060 1.00 0.00 C +ATOM 47 CA ALA A 47 230.932 272.777 265.265 1.00 0.00 C +ATOM 48 CA ASN A 48 230.136 273.998 268.785 1.00 0.00 C +ATOM 49 CA GLN A 49 229.183 276.288 271.677 1.00 0.00 C +ATOM 50 CA PRO A 50 226.126 278.508 271.182 1.00 0.00 C +ATOM 51 CA SER A 51 225.445 279.259 267.510 1.00 0.00 C +ATOM 52 CA CYS A 52 226.133 279.091 263.766 1.00 0.00 C +ATOM 53 CA ARG A 53 229.835 278.568 263.037 1.00 0.00 C +ATOM 54 CA PRO A 54 230.626 276.996 259.658 1.00 0.00 C +ATOM 55 CA ALA A 55 234.186 276.069 258.665 1.00 0.00 C +ATOM 56 CA PRO A 56 237.856 276.067 259.689 1.00 0.00 C +ATOM 57 CA GLY A 57 240.533 273.375 259.372 1.00 0.00 C +ATOM 58 CA ARG A 58 244.302 272.850 259.553 1.00 0.00 C +ATOM 59 CA PRO A 59 247.004 272.017 256.999 1.00 0.00 C +ATOM 60 CA LYS A 60 248.125 273.288 253.586 1.00 0.00 C +ATOM 61 CA ARG A 61 249.412 273.087 250.006 1.00 0.00 C +ATOM 62 CA GLN A 62 252.506 274.096 248.024 1.00 0.00 C +ATOM 63 CA ILE A 63 255.699 273.712 245.982 1.00 0.00 C +ATOM 64 CA ALA A 64 257.541 277.024 246.380 1.00 0.00 C +ATOM 65 CA LEU A 65 261.054 278.341 245.719 1.00 0.00 C +ATOM 66 CA ALA A 66 262.403 276.919 242.451 1.00 0.00 C +ATOM 67 CA GLY A 67 264.153 274.888 239.744 1.00 0.00 C +ATOM 68 CA GLY A 68 262.055 271.879 238.715 1.00 0.00 C +ATOM 69 CA ALA A 69 264.059 269.759 236.265 1.00 0.00 C +ATOM 70 CA GLY A 70 264.386 266.329 237.891 1.00 0.00 C +ATOM 71 CA SER A 71 266.970 264.068 239.542 1.00 0.00 C +ATOM 72 CA ARG A 72 266.328 260.975 241.672 1.00 0.00 C +ATOM 73 CA ALA A 73 266.950 258.040 244.021 1.00 0.00 C +ATOM 74 CA PRO A 74 263.737 256.324 245.138 1.00 0.00 C +ATOM 75 CA GLY A 75 261.550 255.569 242.110 1.00 0.00 C +ATOM 76 CA SER A 76 259.697 253.361 239.619 1.00 0.00 C +TER 77 SER A 76 +END diff --git a/Plants/Q8L679/Q8L679.dcd b/Plants/Q8L679/Q8L679.dcd new file mode 100644 index 0000000000000000000000000000000000000000..02b3ff192fb38824ed35fff63b824c4bad5d25ef --- /dev/null +++ b/Plants/Q8L679/Q8L679.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e3183d27569b7804e0be7d27518fcf0a193f8c0874b8ca4f00468d08e50cec55 +size 37560276 diff --git a/Plants/Q8L679/top.pdb b/Plants/Q8L679/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..b1bfe805c0527945814d44efbad7468a97dd4aa3 --- /dev/null +++ b/Plants/Q8L679/top.pdb @@ -0,0 +1,206 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 298.539 266.244 281.126 1.00 0.00 C +ATOM 2 CA GLY A 2 298.670 268.777 283.968 1.00 0.00 C +ATOM 3 CA VAL A 3 302.029 268.945 285.758 1.00 0.00 C +ATOM 4 CA GLY A 4 303.360 266.977 288.737 1.00 0.00 C +ATOM 5 CA PRO A 5 306.157 264.622 289.808 1.00 0.00 C +ATOM 6 CA THR A 6 309.321 262.518 290.086 1.00 0.00 C +ATOM 7 CA ARG A 7 312.142 260.053 289.394 1.00 0.00 C +ATOM 8 CA GLN A 8 310.924 256.561 290.310 1.00 0.00 C +ATOM 9 CA PRO A 9 307.328 256.882 291.526 1.00 0.00 C +ATOM 10 CA LEU A 10 305.601 259.426 293.776 1.00 0.00 C +ATOM 11 CA GLY A 11 302.249 260.896 292.719 1.00 0.00 C +ATOM 12 CA PRO A 12 298.657 260.792 293.985 1.00 0.00 C +ATOM 13 CA ARG A 13 297.683 257.504 295.645 1.00 0.00 C +ATOM 14 CA TRP A 14 296.453 254.295 297.289 1.00 0.00 C +ATOM 15 CA THR A 15 295.455 250.806 298.450 1.00 0.00 C +ATOM 16 CA GLY A 16 293.388 248.627 300.795 1.00 0.00 C +ATOM 17 CA SER A 17 289.979 248.322 302.467 1.00 0.00 C +ATOM 18 CA THR A 18 288.964 251.683 303.946 1.00 0.00 C +ATOM 19 CA ARG A 19 288.757 253.816 307.097 1.00 0.00 C +ATOM 20 CA LEU A 20 290.116 254.682 310.549 1.00 0.00 C +ATOM 21 CA THR A 21 290.696 251.546 312.634 1.00 0.00 C +ATOM 22 CA PRO A 22 291.482 248.684 310.244 1.00 0.00 C +ATOM 23 CA ALA A 23 290.601 245.039 309.572 1.00 0.00 C +ATOM 24 CA GLY A 24 290.524 242.122 307.122 1.00 0.00 C +ATOM 25 CA ALA A 25 288.383 241.175 304.116 1.00 0.00 C +ATOM 26 CA VAL A 26 285.323 241.702 301.909 1.00 0.00 C +ATOM 27 CA GLY A 27 282.818 239.518 300.045 1.00 0.00 C +ATOM 28 CA PRO A 28 279.047 239.279 299.553 1.00 0.00 C +ATOM 29 CA THR A 29 275.338 238.733 300.232 1.00 0.00 C +ATOM 30 CA ARG A 30 272.682 240.327 298.015 1.00 0.00 C +ATOM 31 CA GLN A 31 273.633 243.174 295.669 1.00 0.00 C +ATOM 32 CA PRO A 32 276.319 243.796 293.039 1.00 0.00 C +ATOM 33 CA HIS A 33 277.834 243.007 289.633 1.00 0.00 C +ATOM 34 CA LEU A 34 280.945 240.915 290.306 1.00 0.00 C +ATOM 35 CA ARG A 35 283.007 240.752 287.106 1.00 0.00 C +ATOM 36 CA ALA A 36 282.048 243.416 284.556 1.00 0.00 C +ATOM 37 CA GLN A 37 278.724 243.863 282.748 1.00 0.00 C +ATOM 38 CA ALA A 38 276.220 245.860 280.685 1.00 0.00 C +ATOM 39 CA ALA A 39 273.017 247.489 279.419 1.00 0.00 C +ATOM 40 CA ASP A 40 272.036 248.951 276.040 1.00 0.00 C +ATOM 41 CA GLY A 41 272.440 246.894 272.859 1.00 0.00 C +ATOM 42 CA ARG A 42 272.554 244.577 269.837 1.00 0.00 C +ATOM 43 CA ALA A 43 269.556 244.320 267.500 1.00 0.00 C +ATOM 44 CA PRO A 44 266.454 246.531 267.414 1.00 0.00 C +ATOM 45 CA HIS A 45 263.128 246.950 265.604 1.00 0.00 C +ATOM 46 CA GLY A 46 262.354 248.897 262.422 1.00 0.00 C +ATOM 47 CA SER A 47 261.635 252.169 260.607 1.00 0.00 C +ATOM 48 CA ARG A 48 260.655 255.356 258.763 1.00 0.00 C +ATOM 49 CA GLY A 49 258.259 257.212 261.071 1.00 0.00 C +ATOM 50 CA ALA A 50 259.533 258.757 264.312 1.00 0.00 C +ATOM 51 CA ARG A 51 262.920 258.103 265.929 1.00 0.00 C +ATOM 52 CA PRO A 52 264.026 261.296 267.689 1.00 0.00 C +ATOM 53 CA LYS A 53 264.505 262.430 271.294 1.00 0.00 C +ATOM 54 CA ALA A 54 265.851 265.303 273.404 1.00 0.00 C +ATOM 55 CA ALA A 55 265.474 266.256 277.074 1.00 0.00 C +ATOM 56 CA SER A 56 265.837 267.007 280.792 1.00 0.00 C +ATOM 57 CA PRO A 57 264.016 266.980 284.138 1.00 0.00 C +ATOM 58 CA ALA A 58 261.681 264.292 285.494 1.00 0.00 C +ATOM 59 CA GLN A 59 258.450 263.547 283.617 1.00 0.00 C +ATOM 60 CA PRO A 60 256.305 260.576 284.658 1.00 0.00 C +ATOM 61 CA THR A 61 252.664 261.339 285.483 1.00 0.00 C +ATOM 62 CA GLY A 62 250.971 257.989 286.136 1.00 0.00 C +ATOM 63 CA GLY A 63 251.903 254.505 284.908 1.00 0.00 C +ATOM 64 CA ASP A 64 251.965 254.691 281.103 1.00 0.00 C +ATOM 65 CA ALA A 65 253.377 257.092 278.505 1.00 0.00 C +ATOM 66 CA PRO A 66 255.137 260.348 277.601 1.00 0.00 C +ATOM 67 CA ALA A 67 254.494 262.008 274.232 1.00 0.00 C +ATOM 68 CA PRO A 68 257.179 260.954 271.744 1.00 0.00 C +ATOM 69 CA LEU A 69 257.217 263.572 268.977 1.00 0.00 C +ATOM 70 CA TRP A 70 253.914 265.242 268.072 1.00 0.00 C +ATOM 71 CA SER A 71 251.853 263.832 265.195 1.00 0.00 C +ATOM 72 CA PRO A 72 249.955 265.410 262.292 1.00 0.00 C +ATOM 73 CA ALA A 73 252.702 266.760 260.023 1.00 0.00 C +ATOM 74 CA ALA A 74 255.883 264.830 260.847 1.00 0.00 C +ATOM 75 CA ALA A 75 258.623 265.072 258.212 1.00 0.00 C +ATOM 76 CA ILE A 76 261.265 267.817 258.183 1.00 0.00 C +ATOM 77 CA GLY A 77 263.391 267.069 255.111 1.00 0.00 C +ATOM 78 CA THR A 78 265.346 268.705 252.279 1.00 0.00 C +ATOM 79 CA ALA A 79 266.039 272.105 250.707 1.00 0.00 C +ATOM 80 CA GLU A 80 263.465 272.722 247.966 1.00 0.00 C +ATOM 81 CA ARG A 81 262.365 271.077 244.710 1.00 0.00 C +ATOM 82 CA ARG A 82 260.460 268.679 242.443 1.00 0.00 C +ATOM 83 CA PRO A 83 259.641 269.792 238.893 1.00 0.00 C +ATOM 84 CA ARG A 84 256.602 271.598 237.473 1.00 0.00 C +ATOM 85 CA GLU A 85 257.509 273.276 234.175 1.00 0.00 C +ATOM 86 CA GLY A 86 254.350 273.541 232.062 1.00 0.00 C +ATOM 87 CA ARG A 87 252.340 270.388 231.332 1.00 0.00 C +ATOM 88 CA GLU A 88 252.015 267.929 228.440 1.00 0.00 C +ATOM 89 CA GLY A 89 253.166 264.760 226.666 1.00 0.00 C +ATOM 90 CA GLY A 90 251.339 262.154 224.570 1.00 0.00 C +ATOM 91 CA ASN A 91 253.814 259.910 222.740 1.00 0.00 C +ATOM 92 CA GLU A 92 253.089 257.620 219.782 1.00 0.00 C +ATOM 93 CA MET A 93 253.335 253.845 219.336 1.00 0.00 C +ATOM 94 CA GLY A 94 252.308 250.994 217.026 1.00 0.00 C +ATOM 95 CA GLY A 95 255.044 248.370 216.648 1.00 0.00 C +ATOM 96 CA PRO A 96 253.362 245.089 217.609 1.00 0.00 C +ATOM 97 CA ARG A 97 255.744 242.198 216.916 1.00 0.00 C +ATOM 98 CA LEU A 98 254.576 239.028 218.677 1.00 0.00 C +ATOM 99 CA THR A 99 252.862 239.695 222.014 1.00 0.00 C +ATOM 100 CA PRO A 100 249.365 240.802 223.046 1.00 0.00 C +ATOM 101 CA GLY A 101 246.734 238.410 221.678 1.00 0.00 C +ATOM 102 CA ARG A 102 244.878 235.091 221.917 1.00 0.00 C +ATOM 103 CA ARG A 103 244.096 231.916 223.872 1.00 0.00 C +ATOM 104 CA ARG A 104 241.214 232.621 226.263 1.00 0.00 C +ATOM 105 CA ARG A 105 237.605 233.843 226.316 1.00 0.00 C +ATOM 106 CA ARG A 106 236.823 235.726 229.534 1.00 0.00 C +ATOM 107 CA GLU A 107 235.562 239.321 229.553 1.00 0.00 C +ATOM 108 CA ARG A 108 232.306 240.766 228.201 1.00 0.00 C +ATOM 109 CA ARG A 109 231.737 244.504 227.725 1.00 0.00 C +ATOM 110 CA PRO A 110 234.128 246.247 230.125 1.00 0.00 C +ATOM 111 CA GLU A 111 236.383 248.562 232.143 1.00 0.00 C +ATOM 112 CA GLN A 112 234.689 249.726 235.351 1.00 0.00 C +ATOM 113 CA LYS A 113 231.684 247.807 236.693 1.00 0.00 C +ATOM 114 CA LYS A 114 230.676 245.614 239.641 1.00 0.00 C +ATOM 115 CA ALA A 115 227.384 246.514 241.334 1.00 0.00 C +ATOM 116 CA ALA A 116 224.649 248.574 243.004 1.00 0.00 C +ATOM 117 CA ALA A 117 222.565 251.282 241.318 1.00 0.00 C +ATOM 118 CA ARG A 118 223.193 255.039 241.380 1.00 0.00 C +ATOM 119 CA HIS A 119 226.628 256.454 242.228 1.00 0.00 C +ATOM 120 CA GLY A 120 227.770 256.591 245.860 1.00 0.00 C +ATOM 121 CA SER A 121 227.192 256.067 249.589 1.00 0.00 C +ATOM 122 CA THR A 122 229.293 256.976 252.635 1.00 0.00 C +ATOM 123 CA GLY A 123 227.148 258.934 255.101 1.00 0.00 C +ATOM 124 CA THR A 124 225.592 256.949 257.956 1.00 0.00 C +ATOM 125 CA ALA A 125 222.539 254.699 257.588 1.00 0.00 C +ATOM 126 CA ALA A 126 222.397 252.679 254.360 1.00 0.00 C +ATOM 127 CA PHE A 127 225.639 250.969 253.320 1.00 0.00 C +ATOM 128 CA ARG A 128 227.311 247.675 254.253 1.00 0.00 C +ATOM 129 CA ARG A 129 228.175 245.748 257.424 1.00 0.00 C +ATOM 130 CA SER A 130 229.390 246.717 260.903 1.00 0.00 C +ATOM 131 CA ALA A 131 229.405 243.525 262.984 1.00 0.00 C +ATOM 132 CA GLY A 132 231.796 240.679 262.144 1.00 0.00 C +ATOM 133 CA GLU A 133 233.826 237.753 260.791 1.00 0.00 C +ATOM 134 CA THR A 134 234.798 238.772 257.251 1.00 0.00 C +ATOM 135 CA GLU A 135 234.646 239.289 253.480 1.00 0.00 C +ATOM 136 CA GLY A 136 232.199 241.553 251.635 1.00 0.00 C +ATOM 137 CA TRP A 137 232.462 243.766 248.545 1.00 0.00 C +ATOM 138 CA THR A 138 235.130 244.950 246.095 1.00 0.00 C +ATOM 139 CA ARG A 139 235.299 247.902 243.692 1.00 0.00 C +ATOM 140 CA SER A 140 236.157 251.218 242.023 1.00 0.00 C +ATOM 141 CA ALA A 141 236.573 254.929 241.269 1.00 0.00 C +ATOM 142 CA ARG A 142 235.778 258.439 240.017 1.00 0.00 C +ATOM 143 CA THR A 143 233.473 259.073 237.050 1.00 0.00 C +ATOM 144 CA ARG A 144 235.040 258.266 233.672 1.00 0.00 C +ATOM 145 CA ARG A 145 238.764 257.572 234.073 1.00 0.00 C +ATOM 146 CA SER A 146 242.429 257.933 233.094 1.00 0.00 C +ATOM 147 CA ARG A 147 245.323 257.592 235.548 1.00 0.00 C +ATOM 148 CA ARG A 148 245.591 256.840 239.274 1.00 0.00 C +ATOM 149 CA ARG A 149 243.842 253.505 239.850 1.00 0.00 C +ATOM 150 CA ARG A 150 243.725 251.310 236.738 1.00 0.00 C +ATOM 151 CA ARG A 151 246.564 248.887 235.974 1.00 0.00 C +ATOM 152 CA ARG A 152 244.939 245.455 235.662 1.00 0.00 C +ATOM 153 CA GLY A 153 244.682 244.572 231.964 1.00 0.00 C +ATOM 154 CA GLY A 154 242.625 246.961 229.826 1.00 0.00 C +ATOM 155 CA ARG A 155 240.578 245.661 226.888 1.00 0.00 C +ATOM 156 CA ARG A 156 238.605 248.352 225.048 1.00 0.00 C +ATOM 157 CA SER A 157 237.807 252.068 225.307 1.00 0.00 C +ATOM 158 CA GLU A 158 238.304 253.734 221.917 1.00 0.00 C +ATOM 159 CA ALA A 159 240.398 254.023 218.747 1.00 0.00 C +ATOM 160 CA THR A 160 239.531 252.094 215.577 1.00 0.00 C +ATOM 161 CA THR A 161 238.974 254.808 212.962 1.00 0.00 C +ATOM 162 CA ALA A 162 237.648 255.917 209.567 1.00 0.00 C +ATOM 163 CA ALA A 163 235.818 256.128 206.232 1.00 0.00 C +ATOM 164 CA ASP A 164 233.124 256.256 203.541 1.00 0.00 C +ATOM 165 CA ARG A 165 230.006 254.071 203.692 1.00 0.00 C +ATOM 166 CA SER A 166 230.791 251.068 201.483 1.00 0.00 C +ATOM 167 CA SER A 167 232.459 251.508 198.086 1.00 0.00 C +ATOM 168 CA ALA A 168 235.982 250.162 197.548 1.00 0.00 C +ATOM 169 CA VAL A 169 236.189 247.775 194.586 1.00 0.00 C +ATOM 170 CA THR A 170 234.985 244.166 194.803 1.00 0.00 C +ATOM 171 CA ALA A 171 232.110 242.070 196.167 1.00 0.00 C +ATOM 172 CA GLU A 172 231.062 241.447 199.776 1.00 0.00 C +ATOM 173 CA ARG A 173 229.332 242.903 202.843 1.00 0.00 C +ATOM 174 CA GLU A 174 229.737 241.674 206.426 1.00 0.00 C +ATOM 175 CA SER A 175 229.097 241.086 210.136 1.00 0.00 C +ATOM 176 CA ASP A 176 227.699 237.946 211.780 1.00 0.00 C +ATOM 177 CA GLY A 177 226.456 236.287 214.977 1.00 0.00 C +ATOM 178 CA ALA A 178 226.219 233.055 216.979 1.00 0.00 C +ATOM 179 CA SER A 179 224.998 229.451 216.788 1.00 0.00 C +ATOM 180 CA SER A 180 221.316 228.987 217.649 1.00 0.00 C +ATOM 181 CA ILE A 181 220.797 227.590 221.156 1.00 0.00 C +ATOM 182 CA PRO A 182 219.118 230.089 223.490 1.00 0.00 C +ATOM 183 CA ALA A 183 216.154 231.202 225.609 1.00 0.00 C +ATOM 184 CA GLU A 184 213.622 229.485 227.881 1.00 0.00 C +ATOM 185 CA ARG A 185 212.792 226.233 229.684 1.00 0.00 C +ATOM 186 CA GLU A 186 211.367 223.088 228.072 1.00 0.00 C +ATOM 187 CA SER A 187 211.641 222.276 224.360 1.00 0.00 C +ATOM 188 CA GLY A 188 208.858 219.918 223.259 1.00 0.00 C +ATOM 189 CA GLU A 189 205.449 220.559 224.836 1.00 0.00 C +ATOM 190 CA TRP A 190 203.575 223.841 224.353 1.00 0.00 C +ATOM 191 CA ARG A 191 203.296 227.615 223.919 1.00 0.00 C +ATOM 192 CA LYS A 192 206.218 229.988 224.506 1.00 0.00 C +ATOM 193 CA ARG A 193 208.937 231.213 222.134 1.00 0.00 C +ATOM 194 CA TRP A 194 208.929 231.996 218.406 1.00 0.00 C +ATOM 195 CA ARG A 195 211.629 233.824 216.436 1.00 0.00 C +ATOM 196 CA GLU A 196 212.220 237.579 216.179 1.00 0.00 C +ATOM 197 CA ALA A 197 214.065 240.811 215.363 1.00 0.00 C +ATOM 198 CA ARG A 198 217.265 241.910 217.114 1.00 0.00 C +ATOM 199 CA GLY A 199 218.759 241.151 220.536 1.00 0.00 C +ATOM 200 CA ALA A 200 219.209 237.810 222.310 1.00 0.00 C +ATOM 201 CA PHE A 201 218.354 237.481 226.008 1.00 0.00 C +ATOM 202 CA ILE A 202 215.366 236.841 228.283 1.00 0.00 C +TER 203 ILE A 202 +END diff --git a/Plants/Q8L7Q1/Q8L7Q1.dcd b/Plants/Q8L7Q1/Q8L7Q1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..2e11c0efe529c024bb5f67cf056a22a614280ed1 --- /dev/null +++ b/Plants/Q8L7Q1/Q8L7Q1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:d27cf466cfc8a1c370a96fe6c5ad51624d295eef9eb28fd1d904226344b13fa6 +size 36840276 diff --git a/Plants/Q8L7Q1/top.pdb b/Plants/Q8L7Q1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..844353276cd6b0bd32c7e551a31c6363231ec7a2 --- /dev/null +++ b/Plants/Q8L7Q1/top.pdb @@ -0,0 +1,202 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 249.322 258.430 217.617 1.00 0.00 C +ATOM 2 CA SER A 2 248.032 258.804 214.052 1.00 0.00 C +ATOM 3 CA SER A 3 248.802 262.422 213.137 1.00 0.00 C +ATOM 4 CA ILE A 4 246.759 265.391 214.372 1.00 0.00 C +ATOM 5 CA PHE A 5 243.362 264.561 215.884 1.00 0.00 C +ATOM 6 CA ALA A 6 243.155 266.056 219.382 1.00 0.00 C +ATOM 7 CA SER A 7 240.795 268.876 220.380 1.00 0.00 C +ATOM 8 CA ILE A 8 242.441 271.858 222.087 1.00 0.00 C +ATOM 9 CA THR A 9 246.120 272.389 222.922 1.00 0.00 C +ATOM 10 CA ALA A 10 248.809 269.763 222.296 1.00 0.00 C +ATOM 11 CA PRO A 11 250.344 266.401 221.371 1.00 0.00 C +ATOM 12 CA LYS A 12 252.168 263.904 223.596 1.00 0.00 C +ATOM 13 CA LYS A 13 252.236 260.375 225.032 1.00 0.00 C +ATOM 14 CA PRO A 14 251.010 259.570 228.548 1.00 0.00 C +ATOM 15 CA LEU A 15 247.554 259.613 230.152 1.00 0.00 C +ATOM 16 CA LEU A 16 247.818 259.070 233.914 1.00 0.00 C +ATOM 17 CA THR A 17 249.464 260.971 236.776 1.00 0.00 C +ATOM 18 CA GLN A 18 251.411 264.232 237.079 1.00 0.00 C +ATOM 19 CA LYS A 19 255.189 264.667 236.858 1.00 0.00 C +ATOM 20 CA THR A 20 257.331 264.947 239.997 1.00 0.00 C +ATOM 21 CA ALA A 21 255.192 264.798 243.147 1.00 0.00 C +ATOM 22 CA GLN A 22 256.103 261.835 245.362 1.00 0.00 C +ATOM 23 CA PRO A 23 253.879 258.755 245.649 1.00 0.00 C +ATOM 24 CA GLU A 24 254.759 256.568 248.643 1.00 0.00 C +ATOM 25 CA VAL A 25 253.004 253.222 249.130 1.00 0.00 C +ATOM 26 CA ALA A 26 253.652 250.651 246.394 1.00 0.00 C +ATOM 27 CA LYS A 27 256.301 248.055 245.524 1.00 0.00 C +ATOM 28 CA PRO A 28 255.320 246.419 242.226 1.00 0.00 C +ATOM 29 CA LEU A 29 254.900 247.678 238.655 1.00 0.00 C +ATOM 30 CA ALA A 30 252.611 246.989 235.688 1.00 0.00 C +ATOM 31 CA LEU A 31 253.194 244.442 232.915 1.00 0.00 C +ATOM 32 CA GLU A 32 250.669 243.102 230.396 1.00 0.00 C +ATOM 33 CA GLU A 33 249.907 241.849 226.880 1.00 0.00 C +ATOM 34 CA PRO A 34 252.127 239.332 225.076 1.00 0.00 C +ATOM 35 CA THR A 35 252.070 237.359 221.817 1.00 0.00 C +ATOM 36 CA LYS A 36 255.100 237.346 219.508 1.00 0.00 C +ATOM 37 CA PRO A 37 255.021 239.343 216.264 1.00 0.00 C +ATOM 38 CA LEU A 38 256.901 240.530 213.170 1.00 0.00 C +ATOM 39 CA ALA A 39 259.568 243.060 214.171 1.00 0.00 C +ATOM 40 CA ILE A 40 258.984 246.617 212.939 1.00 0.00 C +ATOM 41 CA GLU A 41 260.111 249.773 214.752 1.00 0.00 C +ATOM 42 CA ALA A 42 261.868 250.888 217.944 1.00 0.00 C +ATOM 43 CA PRO A 43 264.111 253.074 220.114 1.00 0.00 C +ATOM 44 CA PRO A 44 267.842 252.597 220.721 1.00 0.00 C +ATOM 45 CA SER A 45 270.104 253.985 223.456 1.00 0.00 C +ATOM 46 CA SER A 46 272.505 251.233 224.543 1.00 0.00 C +ATOM 47 CA GLU A 47 273.609 250.843 228.168 1.00 0.00 C +ATOM 48 CA ALA A 48 277.410 250.591 228.204 1.00 0.00 C +ATOM 49 CA PRO A 49 280.097 250.928 230.884 1.00 0.00 C +ATOM 50 CA GLN A 50 280.529 248.831 234.036 1.00 0.00 C +ATOM 51 CA THR A 51 280.147 250.134 237.596 1.00 0.00 C +ATOM 52 CA GLU A 52 283.453 250.131 239.489 1.00 0.00 C +ATOM 53 CA SER A 53 286.309 252.525 240.282 1.00 0.00 C +ATOM 54 CA ALA A 54 285.953 255.208 242.964 1.00 0.00 C +ATOM 55 CA PRO A 55 283.646 253.939 245.717 1.00 0.00 C +ATOM 56 CA GLU A 56 280.516 252.956 247.656 1.00 0.00 C +ATOM 57 CA THR A 57 278.944 249.944 245.933 1.00 0.00 C +ATOM 58 CA ALA A 58 275.288 249.724 246.982 1.00 0.00 C +ATOM 59 CA ALA A 59 273.906 246.443 248.339 1.00 0.00 C +ATOM 60 CA ALA A 60 274.113 242.836 249.546 1.00 0.00 C +ATOM 61 CA ALA A 61 271.885 239.757 249.816 1.00 0.00 C +ATOM 62 CA GLU A 62 270.075 239.336 246.490 1.00 0.00 C +ATOM 63 CA SER A 63 269.120 236.263 244.451 1.00 0.00 C +ATOM 64 CA PRO A 64 268.933 233.290 242.075 1.00 0.00 C +ATOM 65 CA ALA A 65 268.475 230.040 240.140 1.00 0.00 C +ATOM 66 CA PRO A 66 271.379 227.601 240.501 1.00 0.00 C +ATOM 67 CA GLU A 67 273.170 224.294 241.113 1.00 0.00 C +ATOM 68 CA THR A 68 275.435 224.252 244.177 1.00 0.00 C +ATOM 69 CA ALA A 69 278.165 226.199 245.986 1.00 0.00 C +ATOM 70 CA ALA A 70 278.064 229.995 245.679 1.00 0.00 C +ATOM 71 CA VAL A 71 276.921 232.476 248.335 1.00 0.00 C +ATOM 72 CA ALA A 72 277.653 234.933 251.153 1.00 0.00 C +ATOM 73 CA GLU A 73 279.085 233.966 254.548 1.00 0.00 C +ATOM 74 CA SER A 74 279.015 230.492 256.113 1.00 0.00 C +ATOM 75 CA PRO A 75 276.509 228.381 254.169 1.00 0.00 C +ATOM 76 CA ALA A 76 272.838 228.962 253.331 1.00 0.00 C +ATOM 77 CA PRO A 77 269.486 229.836 251.744 1.00 0.00 C +ATOM 78 CA GLY A 78 266.114 228.073 251.547 1.00 0.00 C +ATOM 79 CA THR A 79 262.378 228.804 251.393 1.00 0.00 C +ATOM 80 CA ALA A 80 258.949 229.842 250.097 1.00 0.00 C +ATOM 81 CA ALA A 81 257.276 228.893 246.809 1.00 0.00 C +ATOM 82 CA VAL A 82 253.490 228.863 246.380 1.00 0.00 C +ATOM 83 CA ALA A 83 250.498 227.541 248.333 1.00 0.00 C +ATOM 84 CA GLU A 84 247.193 228.639 246.788 1.00 0.00 C +ATOM 85 CA ALA A 85 244.340 231.139 246.435 1.00 0.00 C +ATOM 86 CA PRO A 86 242.285 234.266 247.155 1.00 0.00 C +ATOM 87 CA ALA A 87 241.608 234.705 250.879 1.00 0.00 C +ATOM 88 CA SER A 88 239.290 237.484 252.069 1.00 0.00 C +ATOM 89 CA GLU A 89 237.793 239.177 249.001 1.00 0.00 C +ATOM 90 CA THR A 90 234.134 238.151 248.734 1.00 0.00 C +ATOM 91 CA ALA A 91 231.917 236.665 246.015 1.00 0.00 C +ATOM 92 CA ALA A 92 233.407 237.206 242.551 1.00 0.00 C +ATOM 93 CA ALA A 93 236.836 238.568 241.603 1.00 0.00 C +ATOM 94 CA PRO A 94 236.438 241.059 238.748 1.00 0.00 C +ATOM 95 CA VAL A 95 234.366 241.294 235.559 1.00 0.00 C +ATOM 96 CA ASP A 96 234.456 240.771 231.786 1.00 0.00 C +ATOM 97 CA GLY A 97 235.657 243.447 229.355 1.00 0.00 C +ATOM 98 CA PRO A 98 234.996 246.939 227.982 1.00 0.00 C +ATOM 99 CA VAL A 99 236.029 249.959 225.902 1.00 0.00 C +ATOM 100 CA THR A 100 238.289 252.616 224.371 1.00 0.00 C +ATOM 101 CA GLU A 101 239.544 256.130 225.141 1.00 0.00 C +ATOM 102 CA THR A 102 243.294 256.757 225.387 1.00 0.00 C +ATOM 103 CA VAL A 103 246.122 258.243 223.310 1.00 0.00 C +ATOM 104 CA SER A 104 245.670 262.024 223.199 1.00 0.00 C +ATOM 105 CA GLU A 105 244.915 264.360 226.112 1.00 0.00 C +ATOM 106 CA PRO A 106 241.499 265.027 227.664 1.00 0.00 C +ATOM 107 CA PRO A 107 237.887 266.024 228.349 1.00 0.00 C +ATOM 108 CA PRO A 108 236.610 269.081 230.231 1.00 0.00 C +ATOM 109 CA VAL A 109 237.774 270.376 233.620 1.00 0.00 C +ATOM 110 CA GLU A 110 238.785 269.439 237.172 1.00 0.00 C +ATOM 111 CA LYS A 111 240.574 266.259 238.271 1.00 0.00 C +ATOM 112 CA GLU A 112 241.915 265.099 241.643 1.00 0.00 C +ATOM 113 CA GLU A 113 240.877 263.110 244.722 1.00 0.00 C +ATOM 114 CA THR A 114 238.407 261.845 247.333 1.00 0.00 C +ATOM 115 CA SER A 115 237.446 262.968 250.845 1.00 0.00 C +ATOM 116 CA LEU A 116 236.910 265.722 253.422 1.00 0.00 C +ATOM 117 CA GLU A 117 234.248 268.430 253.731 1.00 0.00 C +ATOM 118 CA GLU A 118 230.719 269.853 253.531 1.00 0.00 C +ATOM 119 CA LYS A 119 228.510 271.423 256.209 1.00 0.00 C +ATOM 120 CA SER A 120 227.000 268.550 258.205 1.00 0.00 C +ATOM 121 CA ASP A 121 225.495 265.790 260.357 1.00 0.00 C +ATOM 122 CA PRO A 122 227.633 264.692 263.313 1.00 0.00 C +ATOM 123 CA SER A 123 227.374 263.720 266.988 1.00 0.00 C +ATOM 124 CA SER A 124 224.740 262.342 269.371 1.00 0.00 C +ATOM 125 CA THR A 125 224.686 258.605 268.631 1.00 0.00 C +ATOM 126 CA PRO A 126 227.382 256.042 269.456 1.00 0.00 C +ATOM 127 CA ASN A 127 229.713 256.540 272.428 1.00 0.00 C +ATOM 128 CA THR A 128 232.698 258.787 273.174 1.00 0.00 C +ATOM 129 CA GLU A 129 236.443 258.283 272.688 1.00 0.00 C +ATOM 130 CA THR A 130 237.896 257.195 269.339 1.00 0.00 C +ATOM 131 CA ALA A 131 241.638 256.482 269.241 1.00 0.00 C +ATOM 132 CA THR A 132 245.322 255.709 269.829 1.00 0.00 C +ATOM 133 CA SER A 133 247.241 252.887 268.134 1.00 0.00 C +ATOM 134 CA THR A 134 245.738 249.609 266.903 1.00 0.00 C +ATOM 135 CA GLU A 135 245.290 245.921 266.058 1.00 0.00 C +ATOM 136 CA ASN A 136 242.187 244.246 267.501 1.00 0.00 C +ATOM 137 CA THR A 137 238.833 246.051 267.575 1.00 0.00 C +ATOM 138 CA SER A 138 235.225 246.725 266.553 1.00 0.00 C +ATOM 139 CA GLN A 139 234.695 250.315 265.393 1.00 0.00 C +ATOM 140 CA THR A 140 236.280 252.224 262.501 1.00 0.00 C +ATOM 141 CA THR A 141 233.638 253.156 259.920 1.00 0.00 C +ATOM 142 CA THR A 142 232.300 256.578 260.928 1.00 0.00 C +ATOM 143 CA THR A 143 230.972 256.291 264.487 1.00 0.00 C +ATOM 144 CA PRO A 144 232.606 259.164 266.384 1.00 0.00 C +ATOM 145 CA GLU A 145 233.981 261.868 264.079 1.00 0.00 C +ATOM 146 CA SER A 146 237.360 263.324 265.065 1.00 0.00 C +ATOM 147 CA VAL A 147 239.917 266.142 264.863 1.00 0.00 C +ATOM 148 CA THR A 148 241.354 267.606 268.073 1.00 0.00 C +ATOM 149 CA THR A 149 240.870 271.126 269.449 1.00 0.00 C +ATOM 150 CA ALA A 150 243.450 273.792 268.582 1.00 0.00 C +ATOM 151 CA PRO A 151 242.017 276.861 266.839 1.00 0.00 C +ATOM 152 CA PRO A 152 243.110 277.456 263.238 1.00 0.00 C +ATOM 153 CA GLU A 153 245.373 278.060 260.233 1.00 0.00 C +ATOM 154 CA PRO A 154 248.004 277.709 257.500 1.00 0.00 C +ATOM 155 CA ILE A 155 249.908 274.481 258.184 1.00 0.00 C +ATOM 156 CA THR A 156 253.523 275.590 258.654 1.00 0.00 C +ATOM 157 CA THR A 157 255.087 275.526 262.127 1.00 0.00 C +ATOM 158 CA ALA A 158 258.151 274.753 264.256 1.00 0.00 C +ATOM 159 CA PRO A 159 259.506 271.276 263.488 1.00 0.00 C +ATOM 160 CA PRO A 160 259.757 268.804 266.377 1.00 0.00 C +ATOM 161 CA GLU A 161 257.851 267.626 269.458 1.00 0.00 C +ATOM 162 CA THR A 162 255.062 265.841 271.342 1.00 0.00 C +ATOM 163 CA VAL A 163 252.713 263.230 269.863 1.00 0.00 C +ATOM 164 CA THR A 164 251.100 259.869 269.079 1.00 0.00 C +ATOM 165 CA THR A 165 252.332 256.760 270.905 1.00 0.00 C +ATOM 166 CA THR A 166 251.278 254.623 273.877 1.00 0.00 C +ATOM 167 CA ALA A 167 252.436 255.732 277.334 1.00 0.00 C +ATOM 168 CA VAL A 168 254.448 253.267 279.429 1.00 0.00 C +ATOM 169 CA LYS A 169 256.242 249.957 278.846 1.00 0.00 C +ATOM 170 CA PRO A 170 257.603 246.620 277.609 1.00 0.00 C +ATOM 171 CA THR A 171 257.887 246.865 273.818 1.00 0.00 C +ATOM 172 CA GLU A 172 255.960 249.126 271.433 1.00 0.00 C +ATOM 173 CA ASN A 173 254.642 246.830 268.693 1.00 0.00 C +ATOM 174 CA ALA A 174 253.527 246.337 265.083 1.00 0.00 C +ATOM 175 CA ALA A 175 251.583 243.066 264.886 1.00 0.00 C +ATOM 176 CA THR A 176 250.680 241.614 268.290 1.00 0.00 C +ATOM 177 CA GLU A 177 251.259 239.791 271.586 1.00 0.00 C +ATOM 178 CA ARG A 178 252.480 240.012 275.188 1.00 0.00 C +ATOM 179 CA ARG A 179 251.720 243.031 277.384 1.00 0.00 C +ATOM 180 CA VAL A 180 250.468 246.372 278.723 1.00 0.00 C +ATOM 181 CA THR A 181 246.919 246.224 280.099 1.00 0.00 C +ATOM 182 CA ASN A 182 243.658 244.254 280.036 1.00 0.00 C +ATOM 183 CA TYR A 183 243.881 240.536 280.834 1.00 0.00 C +ATOM 184 CA PRO A 184 243.669 236.993 279.448 1.00 0.00 C +ATOM 185 CA PRO A 185 244.046 233.814 281.514 1.00 0.00 C +ATOM 186 CA ILE A 186 243.240 230.336 282.844 1.00 0.00 C +ATOM 187 CA ARG A 187 244.302 226.717 283.381 1.00 0.00 C +ATOM 188 CA SER A 188 241.583 224.582 284.983 1.00 0.00 C +ATOM 189 CA GLN A 189 239.417 221.582 284.074 1.00 0.00 C +ATOM 190 CA PRO A 190 237.576 221.787 280.745 1.00 0.00 C +ATOM 191 CA ILE A 191 234.284 219.881 280.528 1.00 0.00 C +ATOM 192 CA ASP A 192 232.805 219.929 277.017 1.00 0.00 C +ATOM 193 CA PHE A 193 233.366 218.034 273.760 1.00 0.00 C +ATOM 194 CA ASP A 194 231.049 219.010 270.897 1.00 0.00 C +ATOM 195 CA PHE A 195 227.565 217.565 270.364 1.00 0.00 C +ATOM 196 CA LEU A 196 225.789 217.601 273.734 1.00 0.00 C +ATOM 197 CA ASN A 197 223.217 220.373 274.201 1.00 0.00 C +ATOM 198 CA GLY A 198 220.472 220.757 276.816 1.00 0.00 C +TER 199 GLY A 198 +END diff --git a/Plants/Q8L874/Q8L874.dcd b/Plants/Q8L874/Q8L874.dcd new file mode 100644 index 0000000000000000000000000000000000000000..bed345ef1f66bd959716b9e64a5a47a09b691488 --- /dev/null +++ b/Plants/Q8L874/Q8L874.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c8e1e85986d69cc8f3671735087321316d7c71e0448594768a6eb826bbd30f90 +size 13400276 diff --git a/Plants/Q8L874/top.pdb b/Plants/Q8L874/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..d9e84520b5e4733024adc95de7a3e26c802839c0 --- /dev/null +++ b/Plants/Q8L874/top.pdb @@ -0,0 +1,109 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 222.095 284.063 278.096 1.00 0.00 C +ATOM 2 CA ALA A 2 220.117 280.807 278.050 1.00 0.00 C +ATOM 3 CA SER A 3 216.818 278.903 278.125 1.00 0.00 C +ATOM 4 CA LYS A 4 214.272 276.869 280.100 1.00 0.00 C +ATOM 5 CA LYS A 5 213.747 273.100 279.912 1.00 0.00 C +ATOM 6 CA VAL A 6 216.854 270.964 280.455 1.00 0.00 C +ATOM 7 CA ASP A 7 217.683 268.952 277.328 1.00 0.00 C +ATOM 8 CA GLY A 8 218.838 268.643 273.710 1.00 0.00 C +ATOM 9 CA GLU A 9 217.422 265.715 271.725 1.00 0.00 C +ATOM 10 CA GLY A 10 218.304 262.880 269.339 1.00 0.00 C +ATOM 11 CA LYS A 11 219.541 262.189 265.802 1.00 0.00 C +ATOM 12 CA GLY A 12 218.663 263.639 262.390 1.00 0.00 C +ATOM 13 CA LYS A 13 219.339 263.688 258.641 1.00 0.00 C +ATOM 14 CA ALA A 14 216.437 265.546 257.016 1.00 0.00 C +ATOM 15 CA ILE A 15 217.240 268.931 255.461 1.00 0.00 C +ATOM 16 CA ALA A 16 220.384 270.800 256.527 1.00 0.00 C +ATOM 17 CA ASN A 17 223.676 269.411 257.850 1.00 0.00 C +ATOM 18 CA THR A 18 227.438 269.233 258.427 1.00 0.00 C +ATOM 19 CA ARG A 19 230.344 268.142 260.636 1.00 0.00 C +ATOM 20 CA MET A 20 232.672 265.520 259.145 1.00 0.00 C +ATOM 21 CA LEU A 21 236.145 265.021 257.661 1.00 0.00 C +ATOM 22 CA ARG A 22 239.657 264.944 259.137 1.00 0.00 C +ATOM 23 CA SER A 23 240.304 268.495 260.356 1.00 0.00 C +ATOM 24 CA MET A 24 238.168 269.799 263.229 1.00 0.00 C +ATOM 25 CA ASP A 25 235.145 270.590 265.408 1.00 0.00 C +ATOM 26 CA ARG A 26 235.065 271.370 269.137 1.00 0.00 C +ATOM 27 CA LYS A 27 234.254 270.329 272.711 1.00 0.00 C +ATOM 28 CA THR A 28 237.453 269.608 274.651 1.00 0.00 C +ATOM 29 CA ARG A 29 239.390 266.334 274.443 1.00 0.00 C +ATOM 30 CA SER A 30 239.806 263.561 277.022 1.00 0.00 C +ATOM 31 CA ASP A 31 242.930 261.512 277.769 1.00 0.00 C +ATOM 32 CA THR A 32 244.408 262.991 280.954 1.00 0.00 C +ATOM 33 CA LYS A 33 243.778 262.204 284.629 1.00 0.00 C +ATOM 34 CA ARG A 34 247.047 262.332 286.582 1.00 0.00 C +ATOM 35 CA ASP A 35 247.685 262.111 290.332 1.00 0.00 C +ATOM 36 CA GLY A 36 250.517 259.813 291.434 1.00 0.00 C +ATOM 37 CA SER A 37 252.060 256.374 290.881 1.00 0.00 C +ATOM 38 CA SER A 38 251.472 253.437 288.526 1.00 0.00 C +ATOM 39 CA SER A 39 250.053 252.364 285.157 1.00 0.00 C +ATOM 40 CA LYS A 40 249.117 249.242 283.184 1.00 0.00 C +ATOM 41 CA LEU A 41 248.846 249.739 279.416 1.00 0.00 C +ATOM 42 CA MET A 42 249.868 252.894 277.541 1.00 0.00 C +ATOM 43 CA LYS A 43 250.190 256.681 277.813 1.00 0.00 C +ATOM 44 CA ILE A 44 252.700 258.141 275.346 1.00 0.00 C +ATOM 45 CA GLU A 45 251.450 257.323 271.841 1.00 0.00 C +ATOM 46 CA SER A 46 247.976 258.004 270.433 1.00 0.00 C +ATOM 47 CA PRO A 47 245.375 257.589 267.680 1.00 0.00 C +ATOM 48 CA GLU A 48 241.649 257.519 268.474 1.00 0.00 C +ATOM 49 CA LYS A 49 238.628 258.620 270.518 1.00 0.00 C +ATOM 50 CA LYS A 50 235.781 260.475 272.242 1.00 0.00 C +ATOM 51 CA LYS A 51 234.189 263.663 270.894 1.00 0.00 C +ATOM 52 CA ARG A 52 234.169 264.316 267.140 1.00 0.00 C +ATOM 53 CA LYS A 53 233.346 262.106 264.148 1.00 0.00 C +ATOM 54 CA THR A 54 234.511 258.812 262.631 1.00 0.00 C +ATOM 55 CA THR A 55 232.189 255.824 262.183 1.00 0.00 C +ATOM 56 CA LYS A 56 228.869 254.175 263.062 1.00 0.00 C +ATOM 57 CA ALA A 57 229.878 250.828 264.577 1.00 0.00 C +ATOM 58 CA LYS A 58 229.927 247.095 263.816 1.00 0.00 C +ATOM 59 CA ASN A 59 231.174 244.381 261.450 1.00 0.00 C +ATOM 60 CA VAL A 60 233.018 241.068 261.077 1.00 0.00 C +ATOM 61 CA GLY A 61 236.524 241.384 262.535 1.00 0.00 C +ATOM 62 CA ALA A 62 239.817 239.680 261.661 1.00 0.00 C +ATOM 63 CA ALA A 63 240.262 240.059 257.896 1.00 0.00 C +ATOM 64 CA LYS A 64 241.488 240.955 254.401 1.00 0.00 C +ATOM 65 CA LYS A 65 240.843 241.657 250.712 1.00 0.00 C +ATOM 66 CA LYS A 66 242.214 242.602 247.285 1.00 0.00 C +ATOM 67 CA VAL A 67 244.275 242.306 244.095 1.00 0.00 C +ATOM 68 CA LYS A 68 244.197 239.268 241.796 1.00 0.00 C +ATOM 69 CA LYS A 69 244.919 237.774 238.366 1.00 0.00 C +ATOM 70 CA GLU A 70 246.339 236.344 235.133 1.00 0.00 C +ATOM 71 CA GLU A 71 247.684 232.885 235.998 1.00 0.00 C +ATOM 72 CA VAL A 72 251.370 232.025 236.433 1.00 0.00 C +ATOM 73 CA ALA A 73 254.036 232.384 239.131 1.00 0.00 C +ATOM 74 CA VAL A 74 257.816 232.643 238.733 1.00 0.00 C +ATOM 75 CA LYS A 75 261.241 234.163 238.043 1.00 0.00 C +ATOM 76 CA ILE A 76 264.623 235.731 237.255 1.00 0.00 C +ATOM 77 CA GLU A 77 264.235 237.796 234.076 1.00 0.00 C +ATOM 78 CA LYS A 78 266.363 240.778 233.030 1.00 0.00 C +ATOM 79 CA GLU A 79 266.815 240.931 229.250 1.00 0.00 C +ATOM 80 CA GLU A 80 264.698 241.158 226.090 1.00 0.00 C +ATOM 81 CA GLU A 81 266.578 239.288 223.353 1.00 0.00 C +ATOM 82 CA GLU A 82 268.084 236.008 224.571 1.00 0.00 C +ATOM 83 CA ASP A 83 270.167 234.133 221.990 1.00 0.00 C +ATOM 84 CA ASP A 84 272.233 231.127 220.889 1.00 0.00 C +ATOM 85 CA ASP A 85 272.520 227.361 220.383 1.00 0.00 C +ATOM 86 CA ALA A 86 274.436 225.943 217.411 1.00 0.00 C +ATOM 87 CA ALA A 87 277.165 223.730 215.936 1.00 0.00 C +ATOM 88 CA GLU A 88 280.240 223.978 213.701 1.00 0.00 C +ATOM 89 CA LYS A 89 281.594 224.494 210.177 1.00 0.00 C +ATOM 90 CA GLU A 90 281.989 221.990 207.333 1.00 0.00 C +ATOM 91 CA GLU A 91 284.018 220.686 204.383 1.00 0.00 C +ATOM 92 CA ASP A 92 287.083 221.526 202.283 1.00 0.00 C +ATOM 93 CA ASP A 93 290.759 222.406 201.805 1.00 0.00 C +ATOM 94 CA ASP A 94 292.925 221.099 204.654 1.00 0.00 C +ATOM 95 CA SER A 95 296.025 219.541 203.079 1.00 0.00 C +ATOM 96 CA ASP A 96 299.238 221.425 202.277 1.00 0.00 C +ATOM 97 CA LYS A 97 299.522 224.920 200.787 1.00 0.00 C +ATOM 98 CA LYS A 98 302.966 226.236 199.826 1.00 0.00 C +ATOM 99 CA LYS A 99 303.399 228.837 197.076 1.00 0.00 C +ATOM 100 CA ILE A 100 300.024 230.183 195.930 1.00 0.00 C +ATOM 101 CA VAL A 101 299.308 233.488 194.175 1.00 0.00 C +ATOM 102 CA ILE A 102 297.335 236.721 193.761 1.00 0.00 C +ATOM 103 CA GLU A 103 295.657 238.744 191.002 1.00 0.00 C +ATOM 104 CA HIS A 104 296.808 242.050 189.500 1.00 0.00 C +ATOM 105 CA TRP A 105 300.096 241.886 187.581 1.00 0.00 C +TER 106 TRP A 105 +END diff --git a/Plants/Q8L8Y4/Q8L8Y4.dcd b/Plants/Q8L8Y4/Q8L8Y4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..bcd635aec110e279dfd2c80f9b59131145e9c9b9 --- /dev/null +++ b/Plants/Q8L8Y4/Q8L8Y4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:1d8d67d83541a6c8fdcec5b7bdd9972c6885049a194f7ee428a2a914622d2495 +size 12200276 diff --git a/Plants/Q8L8Y4/top.pdb b/Plants/Q8L8Y4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..07743b2a05e8b79a916e391285833b4641b0e764 --- /dev/null +++ b/Plants/Q8L8Y4/top.pdb @@ -0,0 +1,99 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 194.195 266.101 230.102 1.00 0.00 C +ATOM 2 CA ALA A 2 195.368 268.166 233.081 1.00 0.00 C +ATOM 3 CA ASP A 3 193.634 268.916 236.390 1.00 0.00 C +ATOM 4 CA GLU A 4 195.403 268.575 239.747 1.00 0.00 C +ATOM 5 CA LYS A 5 198.542 270.698 239.350 1.00 0.00 C +ATOM 6 CA GLU A 6 200.527 272.863 241.776 1.00 0.00 C +ATOM 7 CA ILE A 7 199.949 276.598 241.299 1.00 0.00 C +ATOM 8 CA VAL A 8 202.608 277.779 238.838 1.00 0.00 C +ATOM 9 CA ASP A 9 204.443 281.050 238.166 1.00 0.00 C +ATOM 10 CA ILE A 10 206.630 283.839 236.768 1.00 0.00 C +ATOM 11 CA TYR A 11 209.401 286.454 236.720 1.00 0.00 C +ATOM 12 CA SER A 12 212.821 286.123 238.365 1.00 0.00 C +ATOM 13 CA SER A 13 216.538 286.936 238.172 1.00 0.00 C +ATOM 14 CA ASP A 14 220.270 286.234 238.488 1.00 0.00 C +ATOM 15 CA GLU A 15 222.460 283.183 237.842 1.00 0.00 C +ATOM 16 CA GLU A 16 221.495 280.326 235.514 1.00 0.00 C +ATOM 17 CA TYR A 17 223.267 278.356 232.776 1.00 0.00 C +ATOM 18 CA ASP A 18 221.783 275.163 231.322 1.00 0.00 C +ATOM 19 CA GLU A 19 218.117 274.861 230.330 1.00 0.00 C +ATOM 20 CA ASP A 20 216.612 271.868 232.144 1.00 0.00 C +ATOM 21 CA ASP A 21 215.705 268.168 232.187 1.00 0.00 C +ATOM 22 CA ASP A 22 216.543 265.279 229.848 1.00 0.00 C +ATOM 23 CA ASP A 23 214.212 264.129 227.062 1.00 0.00 C +ATOM 24 CA ASP A 24 215.330 264.807 223.483 1.00 0.00 C +ATOM 25 CA ASP A 25 215.841 265.231 219.731 1.00 0.00 C +ATOM 26 CA ASP A 26 216.670 267.854 217.095 1.00 0.00 C +ATOM 27 CA THR A 27 219.516 268.389 214.620 1.00 0.00 C +ATOM 28 CA ASP A 28 220.231 268.994 210.927 1.00 0.00 C +ATOM 29 CA GLY A 29 223.442 267.772 209.281 1.00 0.00 C +ATOM 30 CA GLU A 30 226.384 269.465 207.551 1.00 0.00 C +ATOM 31 CA SER A 31 228.916 270.854 210.037 1.00 0.00 C +ATOM 32 CA SER A 32 232.659 271.567 210.051 1.00 0.00 C +ATOM 33 CA ASP A 33 235.484 273.941 210.997 1.00 0.00 C +ATOM 34 CA GLU A 34 235.804 274.481 214.754 1.00 0.00 C +ATOM 35 CA ASP A 35 235.587 275.604 218.389 1.00 0.00 C +ATOM 36 CA ASP A 36 239.172 275.861 219.653 1.00 0.00 C +ATOM 37 CA GLU A 37 241.768 273.356 220.880 1.00 0.00 C +ATOM 38 CA GLU A 38 244.338 270.556 221.151 1.00 0.00 C +ATOM 39 CA GLU A 39 247.700 268.924 221.890 1.00 0.00 C +ATOM 40 CA ASP A 40 249.984 266.237 220.448 1.00 0.00 C +ATOM 41 CA ARG A 41 252.551 264.924 217.957 1.00 0.00 C +ATOM 42 CA ASN A 42 252.173 262.071 215.461 1.00 0.00 C +ATOM 43 CA LEU A 43 249.991 258.983 215.933 1.00 0.00 C +ATOM 44 CA SER A 44 250.172 255.319 214.905 1.00 0.00 C +ATOM 45 CA GLY A 45 252.725 253.096 216.654 1.00 0.00 C +ATOM 46 CA ASP A 46 252.798 251.178 219.945 1.00 0.00 C +ATOM 47 CA ASP A 47 253.223 253.038 223.243 1.00 0.00 C +ATOM 48 CA SER A 48 254.216 250.585 225.984 1.00 0.00 C +ATOM 49 CA GLU A 49 254.498 246.825 225.442 1.00 0.00 C +ATOM 50 CA SER A 50 256.491 243.952 223.928 1.00 0.00 C +ATOM 51 CA SER A 51 259.355 242.635 226.068 1.00 0.00 C +ATOM 52 CA GLU A 52 260.235 242.985 229.758 1.00 0.00 C +ATOM 53 CA ASP A 53 258.699 240.308 231.992 1.00 0.00 C +ATOM 54 CA ASP A 54 259.954 237.861 234.629 1.00 0.00 C +ATOM 55 CA TYR A 55 261.485 236.875 237.976 1.00 0.00 C +ATOM 56 CA THR A 56 262.402 239.968 240.002 1.00 0.00 C +ATOM 57 CA ASP A 57 261.968 242.523 242.796 1.00 0.00 C +ATOM 58 CA SER A 58 260.790 244.664 245.719 1.00 0.00 C +ATOM 59 CA ASN A 59 258.906 244.080 248.978 1.00 0.00 C +ATOM 60 CA SER A 60 260.737 244.396 252.304 1.00 0.00 C +ATOM 61 CA ASP A 61 264.335 243.149 252.172 1.00 0.00 C +ATOM 62 CA SER A 62 266.127 242.362 255.441 1.00 0.00 C +ATOM 63 CA ASP A 63 266.217 240.418 258.716 1.00 0.00 C +ATOM 64 CA ASP A 64 268.122 237.336 259.895 1.00 0.00 C +ATOM 65 CA ASP A 65 267.490 236.641 263.587 1.00 0.00 C +ATOM 66 CA ASP A 66 270.110 237.676 266.152 1.00 0.00 C +ATOM 67 CA GLU A 67 271.268 237.037 269.725 1.00 0.00 C +ATOM 68 CA GLU A 68 268.415 235.881 271.970 1.00 0.00 C +ATOM 69 CA ASP A 69 264.625 235.579 271.730 1.00 0.00 C +ATOM 70 CA ASP A 70 263.413 233.746 274.842 1.00 0.00 C +ATOM 71 CA ASP A 71 265.474 235.147 277.724 1.00 0.00 C +ATOM 72 CA ASP A 72 266.420 232.883 280.640 1.00 0.00 C +ATOM 73 CA GLU A 73 267.046 229.140 280.978 1.00 0.00 C +ATOM 74 CA GLU A 74 268.549 227.879 284.244 1.00 0.00 C +ATOM 75 CA GLU A 75 272.333 228.004 284.670 1.00 0.00 C +ATOM 76 CA GLU A 76 273.645 226.246 287.786 1.00 0.00 C +ATOM 77 CA GLU A 77 276.405 225.631 290.339 1.00 0.00 C +ATOM 78 CA GLU A 78 278.335 225.531 293.623 1.00 0.00 C +ATOM 79 CA GLU A 79 280.066 226.243 296.941 1.00 0.00 C +ATOM 80 CA ASP A 80 282.469 223.362 297.603 1.00 0.00 C +ATOM 81 CA SER A 81 284.114 221.319 300.367 1.00 0.00 C +ATOM 82 CA LEU A 82 286.860 222.199 302.857 1.00 0.00 C +ATOM 83 CA VAL A 83 289.990 220.675 304.405 1.00 0.00 C +ATOM 84 CA ASP A 84 291.882 217.398 304.847 1.00 0.00 C +ATOM 85 CA LYS A 85 295.402 217.995 303.518 1.00 0.00 C +ATOM 86 CA VAL A 86 299.158 217.503 303.928 1.00 0.00 C +ATOM 87 CA THR A 87 301.234 214.919 305.806 1.00 0.00 C +ATOM 88 CA ARG A 88 303.045 215.307 309.135 1.00 0.00 C +ATOM 89 CA LEU A 89 304.186 211.967 310.572 1.00 0.00 C +ATOM 90 CA LEU A 90 302.829 209.147 308.399 1.00 0.00 C +ATOM 91 CA LYS A 91 302.046 207.138 305.258 1.00 0.00 C +ATOM 92 CA GLY A 92 303.900 206.566 301.979 1.00 0.00 C +ATOM 93 CA LYS A 93 303.679 205.079 298.478 1.00 0.00 C +ATOM 94 CA GLN A 94 300.544 206.640 296.979 1.00 0.00 C +ATOM 95 CA ASP A 95 297.550 204.429 297.794 1.00 0.00 C +TER 96 ASP A 95 +END diff --git a/Plants/Q8L9A7/Q8L9A7.dcd b/Plants/Q8L9A7/Q8L9A7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..87838ca7519b26ea219cf60aa9d2d10090a29a3f --- /dev/null +++ b/Plants/Q8L9A7/Q8L9A7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:6025328fe4e697d805181c57c12f65a7c07025ea275093daadf75e8b96873cf0 +size 13280276 diff --git a/Plants/Q8L9A7/top.pdb b/Plants/Q8L9A7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..d161e6be73fbf996aec9bd6556d8f30f085faf95 --- /dev/null +++ b/Plants/Q8L9A7/top.pdb @@ -0,0 +1,108 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 270.951 206.569 267.692 1.00 0.00 C +ATOM 2 CA GLY A 2 273.071 209.484 266.457 1.00 0.00 C +ATOM 3 CA ALA A 3 273.737 211.785 263.495 1.00 0.00 C +ATOM 4 CA CYS A 4 276.994 213.670 262.901 1.00 0.00 C +ATOM 5 CA ALA A 5 279.972 215.200 264.720 1.00 0.00 C +ATOM 6 CA SER A 6 281.571 218.345 266.158 1.00 0.00 C +ATOM 7 CA LYS A 7 284.438 220.183 267.867 1.00 0.00 C +ATOM 8 CA PRO A 8 284.306 223.555 269.635 1.00 0.00 C +ATOM 9 CA LYS A 9 281.577 225.664 271.252 1.00 0.00 C +ATOM 10 CA GLU A 10 279.009 227.462 269.086 1.00 0.00 C +ATOM 11 CA SER A 11 275.251 226.886 268.833 1.00 0.00 C +ATOM 12 CA ASP A 12 273.254 225.235 266.039 1.00 0.00 C +ATOM 13 CA ILE A 13 270.682 223.557 263.785 1.00 0.00 C +ATOM 14 CA VAL A 14 266.882 223.799 263.912 1.00 0.00 C +ATOM 15 CA GLU A 15 263.820 224.960 265.861 1.00 0.00 C +ATOM 16 CA GLY A 16 261.580 221.899 266.220 1.00 0.00 C +ATOM 17 CA SER A 17 259.652 219.075 267.900 1.00 0.00 C +ATOM 18 CA VAL A 18 257.819 220.579 270.883 1.00 0.00 C +ATOM 19 CA SER A 19 257.348 221.841 274.447 1.00 0.00 C +ATOM 20 CA THR A 20 254.789 221.645 277.263 1.00 0.00 C +ATOM 21 CA GLU A 21 251.481 223.327 276.404 1.00 0.00 C +ATOM 22 CA ASN A 22 250.313 226.929 276.828 1.00 0.00 C +ATOM 23 CA ALA A 23 251.604 230.445 277.527 1.00 0.00 C +ATOM 24 CA VAL A 24 250.376 233.545 279.370 1.00 0.00 C +ATOM 25 CA VAL A 25 248.709 234.670 282.606 1.00 0.00 C +ATOM 26 CA GLU A 26 245.987 236.986 283.927 1.00 0.00 C +ATOM 27 CA SER A 27 246.179 240.700 283.098 1.00 0.00 C +ATOM 28 CA LYS A 28 245.073 242.515 279.936 1.00 0.00 C +ATOM 29 CA ASN A 29 244.820 245.525 277.615 1.00 0.00 C +ATOM 30 CA ALA A 30 245.366 249.271 278.050 1.00 0.00 C +ATOM 31 CA ALA A 31 247.455 252.446 278.325 1.00 0.00 C +ATOM 32 CA THR A 32 250.718 251.871 276.445 1.00 0.00 C +ATOM 33 CA GLU A 33 253.055 249.381 274.755 1.00 0.00 C +ATOM 34 CA THR A 34 256.740 248.878 273.929 1.00 0.00 C +ATOM 35 CA ASP A 35 258.783 245.856 272.831 1.00 0.00 C +ATOM 36 CA ALA A 36 260.369 243.339 270.450 1.00 0.00 C +ATOM 37 CA THR A 37 260.797 243.336 266.664 1.00 0.00 C +ATOM 38 CA LEU A 38 259.639 240.991 263.894 1.00 0.00 C +ATOM 39 CA THR A 39 259.305 237.322 262.925 1.00 0.00 C +ATOM 40 CA GLN A 40 260.187 234.208 260.914 1.00 0.00 C +ATOM 41 CA GLU A 41 258.162 231.020 261.417 1.00 0.00 C +ATOM 42 CA LYS A 42 255.139 231.121 259.101 1.00 0.00 C +ATOM 43 CA LYS A 43 256.424 231.998 255.623 1.00 0.00 C +ATOM 44 CA GLU A 44 257.067 235.743 255.337 1.00 0.00 C +ATOM 45 CA GLU A 45 255.643 239.230 255.908 1.00 0.00 C +ATOM 46 CA SER A 46 254.882 241.997 253.401 1.00 0.00 C +ATOM 47 CA ILE A 47 256.574 245.257 254.413 1.00 0.00 C +ATOM 48 CA GLU A 48 260.159 246.210 255.280 1.00 0.00 C +ATOM 49 CA GLU A 49 263.747 247.473 255.507 1.00 0.00 C +ATOM 50 CA THR A 50 266.501 249.849 256.641 1.00 0.00 C +ATOM 51 CA LYS A 51 267.437 253.443 255.791 1.00 0.00 C +ATOM 52 CA LYS A 52 264.765 256.009 254.902 1.00 0.00 C +ATOM 53 CA GLU A 53 261.022 256.199 255.592 1.00 0.00 C +ATOM 54 CA GLY A 54 259.811 253.042 257.347 1.00 0.00 C +ATOM 55 CA GLU A 55 256.371 253.956 258.707 1.00 0.00 C +ATOM 56 CA THR A 56 253.156 255.265 257.136 1.00 0.00 C +ATOM 57 CA LYS A 57 249.713 253.898 256.249 1.00 0.00 C +ATOM 58 CA GLU A 58 247.298 251.044 255.514 1.00 0.00 C +ATOM 59 CA ASP A 59 244.259 251.857 253.364 1.00 0.00 C +ATOM 60 CA SER A 60 243.639 253.769 250.128 1.00 0.00 C +ATOM 61 CA SER A 61 242.466 256.476 247.716 1.00 0.00 C +ATOM 62 CA GLU A 62 242.039 255.414 244.082 1.00 0.00 C +ATOM 63 CA ALA A 63 243.546 255.329 240.584 1.00 0.00 C +ATOM 64 CA THR A 64 242.514 255.024 236.929 1.00 0.00 C +ATOM 65 CA LYS A 65 242.991 257.793 234.356 1.00 0.00 C +ATOM 66 CA ALA A 66 240.706 260.833 234.572 1.00 0.00 C +ATOM 67 CA GLU A 67 242.473 263.722 232.827 1.00 0.00 C +ATOM 68 CA PRO A 68 245.249 266.332 232.818 1.00 0.00 C +ATOM 69 CA THR A 69 243.785 269.374 231.052 1.00 0.00 C +ATOM 70 CA PRO A 70 240.465 270.517 232.529 1.00 0.00 C +ATOM 71 CA GLU A 71 237.299 272.421 231.595 1.00 0.00 C +ATOM 72 CA ALA A 72 234.413 272.216 234.074 1.00 0.00 C +ATOM 73 CA VAL A 73 230.697 271.377 234.096 1.00 0.00 C +ATOM 74 CA LYS A 74 230.164 268.946 231.211 1.00 0.00 C +ATOM 75 CA ALA A 75 227.400 268.017 228.758 1.00 0.00 C +ATOM 76 CA GLU A 76 224.243 267.761 230.876 1.00 0.00 C +ATOM 77 CA GLU A 77 220.636 268.833 231.471 1.00 0.00 C +ATOM 78 CA LYS A 78 217.608 270.963 232.372 1.00 0.00 C +ATOM 79 CA THR A 79 218.498 274.193 234.185 1.00 0.00 C +ATOM 80 CA SER A 80 216.389 274.493 237.344 1.00 0.00 C +ATOM 81 CA SER A 81 218.781 274.939 240.276 1.00 0.00 C +ATOM 82 CA GLU A 82 220.237 278.426 239.791 1.00 0.00 C +ATOM 83 CA THR A 83 222.845 280.069 237.551 1.00 0.00 C +ATOM 84 CA GLU A 84 225.742 282.409 236.746 1.00 0.00 C +ATOM 85 CA PRO A 85 227.826 280.935 233.918 1.00 0.00 C +ATOM 86 CA PRO A 86 227.837 277.151 233.474 1.00 0.00 C +ATOM 87 CA ALA A 87 229.475 275.930 230.258 1.00 0.00 C +ATOM 88 CA GLN A 88 232.958 276.794 228.977 1.00 0.00 C +ATOM 89 CA GLU A 89 234.871 274.669 226.459 1.00 0.00 C +ATOM 90 CA THR A 90 235.700 271.383 224.717 1.00 0.00 C +ATOM 91 CA THR A 91 233.061 268.651 224.429 1.00 0.00 C +ATOM 92 CA PRO A 92 233.520 265.687 222.080 1.00 0.00 C +ATOM 93 CA ALA A 93 236.503 266.333 219.799 1.00 0.00 C +ATOM 94 CA ALA A 94 238.519 263.387 218.467 1.00 0.00 C +ATOM 95 CA LYS A 95 240.217 261.685 215.512 1.00 0.00 C +ATOM 96 CA THR A 96 244.020 261.815 215.312 1.00 0.00 C +ATOM 97 CA ASP A 97 246.561 262.923 217.925 1.00 0.00 C +ATOM 98 CA GLU A 98 248.338 266.267 217.508 1.00 0.00 C +ATOM 99 CA ALA A 99 248.992 268.899 214.832 1.00 0.00 C +ATOM 100 CA PRO A 100 252.420 269.572 213.313 1.00 0.00 C +ATOM 101 CA LEU A 101 252.343 272.894 211.449 1.00 0.00 C +ATOM 102 CA VAL A 102 252.462 273.625 207.712 1.00 0.00 C +ATOM 103 CA ILE A 103 253.089 275.459 204.432 1.00 0.00 C +ATOM 104 CA LEU A 104 254.674 278.753 203.355 1.00 0.00 C +TER 105 LEU A 104 +END diff --git a/Plants/Q8L9A8/Q8L9A8.dcd b/Plants/Q8L9A8/Q8L9A8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..70fcf9422cca01a21af25b3383fb9e756782b5d9 --- /dev/null +++ b/Plants/Q8L9A8/Q8L9A8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:edad01c5aae41f0ba132f14e01757f31cea19fc1ee897b3badd30314ffcd6b41 +size 9920276 diff --git a/Plants/Q8L9A8/top.pdb b/Plants/Q8L9A8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..699d28cf2addefe1a0c695c4aad1c1908e8c523e --- /dev/null +++ b/Plants/Q8L9A8/top.pdb @@ -0,0 +1,80 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 244.271 207.310 236.049 1.00 0.00 C +ATOM 2 CA SER A 2 246.129 210.602 236.525 1.00 0.00 C +ATOM 3 CA GLU A 3 246.925 211.644 240.102 1.00 0.00 C +ATOM 4 CA ARG A 4 248.818 211.862 243.401 1.00 0.00 C +ATOM 5 CA PRO A 5 250.892 211.070 246.498 1.00 0.00 C +ATOM 6 CA SER A 6 251.103 212.629 249.968 1.00 0.00 C +ATOM 7 CA ARG A 7 254.188 214.532 251.141 1.00 0.00 C +ATOM 8 CA HIS A 8 255.340 217.434 253.325 1.00 0.00 C +ATOM 9 CA GLN A 9 256.644 219.002 256.543 1.00 0.00 C +ATOM 10 CA ARG A 10 257.413 219.122 260.272 1.00 0.00 C +ATOM 11 CA ARG A 11 260.188 221.308 261.700 1.00 0.00 C +ATOM 12 CA PRO A 12 263.157 222.907 259.926 1.00 0.00 C +ATOM 13 CA SER A 13 263.891 226.076 257.942 1.00 0.00 C +ATOM 14 CA GLN A 14 261.141 226.819 255.412 1.00 0.00 C +ATOM 15 CA SER A 15 259.263 225.760 252.270 1.00 0.00 C +ATOM 16 CA VAL A 16 258.992 227.241 248.770 1.00 0.00 C +ATOM 17 CA PHE A 17 258.850 226.082 245.144 1.00 0.00 C +ATOM 18 CA PRO A 18 261.001 224.214 242.613 1.00 0.00 C +ATOM 19 CA ILE A 19 263.976 226.141 241.215 1.00 0.00 C +ATOM 20 CA SER A 20 265.724 229.487 240.703 1.00 0.00 C +ATOM 21 CA LEU A 21 267.366 230.867 243.853 1.00 0.00 C +ATOM 22 CA ASP A 22 270.717 231.080 245.652 1.00 0.00 C +ATOM 23 CA ASP A 23 273.269 229.178 247.747 1.00 0.00 C +ATOM 24 CA LEU A 24 273.019 229.036 251.546 1.00 0.00 C +ATOM 25 CA SER A 25 269.356 228.828 252.575 1.00 0.00 C +ATOM 26 CA ASP A 26 266.756 231.346 253.765 1.00 0.00 C +ATOM 27 CA ILE A 27 265.934 231.989 257.429 1.00 0.00 C +ATOM 28 CA SER A 28 265.214 235.334 259.105 1.00 0.00 C +ATOM 29 CA LEU A 29 262.094 237.186 260.266 1.00 0.00 C +ATOM 30 CA SER A 30 259.036 235.395 261.664 1.00 0.00 C +ATOM 31 CA ALA A 31 255.287 235.071 261.063 1.00 0.00 C +ATOM 32 CA ASN A 32 252.327 236.691 259.295 1.00 0.00 C +ATOM 33 CA PRO A 33 250.556 236.942 255.931 1.00 0.00 C +ATOM 34 CA PRO A 34 251.852 236.067 252.457 1.00 0.00 C +ATOM 35 CA SER A 35 252.610 238.698 249.807 1.00 0.00 C +ATOM 36 CA THR A 36 255.524 239.583 247.518 1.00 0.00 C +ATOM 37 CA VAL A 37 257.797 240.710 244.675 1.00 0.00 C +ATOM 38 CA PRO A 38 257.124 244.345 243.752 1.00 0.00 C +ATOM 39 CA THR A 39 259.561 245.682 241.146 1.00 0.00 C +ATOM 40 CA ASN A 40 260.388 243.762 237.961 1.00 0.00 C +ATOM 41 CA PRO A 41 262.912 244.836 235.316 1.00 0.00 C +ATOM 42 CA PRO A 42 262.335 247.686 232.854 1.00 0.00 C +ATOM 43 CA ARG A 43 259.951 250.568 232.131 1.00 0.00 C +ATOM 44 CA HIS A 44 257.019 251.858 234.193 1.00 0.00 C +ATOM 45 CA GLN A 45 253.627 250.292 234.941 1.00 0.00 C +ATOM 46 CA ILE A 46 254.439 247.342 237.212 1.00 0.00 C +ATOM 47 CA PRO A 47 253.481 248.397 240.745 1.00 0.00 C +ATOM 48 CA PRO A 48 251.043 251.082 241.913 1.00 0.00 C +ATOM 49 CA PRO A 49 252.385 254.647 241.998 1.00 0.00 C +ATOM 50 CA SER A 50 253.337 258.328 241.757 1.00 0.00 C +ATOM 51 CA PRO A 51 250.435 260.633 242.642 1.00 0.00 C +ATOM 52 CA ALA A 52 247.868 263.434 242.353 1.00 0.00 C +ATOM 53 CA ALA A 53 246.119 263.351 238.969 1.00 0.00 C +ATOM 54 CA PRO A 54 242.938 265.435 239.208 1.00 0.00 C +ATOM 55 CA PRO A 55 240.124 266.007 241.712 1.00 0.00 C +ATOM 56 CA ALA A 56 238.685 265.182 245.142 1.00 0.00 C +ATOM 57 CA ASN A 57 240.394 266.486 248.287 1.00 0.00 C +ATOM 58 CA ARG A 58 240.982 270.125 249.254 1.00 0.00 C +ATOM 59 CA SER A 59 241.313 273.853 249.966 1.00 0.00 C +ATOM 60 CA ASN A 60 240.661 277.414 248.778 1.00 0.00 C +ATOM 61 CA ASN A 61 238.195 280.195 249.615 1.00 0.00 C +ATOM 62 CA ASP A 62 235.420 282.715 248.933 1.00 0.00 C +ATOM 63 CA ASP A 63 232.075 281.652 250.414 1.00 0.00 C +ATOM 64 CA ASN A 64 229.062 283.800 251.324 1.00 0.00 C +ATOM 65 CA VAL A 65 226.739 285.026 254.083 1.00 0.00 C +ATOM 66 CA SER A 66 227.462 287.602 256.795 1.00 0.00 C +ATOM 67 CA LYS A 67 226.529 288.721 260.316 1.00 0.00 C +ATOM 68 CA ASP A 68 228.709 291.291 262.092 1.00 0.00 C +ATOM 69 CA HIS A 69 226.591 294.186 263.378 1.00 0.00 C +ATOM 70 CA HIS A 70 227.408 297.456 265.154 1.00 0.00 C +ATOM 71 CA GLY A 71 225.708 300.557 266.571 1.00 0.00 C +ATOM 72 CA ASN A 72 226.495 304.075 267.804 1.00 0.00 C +ATOM 73 CA ALA A 73 223.975 306.929 267.664 1.00 0.00 C +ATOM 74 CA SER A 74 226.003 310.040 266.813 1.00 0.00 C +ATOM 75 CA SER A 75 228.409 310.501 269.731 1.00 0.00 C +ATOM 76 CA ASN A 76 227.482 309.270 273.216 1.00 0.00 C +TER 77 ASN A 76 +END diff --git a/Plants/Q8L9E6/Q8L9E6.dcd b/Plants/Q8L9E6/Q8L9E6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..0958a533dfba13c7243ad8f91c52a30b0e745f61 --- /dev/null +++ b/Plants/Q8L9E6/Q8L9E6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:325b1809957ccbd659977436cc40ffba125d86165a80ac40ff5fdef62f069b4c +size 39540276 diff --git a/Plants/Q8L9E6/top.pdb b/Plants/Q8L9E6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..106d3b9c030638379be9613900ec1b3a4ef7d88a --- /dev/null +++ b/Plants/Q8L9E6/top.pdb @@ -0,0 +1,217 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 267.521 190.068 252.003 1.00 0.00 C +ATOM 2 CA ALA A 2 266.979 193.742 252.855 1.00 0.00 C +ATOM 3 CA ALA A 3 266.133 194.811 256.412 1.00 0.00 C +ATOM 4 CA ARG A 4 268.869 193.347 258.623 1.00 0.00 C +ATOM 5 CA ALA A 5 267.935 191.530 261.839 1.00 0.00 C +ATOM 6 CA ASN A 6 267.384 189.708 265.140 1.00 0.00 C +ATOM 7 CA ASN A 7 266.159 190.752 268.593 1.00 0.00 C +ATOM 8 CA LYS A 8 263.336 193.260 268.083 1.00 0.00 C +ATOM 9 CA TYR A 9 261.654 196.341 266.601 1.00 0.00 C +ATOM 10 CA THR A 10 259.972 199.029 264.490 1.00 0.00 C +ATOM 11 CA SER A 11 257.626 197.459 261.931 1.00 0.00 C +ATOM 12 CA ILE A 12 255.091 197.252 259.094 1.00 0.00 C +ATOM 13 CA ASN A 13 252.406 197.346 256.393 1.00 0.00 C +ATOM 14 CA PHE A 14 249.402 196.142 254.383 1.00 0.00 C +ATOM 15 CA ASN A 15 248.077 199.197 252.531 1.00 0.00 C +ATOM 16 CA HIS A 16 246.782 202.628 253.563 1.00 0.00 C +ATOM 17 CA ILE A 17 246.447 203.759 257.186 1.00 0.00 C +ATOM 18 CA LEU A 18 244.567 201.100 259.164 1.00 0.00 C +ATOM 19 CA HIS A 19 243.078 202.333 262.448 1.00 0.00 C +ATOM 20 CA LYS A 20 239.589 203.846 262.673 1.00 0.00 C +ATOM 21 CA ASP A 21 235.880 203.853 261.803 1.00 0.00 C +ATOM 22 CA PRO A 22 234.936 206.402 259.133 1.00 0.00 C +ATOM 23 CA PRO A 23 237.241 209.363 258.477 1.00 0.00 C +ATOM 24 CA SER A 24 240.742 210.745 259.072 1.00 0.00 C +ATOM 25 CA SER A 25 243.507 213.192 260.008 1.00 0.00 C +ATOM 26 CA SER A 26 246.646 214.348 261.833 1.00 0.00 C +ATOM 27 CA SER A 27 250.278 214.710 260.743 1.00 0.00 C +ATOM 28 CA SER A 28 254.025 214.331 260.165 1.00 0.00 C +ATOM 29 CA SER A 29 256.639 217.028 259.528 1.00 0.00 C +ATOM 30 CA SER A 30 260.421 217.489 259.593 1.00 0.00 C +ATOM 31 CA SER A 31 261.523 219.185 256.364 1.00 0.00 C +ATOM 32 CA ALA A 32 258.466 221.189 255.291 1.00 0.00 C +ATOM 33 CA SER A 33 255.514 222.497 257.314 1.00 0.00 C +ATOM 34 CA TYR A 34 252.798 224.803 258.664 1.00 0.00 C +ATOM 35 CA SER A 35 254.559 228.139 259.199 1.00 0.00 C +ATOM 36 CA SER A 36 257.149 229.370 256.690 1.00 0.00 C +ATOM 37 CA VAL A 37 259.964 227.278 255.201 1.00 0.00 C +ATOM 38 CA ALA A 38 263.153 228.794 256.631 1.00 0.00 C +ATOM 39 CA ARG A 39 262.756 229.156 260.403 1.00 0.00 C +ATOM 40 CA SER A 40 260.487 228.316 263.346 1.00 0.00 C +ATOM 41 CA ASN A 41 261.138 229.936 266.733 1.00 0.00 C +ATOM 42 CA GLY A 42 261.857 232.061 269.813 1.00 0.00 C +ATOM 43 CA ARG A 43 259.338 233.139 272.460 1.00 0.00 C +ATOM 44 CA MET A 44 256.358 234.425 274.456 1.00 0.00 C +ATOM 45 CA LEU A 45 252.996 233.206 273.142 1.00 0.00 C +ATOM 46 CA VAL A 46 249.945 231.178 274.188 1.00 0.00 C +ATOM 47 CA LEU A 47 247.548 230.113 276.952 1.00 0.00 C +ATOM 48 CA THR A 48 244.159 228.841 278.139 1.00 0.00 C +ATOM 49 CA LYS A 49 240.720 230.383 278.697 1.00 0.00 C +ATOM 50 CA SER A 50 239.315 233.011 276.323 1.00 0.00 C +ATOM 51 CA SER A 51 235.748 233.679 277.484 1.00 0.00 C +ATOM 52 CA PRO A 52 232.056 234.393 276.869 1.00 0.00 C +ATOM 53 CA LYS A 53 229.236 236.925 277.252 1.00 0.00 C +ATOM 54 CA PRO A 54 226.151 238.395 275.567 1.00 0.00 C +ATOM 55 CA LEU A 55 222.499 237.827 274.639 1.00 0.00 C +ATOM 56 CA ARG A 56 219.490 236.013 273.166 1.00 0.00 C +ATOM 57 CA SER A 57 219.432 236.936 269.470 1.00 0.00 C +ATOM 58 CA PRO A 58 222.219 237.135 266.880 1.00 0.00 C +ATOM 59 CA SER A 59 221.655 234.183 264.538 1.00 0.00 C +ATOM 60 CA ALA A 60 222.357 233.513 260.854 1.00 0.00 C +ATOM 61 CA ALA A 61 224.587 234.827 258.058 1.00 0.00 C +ATOM 62 CA PRO A 62 227.986 235.692 256.569 1.00 0.00 C +ATOM 63 CA THR A 63 229.042 239.327 257.005 1.00 0.00 C +ATOM 64 CA THR A 64 232.423 240.994 257.554 1.00 0.00 C +ATOM 65 CA THR A 65 235.116 238.589 256.338 1.00 0.00 C +ATOM 66 CA THR A 66 236.494 235.037 256.412 1.00 0.00 C +ATOM 67 CA THR A 67 239.360 234.177 254.054 1.00 0.00 C +ATOM 68 CA THR A 68 242.940 235.313 254.694 1.00 0.00 C +ATOM 69 CA THR A 69 245.160 232.572 256.132 1.00 0.00 C +ATOM 70 CA ALA A 70 248.678 234.027 255.979 1.00 0.00 C +ATOM 71 CA PRO A 71 250.872 234.007 259.094 1.00 0.00 C +ATOM 72 CA PRO A 72 250.548 236.035 262.304 1.00 0.00 C +ATOM 73 CA ILE A 73 251.095 234.989 265.927 1.00 0.00 C +ATOM 74 CA SER A 74 251.494 231.205 266.112 1.00 0.00 C +ATOM 75 CA THR A 75 251.835 227.508 266.967 1.00 0.00 C +ATOM 76 CA ALA A 76 253.526 227.441 270.380 1.00 0.00 C +ATOM 77 CA PRO A 77 253.332 223.990 271.983 1.00 0.00 C +ATOM 78 CA ARG A 78 255.690 222.300 274.453 1.00 0.00 C +ATOM 79 CA ILE A 79 259.438 222.065 273.813 1.00 0.00 C +ATOM 80 CA PRO A 80 262.281 221.675 276.319 1.00 0.00 C +ATOM 81 CA SER A 81 265.806 221.438 274.894 1.00 0.00 C +ATOM 82 CA ASN A 82 268.307 224.304 275.102 1.00 0.00 C +ATOM 83 CA GLN A 83 267.092 227.837 274.356 1.00 0.00 C +ATOM 84 CA ALA A 84 265.849 230.479 276.803 1.00 0.00 C +ATOM 85 CA ILE A 85 265.650 234.159 277.771 1.00 0.00 C +ATOM 86 CA SER A 86 266.810 235.254 281.231 1.00 0.00 C +ATOM 87 CA ASP A 87 268.710 235.566 284.519 1.00 0.00 C +ATOM 88 CA PRO A 88 272.387 236.424 284.009 1.00 0.00 C +ATOM 89 CA ASP A 89 273.520 238.270 287.143 1.00 0.00 C +ATOM 90 CA PRO A 90 276.484 238.930 289.444 1.00 0.00 C +ATOM 91 CA SER A 91 277.795 237.379 292.668 1.00 0.00 C +ATOM 92 CA PRO A 92 277.774 233.600 292.185 1.00 0.00 C +ATOM 93 CA ILE A 93 279.476 231.359 294.754 1.00 0.00 C +ATOM 94 CA SER A 94 282.624 233.253 295.763 1.00 0.00 C +ATOM 95 CA LEU A 95 284.018 234.448 299.102 1.00 0.00 C +ATOM 96 CA ARG A 96 285.907 236.728 301.500 1.00 0.00 C +ATOM 97 CA PRO A 97 288.274 239.502 302.602 1.00 0.00 C +ATOM 98 CA LEU A 98 289.112 243.138 303.373 1.00 0.00 C +ATOM 99 CA GLY A 99 291.953 245.176 304.886 1.00 0.00 C +ATOM 100 CA HIS A 100 291.009 248.837 304.412 1.00 0.00 C +ATOM 101 CA THR A 101 287.947 249.082 302.158 1.00 0.00 C +ATOM 102 CA GLY A 102 285.792 247.232 299.618 1.00 0.00 C +ATOM 103 CA SER A 103 286.676 244.726 296.887 1.00 0.00 C +ATOM 104 CA SER A 104 288.151 243.559 293.574 1.00 0.00 C +ATOM 105 CA SER A 105 291.902 243.505 292.906 1.00 0.00 C +ATOM 106 CA SER A 106 292.818 243.824 289.222 1.00 0.00 C +ATOM 107 CA LEU A 107 290.532 245.847 286.942 1.00 0.00 C +ATOM 108 CA SER A 108 290.835 245.913 283.145 1.00 0.00 C +ATOM 109 CA PHE A 109 288.725 245.515 279.997 1.00 0.00 C +ATOM 110 CA PRO A 110 285.459 243.911 278.867 1.00 0.00 C +ATOM 111 CA ILE A 111 282.619 242.532 280.999 1.00 0.00 C +ATOM 112 CA ARG A 112 280.093 241.325 283.584 1.00 0.00 C +ATOM 113 CA THR A 113 277.172 243.757 283.314 1.00 0.00 C +ATOM 114 CA PRO A 114 275.881 247.200 284.314 1.00 0.00 C +ATOM 115 CA GLU A 115 275.731 250.774 283.004 1.00 0.00 C +ATOM 116 CA ILE A 116 275.935 254.548 282.519 1.00 0.00 C +ATOM 117 CA ASN A 117 274.121 257.360 280.697 1.00 0.00 C +ATOM 118 CA LYS A 118 270.704 257.654 279.037 1.00 0.00 C +ATOM 119 CA ALA A 119 267.037 258.613 278.654 1.00 0.00 C +ATOM 120 CA PRO A 120 263.490 258.843 280.025 1.00 0.00 C +ATOM 121 CA GLU A 121 261.581 260.872 277.426 1.00 0.00 C +ATOM 122 CA VAL A 122 261.366 260.864 273.622 1.00 0.00 C +ATOM 123 CA ASN A 123 260.602 261.003 269.892 1.00 0.00 C +ATOM 124 CA ALA A 124 260.837 258.194 267.328 1.00 0.00 C +ATOM 125 CA PRO A 125 262.652 259.629 264.302 1.00 0.00 C +ATOM 126 CA THR A 126 261.545 263.092 263.161 1.00 0.00 C +ATOM 127 CA PRO A 127 259.458 262.972 259.975 1.00 0.00 C +ATOM 128 CA VAL A 128 256.954 260.117 260.286 1.00 0.00 C +ATOM 129 CA SER A 129 254.432 257.936 258.443 1.00 0.00 C +ATOM 130 CA LEU A 130 250.888 257.869 259.841 1.00 0.00 C +ATOM 131 CA SER A 131 248.164 259.251 262.117 1.00 0.00 C +ATOM 132 CA PRO A 132 245.849 261.876 260.609 1.00 0.00 C +ATOM 133 CA LYS A 133 245.785 262.339 256.828 1.00 0.00 C +ATOM 134 CA PRO A 134 242.731 264.445 255.959 1.00 0.00 C +ATOM 135 CA ASP A 135 241.630 267.291 253.678 1.00 0.00 C +ATOM 136 CA ARG A 136 240.241 270.304 251.805 1.00 0.00 C +ATOM 137 CA PHE A 137 237.659 272.281 249.819 1.00 0.00 C +ATOM 138 CA VAL A 138 235.655 274.985 251.605 1.00 0.00 C +ATOM 139 CA PRO A 139 235.173 277.079 254.751 1.00 0.00 C +ATOM 140 CA PRO A 140 231.500 277.071 255.765 1.00 0.00 C +ATOM 141 CA HIS A 141 227.873 275.969 255.387 1.00 0.00 C +ATOM 142 CA LEU A 142 224.397 276.586 253.954 1.00 0.00 C +ATOM 143 CA ARG A 143 222.458 278.675 251.425 1.00 0.00 C +ATOM 144 CA PRO A 144 221.757 278.055 247.732 1.00 0.00 C +ATOM 145 CA GLY A 145 220.356 276.188 244.721 1.00 0.00 C +ATOM 146 CA PHE A 146 218.971 272.738 245.557 1.00 0.00 C +ATOM 147 CA VAL A 147 215.351 272.496 244.394 1.00 0.00 C +ATOM 148 CA ARG A 148 212.336 270.567 245.700 1.00 0.00 C +ATOM 149 CA LYS A 149 209.294 271.245 243.509 1.00 0.00 C +ATOM 150 CA ASP A 150 207.198 274.364 242.878 1.00 0.00 C +ATOM 151 CA GLU A 151 204.316 274.095 240.401 1.00 0.00 C +ATOM 152 CA LYS A 152 204.535 276.937 237.873 1.00 0.00 C +ATOM 153 CA PRO A 153 207.889 277.055 236.070 1.00 0.00 C +ATOM 154 CA GLY A 154 211.323 275.556 236.761 1.00 0.00 C +ATOM 155 CA LEU A 155 215.116 275.212 236.839 1.00 0.00 C +ATOM 156 CA ASN A 156 218.035 277.312 238.102 1.00 0.00 C +ATOM 157 CA SER A 157 219.143 280.754 236.904 1.00 0.00 C +ATOM 158 CA SER A 158 221.418 283.762 236.362 1.00 0.00 C +ATOM 159 CA ARG A 159 221.989 285.714 233.140 1.00 0.00 C +ATOM 160 CA VAL A 160 220.972 289.342 232.575 1.00 0.00 C +ATOM 161 CA ARG A 161 221.097 292.317 230.197 1.00 0.00 C +ATOM 162 CA ASP A 162 223.100 295.557 230.153 1.00 0.00 C +ATOM 163 CA PRO A 163 224.523 297.682 232.978 1.00 0.00 C +ATOM 164 CA ASN A 164 225.413 295.316 235.828 1.00 0.00 C +ATOM 165 CA PRO A 165 226.847 292.035 234.526 1.00 0.00 C +ATOM 166 CA ASN A 166 228.942 291.005 231.515 1.00 0.00 C +ATOM 167 CA LEU A 167 230.475 291.788 228.116 1.00 0.00 C +ATOM 168 CA ASN A 168 233.845 290.360 227.057 1.00 0.00 C +ATOM 169 CA GLN A 169 234.961 291.194 223.511 1.00 0.00 C +ATOM 170 CA ARG A 170 233.803 291.586 219.902 1.00 0.00 C +ATOM 171 CA LEU A 171 233.374 288.859 217.276 1.00 0.00 C +ATOM 172 CA PRO A 172 234.348 290.247 213.864 1.00 0.00 C +ATOM 173 CA ASN A 173 234.756 292.860 211.122 1.00 0.00 C +ATOM 174 CA GLN A 174 233.469 294.531 207.949 1.00 0.00 C +ATOM 175 CA GLU A 175 232.608 297.892 206.375 1.00 0.00 C +ATOM 176 CA GLN A 176 228.924 298.309 205.499 1.00 0.00 C +ATOM 177 CA PRO A 177 226.424 296.173 207.424 1.00 0.00 C +ATOM 178 CA ARG A 178 224.599 293.581 205.310 1.00 0.00 C +ATOM 179 CA GLN A 179 226.497 290.397 204.430 1.00 0.00 C +ATOM 180 CA GLU A 180 228.661 291.157 201.387 1.00 0.00 C +ATOM 181 CA TYR A 181 229.293 291.405 197.638 1.00 0.00 C +ATOM 182 CA PHE A 182 232.375 289.573 196.350 1.00 0.00 C +ATOM 183 CA GLY A 183 235.448 287.691 197.588 1.00 0.00 C +ATOM 184 CA TYR A 184 237.879 285.019 198.799 1.00 0.00 C +ATOM 185 CA GLY A 185 235.792 282.439 200.669 1.00 0.00 C +ATOM 186 CA GLN A 186 235.347 280.637 203.997 1.00 0.00 C +ATOM 187 CA PRO A 187 235.518 281.248 207.754 1.00 0.00 C +ATOM 188 CA GLY A 188 238.920 279.954 208.881 1.00 0.00 C +ATOM 189 CA ARG A 189 242.055 277.793 208.754 1.00 0.00 C +ATOM 190 CA PRO A 190 243.192 275.847 205.682 1.00 0.00 C +ATOM 191 CA LYS A 191 242.644 272.682 203.634 1.00 0.00 C +ATOM 192 CA SER A 192 242.459 270.230 200.723 1.00 0.00 C +ATOM 193 CA GLY A 193 245.388 270.826 198.361 1.00 0.00 C +ATOM 194 CA GLY A 194 247.546 273.195 196.300 1.00 0.00 C +ATOM 195 CA TYR A 195 250.865 273.336 194.436 1.00 0.00 C +ATOM 196 CA GLU A 196 252.041 276.291 192.338 1.00 0.00 C +ATOM 197 CA ARG A 197 255.611 277.413 193.055 1.00 0.00 C +ATOM 198 CA ILE A 198 259.354 277.285 192.358 1.00 0.00 C +ATOM 199 CA ARG A 199 262.726 278.186 190.829 1.00 0.00 C +ATOM 200 CA THR A 200 262.847 281.503 188.959 1.00 0.00 C +ATOM 201 CA ASP A 201 260.084 283.610 187.396 1.00 0.00 C +ATOM 202 CA PRO A 202 258.597 281.368 184.699 1.00 0.00 C +ATOM 203 CA ARG A 203 259.444 277.779 183.739 1.00 0.00 C +ATOM 204 CA ILE A 204 259.826 277.523 179.957 1.00 0.00 C +ATOM 205 CA THR A 205 260.933 279.506 176.898 1.00 0.00 C +ATOM 206 CA GLY A 206 261.982 280.886 173.505 1.00 0.00 C +ATOM 207 CA ASN A 207 262.455 281.453 169.768 1.00 0.00 C +ATOM 208 CA ARG A 208 263.382 280.738 166.142 1.00 0.00 C +ATOM 209 CA PRO A 209 266.563 282.572 165.124 1.00 0.00 C +ATOM 210 CA GLY A 210 270.188 282.283 163.988 1.00 0.00 C +ATOM 211 CA THR A 211 271.948 285.337 165.434 1.00 0.00 C +ATOM 212 CA SER A 212 270.576 286.738 168.701 1.00 0.00 C +ATOM 213 CA GLY A 213 268.652 290.014 168.415 1.00 0.00 C +TER 214 GLY A 213 +END diff --git a/Plants/Q8LAM9/Q8LAM9.dcd b/Plants/Q8LAM9/Q8LAM9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..871815fd9d75a23f8f59c1a944a4a8912d5231fe --- /dev/null +++ b/Plants/Q8LAM9/Q8LAM9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2cb0e4bbc20b45f73aae8d77c3cbf1ff7f31272433248b8edb68ea185597f21d +size 8840276 diff --git a/Plants/Q8LAM9/top.pdb b/Plants/Q8LAM9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..4f7ccd73537621ca79816544f0cd6c823e876950 --- /dev/null +++ b/Plants/Q8LAM9/top.pdb @@ -0,0 +1,71 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 272.516 236.993 245.578 1.00 0.00 C +ATOM 2 CA SER A 2 269.041 237.373 247.094 1.00 0.00 C +ATOM 3 CA SER A 3 266.304 235.571 249.038 1.00 0.00 C +ATOM 4 CA ASN A 4 267.644 235.166 252.581 1.00 0.00 C +ATOM 5 CA SER A 5 265.877 237.144 255.317 1.00 0.00 C +ATOM 6 CA GLN A 6 267.384 239.400 257.991 1.00 0.00 C +ATOM 7 CA ASN A 7 270.429 240.990 256.343 1.00 0.00 C +ATOM 8 CA ILE A 8 271.188 244.616 255.452 1.00 0.00 C +ATOM 9 CA SER A 9 274.090 246.472 257.082 1.00 0.00 C +ATOM 10 CA PHE A 10 272.574 248.246 260.093 1.00 0.00 C +ATOM 11 CA GLN A 11 268.836 248.936 259.832 1.00 0.00 C +ATOM 12 CA ALA A 12 266.424 251.818 259.210 1.00 0.00 C +ATOM 13 CA GLY A 13 262.869 251.365 260.504 1.00 0.00 C +ATOM 14 CA GLN A 14 259.979 251.489 262.983 1.00 0.00 C +ATOM 15 CA ALA A 15 256.207 251.235 262.507 1.00 0.00 C +ATOM 16 CA LYS A 16 252.896 250.257 260.896 1.00 0.00 C +ATOM 17 CA GLY A 17 249.796 249.524 258.805 1.00 0.00 C +ATOM 18 CA GLN A 18 249.377 252.219 256.145 1.00 0.00 C +ATOM 19 CA THR A 19 247.810 253.930 253.123 1.00 0.00 C +ATOM 20 CA GLN A 20 246.235 253.166 249.739 1.00 0.00 C +ATOM 21 CA GLU A 21 244.647 256.298 248.260 1.00 0.00 C +ATOM 22 CA LYS A 22 246.083 259.578 246.957 1.00 0.00 C +ATOM 23 CA ALA A 23 245.376 262.889 248.706 1.00 0.00 C +ATOM 24 CA SER A 24 247.866 264.952 250.720 1.00 0.00 C +ATOM 25 CA THR A 25 251.150 265.118 252.645 1.00 0.00 C +ATOM 26 CA MET A 26 254.859 265.861 253.099 1.00 0.00 C +ATOM 27 CA MET A 27 255.758 269.372 251.921 1.00 0.00 C +ATOM 28 CA ASP A 28 254.846 272.310 254.168 1.00 0.00 C +ATOM 29 CA LYS A 29 256.528 275.260 255.895 1.00 0.00 C +ATOM 30 CA ALA A 30 255.633 275.394 259.596 1.00 0.00 C +ATOM 31 CA SER A 31 252.468 275.811 261.676 1.00 0.00 C +ATOM 32 CA ASN A 32 251.198 279.395 261.908 1.00 0.00 C +ATOM 33 CA ALA A 33 249.536 281.982 259.658 1.00 0.00 C +ATOM 34 CA ALA A 34 245.960 281.895 258.346 1.00 0.00 C +ATOM 35 CA GLN A 35 242.622 280.307 259.268 1.00 0.00 C +ATOM 36 CA SER A 36 239.133 279.464 257.992 1.00 0.00 C +ATOM 37 CA ALA A 37 236.279 277.645 259.743 1.00 0.00 C +ATOM 38 CA LYS A 38 235.015 275.146 257.160 1.00 0.00 C +ATOM 39 CA GLU A 39 237.431 272.230 256.740 1.00 0.00 C +ATOM 40 CA SER A 40 240.142 269.553 256.734 1.00 0.00 C +ATOM 41 CA LEU A 41 239.803 266.174 255.007 1.00 0.00 C +ATOM 42 CA GLN A 42 237.400 264.700 252.444 1.00 0.00 C +ATOM 43 CA GLU A 43 236.796 261.609 250.299 1.00 0.00 C +ATOM 44 CA THR A 44 236.456 259.317 247.275 1.00 0.00 C +ATOM 45 CA GLY A 45 237.269 255.601 247.045 1.00 0.00 C +ATOM 46 CA GLN A 46 238.433 252.863 244.666 1.00 0.00 C +ATOM 47 CA GLN A 47 241.629 252.481 242.626 1.00 0.00 C +ATOM 48 CA ILE A 48 243.844 251.324 239.751 1.00 0.00 C +ATOM 49 CA LYS A 49 247.542 250.532 239.287 1.00 0.00 C +ATOM 50 CA GLU A 50 249.599 247.358 239.743 1.00 0.00 C +ATOM 51 CA LYS A 51 248.475 243.867 238.710 1.00 0.00 C +ATOM 52 CA ALA A 52 246.575 240.769 237.568 1.00 0.00 C +ATOM 53 CA GLN A 53 244.917 238.475 235.018 1.00 0.00 C +ATOM 54 CA GLY A 54 245.571 234.741 234.638 1.00 0.00 C +ATOM 55 CA ALA A 55 244.196 233.085 237.782 1.00 0.00 C +ATOM 56 CA THR A 56 242.300 229.820 238.288 1.00 0.00 C +ATOM 57 CA GLU A 57 241.299 226.633 240.120 1.00 0.00 C +ATOM 58 CA SER A 58 243.457 226.270 243.239 1.00 0.00 C +ATOM 59 CA VAL A 59 247.077 225.830 242.133 1.00 0.00 C +ATOM 60 CA LYS A 60 249.399 222.811 242.057 1.00 0.00 C +ATOM 61 CA ASN A 61 247.155 219.735 241.939 1.00 0.00 C +ATOM 62 CA ALA A 62 243.528 219.838 243.104 1.00 0.00 C +ATOM 63 CA THR A 63 241.439 218.765 240.104 1.00 0.00 C +ATOM 64 CA GLY A 64 241.187 216.565 237.004 1.00 0.00 C +ATOM 65 CA MET A 65 238.418 214.484 235.417 1.00 0.00 C +ATOM 66 CA ASN A 66 237.289 210.857 235.130 1.00 0.00 C +ATOM 67 CA LYS A 67 238.940 209.127 238.096 1.00 0.00 C +TER 68 LYS A 67 +END diff --git a/Plants/Q8LB29/Q8LB29.dcd b/Plants/Q8LB29/Q8LB29.dcd new file mode 100644 index 0000000000000000000000000000000000000000..20259e5cadc4e2ccc13fc34645ee977f013366e6 --- /dev/null +++ b/Plants/Q8LB29/Q8LB29.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:bd5ad944d499ce25fd1c20079aa11071d3a63efb67e57a5d9b29cc0a0e5b00c4 +size 9920276 diff --git a/Plants/Q8LB29/top.pdb b/Plants/Q8LB29/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..130cba3aab32fc1fd32e49ba58fca0e39180038e --- /dev/null +++ b/Plants/Q8LB29/top.pdb @@ -0,0 +1,80 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 237.083 209.098 237.723 1.00 0.00 C +ATOM 2 CA GLY A 2 240.258 210.013 239.620 1.00 0.00 C +ATOM 3 CA CYS A 3 241.003 213.546 240.836 1.00 0.00 C +ATOM 4 CA PHE A 4 237.840 215.644 241.163 1.00 0.00 C +ATOM 5 CA SER A 5 238.361 219.330 241.973 1.00 0.00 C +ATOM 6 CA CYS A 6 236.746 221.628 244.548 1.00 0.00 C +ATOM 7 CA PHE A 7 238.514 225.002 244.483 1.00 0.00 C +ATOM 8 CA ASP A 8 241.513 225.199 242.141 1.00 0.00 C +ATOM 9 CA GLY A 9 242.146 227.675 239.316 1.00 0.00 C +ATOM 10 CA THR A 10 245.153 230.006 239.119 1.00 0.00 C +ATOM 11 CA GLN A 11 248.096 232.400 238.763 1.00 0.00 C +ATOM 12 CA LYS A 12 250.454 233.182 235.874 1.00 0.00 C +ATOM 13 CA GLU A 13 253.464 230.923 236.468 1.00 0.00 C +ATOM 14 CA GLN A 14 257.151 231.743 235.970 1.00 0.00 C +ATOM 15 CA ARG A 15 257.539 235.533 236.037 1.00 0.00 C +ATOM 16 CA LYS A 16 257.076 237.277 232.682 1.00 0.00 C +ATOM 17 CA GLU A 17 256.091 237.671 229.023 1.00 0.00 C +ATOM 18 CA GLU A 18 256.835 235.399 226.056 1.00 0.00 C +ATOM 19 CA GLU A 19 256.403 234.700 222.336 1.00 0.00 C +ATOM 20 CA ARG A 20 253.959 237.358 221.121 1.00 0.00 C +ATOM 21 CA GLN A 21 251.217 237.029 218.497 1.00 0.00 C +ATOM 22 CA ALA A 22 247.659 238.376 218.288 1.00 0.00 C +ATOM 23 CA SER A 23 246.197 240.453 221.128 1.00 0.00 C +ATOM 24 CA ALA A 24 246.990 242.893 223.945 1.00 0.00 C +ATOM 25 CA GLU A 25 250.441 244.357 224.626 1.00 0.00 C +ATOM 26 CA ALA A 26 251.946 243.532 228.027 1.00 0.00 C +ATOM 27 CA ARG A 27 251.554 243.644 231.815 1.00 0.00 C +ATOM 28 CA ALA A 28 253.244 244.297 235.167 1.00 0.00 C +ATOM 29 CA LYS A 29 255.085 243.037 238.255 1.00 0.00 C +ATOM 30 CA ALA A 30 257.664 243.277 241.049 1.00 0.00 C +ATOM 31 CA ALA A 31 258.251 243.835 244.772 1.00 0.00 C +ATOM 32 CA GLU A 32 257.167 240.661 246.580 1.00 0.00 C +ATOM 33 CA ALA A 33 253.777 238.961 246.939 1.00 0.00 C +ATOM 34 CA ALA A 34 251.310 236.180 247.772 1.00 0.00 C +ATOM 35 CA GLN A 35 251.855 233.207 250.092 1.00 0.00 C +ATOM 36 CA ARG A 36 252.769 231.328 253.278 1.00 0.00 C +ATOM 37 CA ARG A 37 254.973 231.454 256.384 1.00 0.00 C +ATOM 38 CA LYS A 38 254.899 234.615 258.509 1.00 0.00 C +ATOM 39 CA GLU A 39 256.634 237.949 257.882 1.00 0.00 C +ATOM 40 CA GLN A 40 258.969 238.723 254.973 1.00 0.00 C +ATOM 41 CA PHE A 41 260.935 241.575 253.386 1.00 0.00 C +ATOM 42 CA ASP A 42 260.356 244.806 255.320 1.00 0.00 C +ATOM 43 CA LYS A 43 259.857 246.595 258.647 1.00 0.00 C +ATOM 44 CA SER A 44 258.538 250.169 258.601 1.00 0.00 C +ATOM 45 CA ALA A 45 255.344 252.133 257.924 1.00 0.00 C +ATOM 46 CA ALA A 46 251.806 251.521 259.199 1.00 0.00 C +ATOM 47 CA GLY A 47 250.932 253.622 262.255 1.00 0.00 C +ATOM 48 CA ARG A 48 253.564 254.527 264.857 1.00 0.00 C +ATOM 49 CA ALA A 49 252.558 252.919 268.161 1.00 0.00 C +ATOM 50 CA ALA A 50 251.544 255.278 270.976 1.00 0.00 C +ATOM 51 CA GLN A 51 249.883 258.686 271.354 1.00 0.00 C +ATOM 52 CA ALA A 52 247.044 260.034 269.201 1.00 0.00 C +ATOM 53 CA GLN A 53 244.315 258.078 267.401 1.00 0.00 C +ATOM 54 CA LEU A 54 242.992 257.586 263.861 1.00 0.00 C +ATOM 55 CA GLN A 55 244.772 258.166 260.543 1.00 0.00 C +ATOM 56 CA GLN A 56 245.595 261.886 260.520 1.00 0.00 C +ATOM 57 CA MET A 57 248.799 262.784 262.376 1.00 0.00 C +ATOM 58 CA ALA A 58 252.321 264.211 262.637 1.00 0.00 C +ATOM 59 CA LYS A 59 252.548 267.955 261.967 1.00 0.00 C +ATOM 60 CA GLN A 60 250.493 271.150 261.678 1.00 0.00 C +ATOM 61 CA SER A 61 252.642 273.668 259.791 1.00 0.00 C +ATOM 62 CA ALA A 62 253.044 276.728 257.558 1.00 0.00 C +ATOM 63 CA ASN A 63 251.758 279.130 254.894 1.00 0.00 C +ATOM 64 CA THR A 64 249.583 282.161 255.669 1.00 0.00 C +ATOM 65 CA ASN A 65 248.316 285.754 255.679 1.00 0.00 C +ATOM 66 CA LYS A 66 245.577 286.931 258.051 1.00 0.00 C +ATOM 67 CA GLY A 67 242.774 289.511 257.999 1.00 0.00 C +ATOM 68 CA GLU A 68 240.300 288.568 260.739 1.00 0.00 C +ATOM 69 CA PRO A 69 241.487 286.531 263.732 1.00 0.00 C +ATOM 70 CA VAL A 70 244.746 288.142 264.873 1.00 0.00 C +ATOM 71 CA LEU A 71 248.171 286.558 265.394 1.00 0.00 C +ATOM 72 CA LYS A 72 248.721 284.506 268.557 1.00 0.00 C +ATOM 73 CA TRP A 73 250.036 285.215 272.062 1.00 0.00 C +ATOM 74 CA GLN A 74 247.542 286.145 274.789 1.00 0.00 C +ATOM 75 CA MET A 75 248.030 283.760 277.720 1.00 0.00 C +ATOM 76 CA THR A 76 244.788 281.877 278.396 1.00 0.00 C +TER 77 THR A 76 +END diff --git a/Plants/Q8LCD2/Q8LCD2.dcd b/Plants/Q8LCD2/Q8LCD2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..622c7b5a290bf40d1d7a8532a7b2955d7f690477 --- /dev/null +++ b/Plants/Q8LCD2/Q8LCD2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2e441f03af49f26bad70cf6bd54e50a3ead29719f670cadb3f5f40cc650c27af +size 17000276 diff --git a/Plants/Q8LCD2/top.pdb b/Plants/Q8LCD2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..1ebf2f89e286c53c7db8c80828b0a4cd2579d179 --- /dev/null +++ b/Plants/Q8LCD2/top.pdb @@ -0,0 +1,139 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 285.126 212.422 236.147 1.00 0.00 C +ATOM 2 CA GLY A 2 282.077 214.668 235.726 1.00 0.00 C +ATOM 3 CA GLY A 3 280.860 217.962 237.205 1.00 0.00 C +ATOM 4 CA CYS A 4 281.052 221.635 236.211 1.00 0.00 C +ATOM 5 CA ALA A 5 280.178 225.300 236.779 1.00 0.00 C +ATOM 6 CA SER A 6 278.814 227.999 239.097 1.00 0.00 C +ATOM 7 CA LYS A 7 275.452 229.153 237.727 1.00 0.00 C +ATOM 8 CA PRO A 8 272.747 231.523 238.984 1.00 0.00 C +ATOM 9 CA LYS A 9 270.433 232.890 236.283 1.00 0.00 C +ATOM 10 CA GLU A 10 266.795 231.811 236.626 1.00 0.00 C +ATOM 11 CA SER A 11 263.133 232.865 236.628 1.00 0.00 C +ATOM 12 CA ASP A 12 260.363 232.263 234.083 1.00 0.00 C +ATOM 13 CA ILE A 13 256.620 231.600 234.346 1.00 0.00 C +ATOM 14 CA PRO A 14 253.111 232.584 233.234 1.00 0.00 C +ATOM 15 CA GLU A 15 251.065 234.684 230.802 1.00 0.00 C +ATOM 16 CA THR A 16 247.646 236.341 230.510 1.00 0.00 C +ATOM 17 CA GLU A 17 245.098 233.573 231.113 1.00 0.00 C +ATOM 18 CA LYS A 18 243.182 231.848 233.918 1.00 0.00 C +ATOM 19 CA THR A 19 240.663 234.007 235.791 1.00 0.00 C +ATOM 20 CA VAL A 20 237.275 235.446 236.775 1.00 0.00 C +ATOM 21 CA VAL A 21 235.152 238.012 234.924 1.00 0.00 C +ATOM 22 CA GLU A 22 232.908 239.474 232.214 1.00 0.00 C +ATOM 23 CA SER A 23 232.034 236.983 229.467 1.00 0.00 C +ATOM 24 CA LYS A 24 235.356 235.355 228.558 1.00 0.00 C +ATOM 25 CA ASN A 25 238.576 236.660 226.993 1.00 0.00 C +ATOM 26 CA VAL A 26 240.523 238.757 224.478 1.00 0.00 C +ATOM 27 CA GLU A 27 240.663 240.055 220.899 1.00 0.00 C +ATOM 28 CA THR A 28 242.104 237.731 218.246 1.00 0.00 C +ATOM 29 CA GLU A 29 245.560 238.816 217.066 1.00 0.00 C +ATOM 30 CA THR A 30 245.870 241.913 214.868 1.00 0.00 C +ATOM 31 CA VAL A 31 246.654 244.399 212.088 1.00 0.00 C +ATOM 32 CA SER A 32 246.564 246.104 208.683 1.00 0.00 C +ATOM 33 CA GLN A 33 245.320 249.699 208.481 1.00 0.00 C +ATOM 34 CA GLU A 34 245.024 251.256 211.946 1.00 0.00 C +ATOM 35 CA LYS A 35 245.395 249.367 215.234 1.00 0.00 C +ATOM 36 CA ALA A 36 243.750 247.129 217.841 1.00 0.00 C +ATOM 37 CA ASP A 37 242.992 248.813 221.174 1.00 0.00 C +ATOM 38 CA GLU A 38 245.401 251.320 222.733 1.00 0.00 C +ATOM 39 CA VAL A 39 245.918 255.095 222.738 1.00 0.00 C +ATOM 40 CA VAL A 40 245.929 258.347 224.722 1.00 0.00 C +ATOM 41 CA THR A 41 245.793 257.607 228.457 1.00 0.00 C +ATOM 42 CA GLU A 42 244.307 256.088 231.619 1.00 0.00 C +ATOM 43 CA LYS A 43 246.582 253.775 233.617 1.00 0.00 C +ATOM 44 CA LYS A 44 249.281 255.850 235.327 1.00 0.00 C +ATOM 45 CA GLU A 45 248.930 259.540 236.205 1.00 0.00 C +ATOM 46 CA GLU A 46 249.699 262.665 234.165 1.00 0.00 C +ATOM 47 CA SER A 47 253.415 263.498 234.068 1.00 0.00 C +ATOM 48 CA ALA A 48 255.661 265.665 231.882 1.00 0.00 C +ATOM 49 CA GLY A 49 256.989 269.225 232.173 1.00 0.00 C +ATOM 50 CA ASP A 50 260.318 270.281 233.694 1.00 0.00 C +ATOM 51 CA VAL A 51 264.123 270.152 233.532 1.00 0.00 C +ATOM 52 CA ALA A 52 265.496 272.774 231.133 1.00 0.00 C +ATOM 53 CA GLU A 53 263.015 273.308 228.291 1.00 0.00 C +ATOM 54 CA THR A 54 259.336 274.206 227.878 1.00 0.00 C +ATOM 55 CA PRO A 55 255.741 274.327 229.135 1.00 0.00 C +ATOM 56 CA LYS A 56 252.468 272.435 229.608 1.00 0.00 C +ATOM 57 CA GLU A 57 249.456 270.658 231.120 1.00 0.00 C +ATOM 58 CA ALA A 58 246.602 268.160 230.761 1.00 0.00 C +ATOM 59 CA GLU A 59 244.760 266.776 227.727 1.00 0.00 C +ATOM 60 CA ALA A 60 241.077 265.891 228.138 1.00 0.00 C +ATOM 61 CA ALA A 61 239.250 269.063 227.080 1.00 0.00 C +ATOM 62 CA LYS A 62 239.309 272.714 228.168 1.00 0.00 C +ATOM 63 CA PRO A 63 238.859 275.939 230.146 1.00 0.00 C +ATOM 64 CA ALA A 64 239.313 277.722 233.482 1.00 0.00 C +ATOM 65 CA GLU A 65 241.706 276.382 236.127 1.00 0.00 C +ATOM 66 CA ALA A 66 243.158 273.395 237.993 1.00 0.00 C +ATOM 67 CA GLU A 67 243.042 274.395 241.668 1.00 0.00 C +ATOM 68 CA ALA A 68 245.055 273.415 244.750 1.00 0.00 C +ATOM 69 CA ALA A 69 247.215 270.341 245.378 1.00 0.00 C +ATOM 70 CA LYS A 70 250.009 268.320 246.999 1.00 0.00 C +ATOM 71 CA PRO A 71 250.516 267.869 250.748 1.00 0.00 C +ATOM 72 CA ALA A 72 249.096 265.404 253.283 1.00 0.00 C +ATOM 73 CA GLU A 73 248.333 263.310 256.372 1.00 0.00 C +ATOM 74 CA ALA A 74 246.042 261.458 258.789 1.00 0.00 C +ATOM 75 CA GLU A 75 246.191 260.780 262.535 1.00 0.00 C +ATOM 76 CA VAL A 76 246.883 261.222 266.256 1.00 0.00 C +ATOM 77 CA ALA A 77 245.193 264.307 267.720 1.00 0.00 C +ATOM 78 CA LYS A 78 242.111 264.105 269.950 1.00 0.00 C +ATOM 79 CA PRO A 79 238.455 263.045 270.115 1.00 0.00 C +ATOM 80 CA ALA A 80 236.860 262.206 273.472 1.00 0.00 C +ATOM 81 CA GLU A 81 237.796 259.698 276.183 1.00 0.00 C +ATOM 82 CA ALA A 82 236.500 256.166 275.580 1.00 0.00 C +ATOM 83 CA GLU A 83 237.607 254.712 272.237 1.00 0.00 C +ATOM 84 CA VAL A 84 237.915 251.166 270.877 1.00 0.00 C +ATOM 85 CA ALA A 85 240.184 249.533 268.288 1.00 0.00 C +ATOM 86 CA LYS A 86 241.635 246.419 266.640 1.00 0.00 C +ATOM 87 CA PRO A 87 241.162 242.661 266.231 1.00 0.00 C +ATOM 88 CA ALA A 88 239.428 240.468 268.820 1.00 0.00 C +ATOM 89 CA GLU A 89 236.602 238.034 268.042 1.00 0.00 C +ATOM 90 CA ALA A 90 235.852 234.722 266.314 1.00 0.00 C +ATOM 91 CA GLU A 91 234.406 231.220 266.714 1.00 0.00 C +ATOM 92 CA ALA A 92 234.909 230.291 270.375 1.00 0.00 C +ATOM 93 CA ALA A 93 235.614 232.807 273.147 1.00 0.00 C +ATOM 94 CA PRO A 94 237.269 232.403 276.555 1.00 0.00 C +ATOM 95 CA GLU A 95 240.508 234.003 277.765 1.00 0.00 C +ATOM 96 CA VAL A 96 239.676 237.129 279.778 1.00 0.00 C +ATOM 97 CA VAL A 97 238.362 240.646 279.130 1.00 0.00 C +ATOM 98 CA LYS A 98 236.124 243.645 279.850 1.00 0.00 C +ATOM 99 CA THR A 99 237.145 247.039 281.249 1.00 0.00 C +ATOM 100 CA GLU A 100 237.841 250.135 283.356 1.00 0.00 C +ATOM 101 CA GLU A 101 240.632 252.067 281.625 1.00 0.00 C +ATOM 102 CA ALA A 102 244.108 252.436 283.140 1.00 0.00 C +ATOM 103 CA VAL A 103 247.818 252.958 282.446 1.00 0.00 C +ATOM 104 CA VAL A 104 251.152 253.565 280.704 1.00 0.00 C +ATOM 105 CA GLU A 105 253.750 256.197 281.620 1.00 0.00 C +ATOM 106 CA THR A 106 254.401 258.908 279.024 1.00 0.00 C +ATOM 107 CA VAL A 107 256.516 262.077 278.977 1.00 0.00 C +ATOM 108 CA LYS A 108 255.164 265.638 279.001 1.00 0.00 C +ATOM 109 CA GLU A 109 253.314 267.596 276.306 1.00 0.00 C +ATOM 110 CA THR A 110 255.334 269.091 273.443 1.00 0.00 C +ATOM 111 CA GLU A 111 254.505 267.035 270.344 1.00 0.00 C +ATOM 112 CA PRO A 112 254.946 263.269 269.975 1.00 0.00 C +ATOM 113 CA PRO A 113 255.778 259.707 268.906 1.00 0.00 C +ATOM 114 CA LYS A 114 259.305 258.314 269.280 1.00 0.00 C +ATOM 115 CA GLN A 115 262.866 257.008 269.638 1.00 0.00 C +ATOM 116 CA GLU A 116 265.748 254.801 268.481 1.00 0.00 C +ATOM 117 CA GLU A 117 265.415 251.012 268.696 1.00 0.00 C +ATOM 118 CA ALA A 118 261.798 249.830 268.497 1.00 0.00 C +ATOM 119 CA VAL A 119 258.982 248.145 266.562 1.00 0.00 C +ATOM 120 CA VAL A 120 255.953 248.699 264.318 1.00 0.00 C +ATOM 121 CA ALA A 121 252.579 248.338 266.050 1.00 0.00 C +ATOM 122 CA ALA A 122 249.759 247.748 263.556 1.00 0.00 C +ATOM 123 CA ASN A 123 251.276 246.932 260.158 1.00 0.00 C +ATOM 124 CA ASP A 124 252.204 243.240 260.006 1.00 0.00 C +ATOM 125 CA THR A 125 251.935 241.813 263.529 1.00 0.00 C +ATOM 126 CA LYS A 126 252.480 240.132 266.904 1.00 0.00 C +ATOM 127 CA THR A 127 255.538 240.694 269.107 1.00 0.00 C +ATOM 128 CA ASN A 128 255.339 243.778 271.335 1.00 0.00 C +ATOM 129 CA GLU A 129 256.975 242.674 274.594 1.00 0.00 C +ATOM 130 CA GLU A 130 260.242 240.832 275.264 1.00 0.00 C +ATOM 131 CA PRO A 131 260.536 237.053 274.877 1.00 0.00 C +ATOM 132 CA LEU A 132 263.174 234.339 275.320 1.00 0.00 C +ATOM 133 CA VAL A 133 263.013 231.236 277.524 1.00 0.00 C +ATOM 134 CA THR A 134 260.023 228.877 277.624 1.00 0.00 C +ATOM 135 CA LEU A 135 257.885 226.931 275.143 1.00 0.00 C +TER 136 LEU A 135 +END diff --git a/Plants/Q8LCF4/Q8LCF4.dcd b/Plants/Q8LCF4/Q8LCF4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..9f7cef6612420b4e267acedc255e8e32a66bc525 --- /dev/null +++ b/Plants/Q8LCF4/Q8LCF4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:9e67df72db17fff350fedd9f2e55e5b70cbfbee7245d5dd2ee1e7cee076bb7e0 +size 11480276 diff --git a/Plants/Q8LCF4/top.pdb b/Plants/Q8LCF4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..07be9ebaaf218442f06829f48253b7ade2e22926 --- /dev/null +++ b/Plants/Q8LCF4/top.pdb @@ -0,0 +1,93 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 251.642 221.274 225.883 1.00 0.00 C +ATOM 2 CA ALA A 2 252.128 224.941 224.971 1.00 0.00 C +ATOM 3 CA THR A 3 250.398 228.332 224.816 1.00 0.00 C +ATOM 4 CA GLY A 4 248.966 231.774 225.602 1.00 0.00 C +ATOM 5 CA ASN A 5 250.627 235.052 226.608 1.00 0.00 C +ATOM 6 CA ARG A 6 253.609 237.017 227.937 1.00 0.00 C +ATOM 7 CA ALA A 7 254.121 238.975 231.165 1.00 0.00 C +ATOM 8 CA ARG A 8 257.390 240.082 232.779 1.00 0.00 C +ATOM 9 CA PRO A 9 259.590 242.171 230.475 1.00 0.00 C +ATOM 10 CA LEU A 10 262.782 243.536 232.045 1.00 0.00 C +ATOM 11 CA PRO A 11 266.203 243.002 233.635 1.00 0.00 C +ATOM 12 CA LYS A 12 268.425 243.877 236.603 1.00 0.00 C +ATOM 13 CA PHE A 13 266.946 246.237 239.204 1.00 0.00 C +ATOM 14 CA GLY A 14 264.531 245.960 242.137 1.00 0.00 C +ATOM 15 CA GLU A 15 265.404 247.903 245.296 1.00 0.00 C +ATOM 16 CA TRP A 16 264.209 245.677 248.147 1.00 0.00 C +ATOM 17 CA ASP A 17 262.065 246.617 251.154 1.00 0.00 C +ATOM 18 CA ALA A 18 263.476 246.058 254.648 1.00 0.00 C +ATOM 19 CA THR A 19 264.783 245.193 258.121 1.00 0.00 C +ATOM 20 CA ASN A 20 268.529 244.559 257.831 1.00 0.00 C +ATOM 21 CA PRO A 21 271.048 244.594 260.689 1.00 0.00 C +ATOM 22 CA GLY A 22 270.076 247.225 263.269 1.00 0.00 C +ATOM 23 CA SER A 23 268.771 247.854 266.793 1.00 0.00 C +ATOM 24 CA ALA A 24 267.141 247.119 270.157 1.00 0.00 C +ATOM 25 CA GLU A 25 264.110 246.414 272.355 1.00 0.00 C +ATOM 26 CA GLY A 26 264.168 244.093 275.376 1.00 0.00 C +ATOM 27 CA PHE A 27 265.376 245.913 278.497 1.00 0.00 C +ATOM 28 CA THR A 28 263.843 249.094 279.928 1.00 0.00 C +ATOM 29 CA VAL A 29 261.378 251.445 278.222 1.00 0.00 C +ATOM 30 CA ILE A 30 258.075 252.936 279.399 1.00 0.00 C +ATOM 31 CA PHE A 31 254.415 253.992 279.359 1.00 0.00 C +ATOM 32 CA ASN A 32 251.523 255.789 281.068 1.00 0.00 C +ATOM 33 CA LYS A 33 249.916 257.864 278.306 1.00 0.00 C +ATOM 34 CA ALA A 34 248.793 260.508 275.804 1.00 0.00 C +ATOM 35 CA ARG A 35 249.002 261.709 272.194 1.00 0.00 C +ATOM 36 CA ASP A 36 246.454 264.449 271.474 1.00 0.00 C +ATOM 37 CA ASP A 37 247.215 268.180 271.588 1.00 0.00 C +ATOM 38 CA LYS A 38 247.322 271.988 271.519 1.00 0.00 C +ATOM 39 CA LYS A 39 250.510 272.857 273.416 1.00 0.00 C +ATOM 40 CA THR A 40 253.400 271.461 275.470 1.00 0.00 C +ATOM 41 CA MET A 41 255.821 269.063 273.767 1.00 0.00 C +ATOM 42 CA LYS A 42 253.645 266.163 272.594 1.00 0.00 C +ATOM 43 CA THR A 43 255.229 263.201 270.795 1.00 0.00 C +ATOM 44 CA ALA A 44 254.636 259.483 270.211 1.00 0.00 C +ATOM 45 CA VAL A 45 256.397 256.421 268.783 1.00 0.00 C +ATOM 46 CA ALA A 46 257.776 254.983 265.536 1.00 0.00 C +ATOM 47 CA GLY A 47 259.902 252.830 263.221 1.00 0.00 C +ATOM 48 CA PRO A 48 258.201 250.556 260.681 1.00 0.00 C +ATOM 49 CA GLU A 49 257.407 250.354 256.960 1.00 0.00 C +ATOM 50 CA SER A 50 256.910 253.046 254.311 1.00 0.00 C +ATOM 51 CA ILE A 51 256.926 253.512 250.529 1.00 0.00 C +ATOM 52 CA VAL A 52 256.911 252.204 246.951 1.00 0.00 C +ATOM 53 CA SER A 53 254.737 253.490 244.099 1.00 0.00 C +ATOM 54 CA PRO A 54 254.959 256.981 242.589 1.00 0.00 C +ATOM 55 CA PRO A 55 252.315 259.723 242.653 1.00 0.00 C +ATOM 56 CA ARG A 56 248.719 258.907 243.610 1.00 0.00 C +ATOM 57 CA ASN A 57 247.711 256.037 241.317 1.00 0.00 C +ATOM 58 CA GLU A 58 249.464 256.782 238.017 1.00 0.00 C +ATOM 59 CA GLU A 59 247.621 259.372 235.917 1.00 0.00 C +ATOM 60 CA PRO A 60 244.310 259.568 234.042 1.00 0.00 C +ATOM 61 CA PRO A 61 243.397 263.063 232.832 1.00 0.00 C +ATOM 62 CA LYS A 62 240.118 264.986 233.093 1.00 0.00 C +ATOM 63 CA ASN A 63 237.722 266.701 235.509 1.00 0.00 C +ATOM 64 CA ASN A 64 236.977 268.367 238.853 1.00 0.00 C +ATOM 65 CA ASN A 65 233.907 267.296 240.838 1.00 0.00 C +ATOM 66 CA ASN A 66 230.109 267.275 240.530 1.00 0.00 C +ATOM 67 CA HIS A 67 228.599 265.703 243.655 1.00 0.00 C +ATOM 68 CA HIS A 68 226.604 262.615 244.652 1.00 0.00 C +ATOM 69 CA HIS A 69 228.635 259.424 244.195 1.00 0.00 C +ATOM 70 CA ASN A 70 228.504 256.245 242.100 1.00 0.00 C +ATOM 71 CA HIS A 71 231.034 253.626 240.977 1.00 0.00 C +ATOM 72 CA HIS A 72 234.505 252.439 242.004 1.00 0.00 C +ATOM 73 CA THR A 73 236.575 249.939 240.008 1.00 0.00 C +ATOM 74 CA ARG A 74 240.276 249.286 239.383 1.00 0.00 C +ATOM 75 CA HIS A 75 241.951 246.872 241.809 1.00 0.00 C +ATOM 76 CA SER A 76 240.845 247.057 245.450 1.00 0.00 C +ATOM 77 CA GLN A 77 241.254 243.977 247.655 1.00 0.00 C +ATOM 78 CA THR A 78 238.623 241.653 249.138 1.00 0.00 C +ATOM 79 CA PRO A 79 236.877 239.370 246.637 1.00 0.00 C +ATOM 80 CA ARG A 80 236.615 236.341 244.341 1.00 0.00 C +ATOM 81 CA SER A 81 234.149 234.718 241.932 1.00 0.00 C +ATOM 82 CA LYS A 82 230.969 235.781 240.122 1.00 0.00 C +ATOM 83 CA LYS A 83 228.433 233.876 238.012 1.00 0.00 C +ATOM 84 CA LYS A 84 227.954 232.937 234.351 1.00 0.00 C +ATOM 85 CA TRP A 85 230.839 231.497 232.322 1.00 0.00 C +ATOM 86 CA LEU A 86 234.152 229.762 231.593 1.00 0.00 C +ATOM 87 CA CYS A 87 237.957 229.851 231.753 1.00 0.00 C +ATOM 88 CA PHE A 88 240.635 231.497 233.906 1.00 0.00 C +ATOM 89 CA ARG A 89 243.830 231.449 231.830 1.00 0.00 C +TER 90 ARG A 89 +END diff --git a/Plants/Q8LCH2/Q8LCH2.dcd b/Plants/Q8LCH2/Q8LCH2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..6038d81113edcb5adb0cae6f563e2c3b43a79c45 --- /dev/null +++ b/Plants/Q8LCH2/Q8LCH2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:4cdebd95218f616e5ec06e7b7c1a7190cb5ef6bae57f9a3c8f085307e4b52efb +size 19040276 diff --git a/Plants/Q8LCH2/top.pdb b/Plants/Q8LCH2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..39aeae5367605ef83e7d1387aed103f71184621f --- /dev/null +++ b/Plants/Q8LCH2/top.pdb @@ -0,0 +1,156 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 171.369 282.159 196.583 1.00 0.00 C +ATOM 2 CA GLU A 2 171.700 281.971 200.374 1.00 0.00 C +ATOM 3 CA ARG A 3 174.583 283.975 201.852 1.00 0.00 C +ATOM 4 CA ARG A 4 178.037 285.570 201.646 1.00 0.00 C +ATOM 5 CA PRO A 5 180.936 284.836 204.007 1.00 0.00 C +ATOM 6 CA PRO A 6 184.098 283.606 205.741 1.00 0.00 C +ATOM 7 CA ARG A 7 186.858 282.726 203.266 1.00 0.00 C +ATOM 8 CA LYS A 8 190.483 281.580 203.515 1.00 0.00 C +ATOM 9 CA ARG A 9 193.600 282.837 205.308 1.00 0.00 C +ATOM 10 CA LYS A 10 195.669 281.558 208.241 1.00 0.00 C +ATOM 11 CA PHE A 11 199.103 280.053 208.918 1.00 0.00 C +ATOM 12 CA GLN A 12 202.054 282.408 208.402 1.00 0.00 C +ATOM 13 CA GLU A 13 205.777 281.694 208.779 1.00 0.00 C +ATOM 14 CA LEU A 14 209.122 280.289 207.616 1.00 0.00 C +ATOM 15 CA PRO A 15 211.795 278.164 205.926 1.00 0.00 C +ATOM 16 CA ALA A 16 214.590 278.444 203.352 1.00 0.00 C +ATOM 17 CA ASP A 17 213.462 279.299 199.815 1.00 0.00 C +ATOM 18 CA CYS A 18 212.611 282.619 198.151 1.00 0.00 C +ATOM 19 CA LYS A 19 211.250 282.443 194.597 1.00 0.00 C +ATOM 20 CA VAL A 20 212.196 284.266 191.388 1.00 0.00 C +ATOM 21 CA PRO A 21 211.395 287.703 189.951 1.00 0.00 C +ATOM 22 CA GLU A 22 213.600 289.253 187.259 1.00 0.00 C +ATOM 23 CA LYS A 23 215.628 292.467 187.542 1.00 0.00 C +ATOM 24 CA ASP A 24 217.813 295.587 187.474 1.00 0.00 C +ATOM 25 CA LYS A 25 219.953 298.596 186.537 1.00 0.00 C +ATOM 26 CA GLN A 26 222.911 299.947 188.523 1.00 0.00 C +ATOM 27 CA GLN A 27 226.172 300.138 190.483 1.00 0.00 C +ATOM 28 CA SER A 28 226.905 296.521 191.428 1.00 0.00 C +ATOM 29 CA GLU A 29 224.486 293.582 191.585 1.00 0.00 C +ATOM 30 CA LEU A 30 222.113 291.104 193.243 1.00 0.00 C +ATOM 31 CA ALA A 31 221.059 292.729 196.524 1.00 0.00 C +ATOM 32 CA MET A 32 218.687 290.971 198.933 1.00 0.00 C +ATOM 33 CA THR A 33 217.944 287.719 200.773 1.00 0.00 C +ATOM 34 CA GLY A 34 217.119 285.232 203.539 1.00 0.00 C +ATOM 35 CA ASP A 35 215.015 285.341 206.714 1.00 0.00 C +ATOM 36 CA VAL A 36 217.392 284.571 209.590 1.00 0.00 C +ATOM 37 CA THR A 37 219.978 282.988 211.897 1.00 0.00 C +ATOM 38 CA PRO A 38 219.268 279.427 213.050 1.00 0.00 C +ATOM 39 CA SER A 39 222.087 277.137 214.201 1.00 0.00 C +ATOM 40 CA ALA A 40 221.771 276.378 217.921 1.00 0.00 C +ATOM 41 CA ASN A 41 223.116 273.138 219.409 1.00 0.00 C +ATOM 42 CA ARG A 42 226.916 272.877 219.474 1.00 0.00 C +ATOM 43 CA VAL A 43 230.358 271.567 220.452 1.00 0.00 C +ATOM 44 CA ARG A 44 231.461 268.394 222.249 1.00 0.00 C +ATOM 45 CA SER A 45 235.258 268.624 222.467 1.00 0.00 C +ATOM 46 CA PRO A 46 236.031 269.745 226.026 1.00 0.00 C +ATOM 47 CA PRO A 47 234.842 268.977 229.563 1.00 0.00 C +ATOM 48 CA SER A 48 235.753 271.734 232.030 1.00 0.00 C +ATOM 49 CA PRO A 49 236.791 273.124 235.423 1.00 0.00 C +ATOM 50 CA ARG A 50 239.638 274.992 237.132 1.00 0.00 C +ATOM 51 CA SER A 51 241.666 274.667 240.340 1.00 0.00 C +ATOM 52 CA VAL A 52 245.465 274.731 240.055 1.00 0.00 C +ATOM 53 CA MET A 53 248.282 272.424 241.176 1.00 0.00 C +ATOM 54 CA PRO A 54 252.043 272.870 240.756 1.00 0.00 C +ATOM 55 CA PRO A 55 255.403 271.275 241.581 1.00 0.00 C +ATOM 56 CA PRO A 56 257.301 268.453 243.300 1.00 0.00 C +ATOM 57 CA PRO A 57 259.308 269.649 246.309 1.00 0.00 C +ATOM 58 CA PRO A 58 261.849 271.584 248.387 1.00 0.00 C +ATOM 59 CA LYS A 59 264.747 271.926 250.836 1.00 0.00 C +ATOM 60 CA THR A 60 264.054 270.694 254.374 1.00 0.00 C +ATOM 61 CA ILE A 61 265.027 268.011 256.898 1.00 0.00 C +ATOM 62 CA ALA A 62 265.379 266.939 260.537 1.00 0.00 C +ATOM 63 CA PRO A 63 264.689 266.907 264.284 1.00 0.00 C +ATOM 64 CA PRO A 64 263.564 263.807 266.191 1.00 0.00 C +ATOM 65 CA PRO A 65 266.110 262.442 268.675 1.00 0.00 C +ATOM 66 CA SER A 66 265.285 259.965 271.450 1.00 0.00 C +ATOM 67 CA LYS A 67 263.107 256.885 271.989 1.00 0.00 C +ATOM 68 CA THR A 68 261.023 253.909 270.842 1.00 0.00 C +ATOM 69 CA MET A 69 260.159 251.872 273.944 1.00 0.00 C +ATOM 70 CA SER A 70 262.773 249.958 275.950 1.00 0.00 C +ATOM 71 CA PRO A 71 264.936 247.423 277.796 1.00 0.00 C +ATOM 72 CA PRO A 72 266.685 244.463 279.438 1.00 0.00 C +ATOM 73 CA SER A 73 267.970 245.275 282.932 1.00 0.00 C +ATOM 74 CA SER A 74 266.399 242.686 285.244 1.00 0.00 C +ATOM 75 CA LYS A 75 264.316 244.489 287.875 1.00 0.00 C +ATOM 76 CA SER A 76 262.748 242.248 290.528 1.00 0.00 C +ATOM 77 CA MET A 77 260.161 240.084 292.300 1.00 0.00 C +ATOM 78 CA LEU A 78 256.883 238.396 291.340 1.00 0.00 C +ATOM 79 CA PRO A 79 253.994 238.647 288.869 1.00 0.00 C +ATOM 80 CA PRO A 80 251.213 236.042 288.828 1.00 0.00 C +ATOM 81 CA PRO A 81 250.497 232.733 290.576 1.00 0.00 C +ATOM 82 CA PRO A 82 252.073 229.577 292.014 1.00 0.00 C +ATOM 83 CA ARG A 83 251.580 225.951 290.952 1.00 0.00 C +ATOM 84 CA SER A 84 249.543 225.746 287.739 1.00 0.00 C +ATOM 85 CA LYS A 85 251.797 225.777 284.668 1.00 0.00 C +ATOM 86 CA THR A 86 254.946 224.976 282.678 1.00 0.00 C +ATOM 87 CA MET A 87 257.712 224.838 280.062 1.00 0.00 C +ATOM 88 CA SER A 88 261.447 225.140 279.374 1.00 0.00 C +ATOM 89 CA PRO A 89 263.352 225.921 276.169 1.00 0.00 C +ATOM 90 CA LEU A 90 262.928 227.900 272.941 1.00 0.00 C +ATOM 91 CA THR A 91 259.391 229.304 273.114 1.00 0.00 C +ATOM 92 CA SER A 92 258.203 232.781 274.123 1.00 0.00 C +ATOM 93 CA LYS A 93 258.959 234.257 277.554 1.00 0.00 C +ATOM 94 CA SER A 94 256.941 236.291 280.065 1.00 0.00 C +ATOM 95 CA MET A 95 259.255 237.986 282.572 1.00 0.00 C +ATOM 96 CA LEU A 96 262.749 239.292 281.793 1.00 0.00 C +ATOM 97 CA PRO A 97 265.298 236.781 280.484 1.00 0.00 C +ATOM 98 CA PRO A 98 267.302 234.266 278.441 1.00 0.00 C +ATOM 99 CA PRO A 99 270.347 233.536 280.611 1.00 0.00 C +ATOM 100 CA PRO A 100 271.788 230.108 279.781 1.00 0.00 C +ATOM 101 CA ARG A 101 273.725 227.060 278.567 1.00 0.00 C +ATOM 102 CA PHE A 102 276.167 228.352 275.943 1.00 0.00 C +ATOM 103 CA THR A 103 276.542 227.611 272.225 1.00 0.00 C +ATOM 104 CA LEU A 104 274.122 227.710 269.284 1.00 0.00 C +ATOM 105 CA THR A 105 272.454 227.788 265.859 1.00 0.00 C +ATOM 106 CA THR A 106 274.027 225.082 263.687 1.00 0.00 C +ATOM 107 CA GLN A 107 273.020 221.482 264.420 1.00 0.00 C +ATOM 108 CA PRO A 108 269.565 220.981 265.945 1.00 0.00 C +ATOM 109 CA SER A 109 268.840 217.243 266.085 1.00 0.00 C +ATOM 110 CA ARG A 110 269.260 215.854 262.562 1.00 0.00 C +ATOM 111 CA LEU A 111 271.250 213.348 260.493 1.00 0.00 C +ATOM 112 CA GLN A 112 271.671 209.808 259.151 1.00 0.00 C +ATOM 113 CA ASP A 113 272.378 207.645 262.206 1.00 0.00 C +ATOM 114 CA ASN A 114 271.755 207.859 265.959 1.00 0.00 C +ATOM 115 CA HIS A 115 274.802 209.307 267.730 1.00 0.00 C +ATOM 116 CA ILE A 116 275.187 213.097 267.781 1.00 0.00 C +ATOM 117 CA SER A 117 274.517 216.679 268.890 1.00 0.00 C +ATOM 118 CA VAL A 118 272.252 216.950 271.942 1.00 0.00 C +ATOM 119 CA LYS A 119 271.033 219.943 273.961 1.00 0.00 C +ATOM 120 CA LYS A 120 271.916 223.546 273.091 1.00 0.00 C +ATOM 121 CA PRO A 121 269.366 226.373 272.946 1.00 0.00 C +ATOM 122 CA ASN A 122 268.508 229.971 272.034 1.00 0.00 C +ATOM 123 CA PRO A 123 266.041 232.753 271.202 1.00 0.00 C +ATOM 124 CA VAL A 124 265.853 236.492 270.492 1.00 0.00 C +ATOM 125 CA PRO A 125 267.020 239.428 268.363 1.00 0.00 C +ATOM 126 CA ASP A 126 269.429 240.638 265.671 1.00 0.00 C +ATOM 127 CA THR A 127 273.014 239.410 265.280 1.00 0.00 C +ATOM 128 CA LEU A 128 274.250 236.641 267.588 1.00 0.00 C +ATOM 129 CA ILE A 129 274.799 237.212 271.315 1.00 0.00 C +ATOM 130 CA LYS A 130 274.924 235.003 274.417 1.00 0.00 C +ATOM 131 CA LEU A 131 278.266 234.136 276.028 1.00 0.00 C +ATOM 132 CA MET A 132 281.295 236.442 275.885 1.00 0.00 C +ATOM 133 CA GLU A 133 284.169 237.189 278.273 1.00 0.00 C +ATOM 134 CA TYR A 134 286.066 234.308 279.890 1.00 0.00 C +ATOM 135 CA GLY A 135 289.854 234.059 279.566 1.00 0.00 C +ATOM 136 CA ASP A 136 290.481 231.727 276.619 1.00 0.00 C +ATOM 137 CA ASP A 137 289.955 228.573 274.546 1.00 0.00 C +ATOM 138 CA GLU A 138 288.614 225.098 275.348 1.00 0.00 C +ATOM 139 CA ASP A 139 285.413 223.296 274.339 1.00 0.00 C +ATOM 140 CA ASP A 140 284.276 220.769 271.724 1.00 0.00 C +ATOM 141 CA ASP A 141 280.785 220.089 270.358 1.00 0.00 C +ATOM 142 CA ASP A 142 280.507 216.956 268.208 1.00 0.00 C +ATOM 143 CA ASP A 143 282.535 213.872 269.154 1.00 0.00 C +ATOM 144 CA PRO A 144 282.960 212.649 272.737 1.00 0.00 C +ATOM 145 CA ASP A 145 284.249 209.656 274.710 1.00 0.00 C +ATOM 146 CA GLU A 146 284.460 205.900 275.315 1.00 0.00 C +ATOM 147 CA PRO A 147 282.423 202.840 276.317 1.00 0.00 C +ATOM 148 CA LEU A 148 278.875 202.194 275.090 1.00 0.00 C +ATOM 149 CA THR A 149 277.533 198.674 275.661 1.00 0.00 C +ATOM 150 CA THR A 150 273.832 197.808 275.394 1.00 0.00 C +ATOM 151 CA ARG A 151 273.400 196.510 271.838 1.00 0.00 C +ATOM 152 CA SER A 152 272.959 193.048 270.310 1.00 0.00 C +TER 153 SER A 152 +END diff --git a/Plants/Q8LCM2/Q8LCM2.dcd b/Plants/Q8LCM2/Q8LCM2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..5da03da4321cc36f1b02328975cf4b9eef6b9c9d --- /dev/null +++ b/Plants/Q8LCM2/Q8LCM2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:6b7e78577b59e557e08303c3533e073d82c78d540b72ac60728349e71f7ab3f5 +size 8600276 diff --git a/Plants/Q8LCM2/top.pdb b/Plants/Q8LCM2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..bb2f5da6b7bc56fea9200fc62d13840d137120ad --- /dev/null +++ b/Plants/Q8LCM2/top.pdb @@ -0,0 +1,69 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA GLU A 1 297.988 244.208 252.795 1.00 0.00 C +ATOM 2 CA MET A 2 294.919 241.950 252.843 1.00 0.00 C +ATOM 3 CA ARG A 3 291.624 242.124 254.748 1.00 0.00 C +ATOM 4 CA GLY A 4 288.110 242.076 256.218 1.00 0.00 C +ATOM 5 CA ASN A 5 287.682 238.854 258.206 1.00 0.00 C +ATOM 6 CA LYS A 6 284.266 237.239 257.720 1.00 0.00 C +ATOM 7 CA ILE A 7 282.941 234.946 254.981 1.00 0.00 C +ATOM 8 CA SER A 8 279.181 234.474 254.585 1.00 0.00 C +ATOM 9 CA VAL A 9 276.094 234.405 252.353 1.00 0.00 C +ATOM 10 CA THR A 10 273.212 234.089 249.882 1.00 0.00 C +ATOM 11 CA MET A 11 270.022 235.545 248.391 1.00 0.00 C +ATOM 12 CA ALA A 12 266.334 236.127 247.632 1.00 0.00 C +ATOM 13 CA GLU A 13 265.357 239.527 246.219 1.00 0.00 C +ATOM 14 CA LYS A 14 264.541 241.841 243.303 1.00 0.00 C +ATOM 15 CA SER A 15 263.378 245.094 244.908 1.00 0.00 C +ATOM 16 CA ALA A 16 265.203 248.077 243.395 1.00 0.00 C +ATOM 17 CA PRO A 17 264.605 251.723 244.322 1.00 0.00 C +ATOM 18 CA ARG A 18 262.079 254.016 246.020 1.00 0.00 C +ATOM 19 CA ALA A 19 264.198 256.592 247.862 1.00 0.00 C +ATOM 20 CA PRO A 20 262.238 259.479 249.390 1.00 0.00 C +ATOM 21 CA THR A 21 260.406 258.982 252.694 1.00 0.00 C +ATOM 22 CA PHE A 22 257.947 260.103 255.379 1.00 0.00 C +ATOM 23 CA ASP A 23 254.270 261.099 255.324 1.00 0.00 C +ATOM 24 CA GLN A 24 251.546 258.936 256.878 1.00 0.00 C +ATOM 25 CA ARG A 25 248.100 258.917 258.503 1.00 0.00 C +ATOM 26 CA GLY A 26 244.809 257.273 259.494 1.00 0.00 C +ATOM 27 CA GLY A 27 242.509 256.060 262.279 1.00 0.00 C +ATOM 28 CA GLY A 28 240.805 253.325 264.312 1.00 0.00 C +ATOM 29 CA ARG A 29 239.158 250.769 262.017 1.00 0.00 C +ATOM 30 CA GLY A 30 235.761 249.178 262.682 1.00 0.00 C +ATOM 31 CA GLY A 31 232.970 250.674 260.563 1.00 0.00 C +ATOM 32 CA GLY A 32 231.662 251.637 257.117 1.00 0.00 C +ATOM 33 CA GLY A 33 228.626 249.627 255.996 1.00 0.00 C +ATOM 34 CA GLY A 34 227.216 246.249 254.939 1.00 0.00 C +ATOM 35 CA GLY A 35 226.327 242.719 253.816 1.00 0.00 C +ATOM 36 CA TYR A 36 225.661 243.084 250.082 1.00 0.00 C +ATOM 37 CA GLY A 37 225.593 243.197 246.274 1.00 0.00 C +ATOM 38 CA GLY A 38 228.429 243.927 243.837 1.00 0.00 C +ATOM 39 CA GLY A 39 229.605 244.081 240.216 1.00 0.00 C +ATOM 40 CA GLY A 40 232.779 246.189 240.217 1.00 0.00 C +ATOM 41 CA GLY A 41 236.474 247.115 240.257 1.00 0.00 C +ATOM 42 CA ASP A 42 240.110 248.135 240.764 1.00 0.00 C +ATOM 43 CA ARG A 43 242.161 246.677 243.625 1.00 0.00 C +ATOM 44 CA ARG A 44 242.889 248.787 246.713 1.00 0.00 C +ATOM 45 CA ARG A 45 243.986 246.997 249.892 1.00 0.00 C +ATOM 46 CA ASP A 46 246.911 246.578 252.298 1.00 0.00 C +ATOM 47 CA ASN A 47 250.378 247.278 250.882 1.00 0.00 C +ATOM 48 CA TYR A 48 253.968 247.465 249.621 1.00 0.00 C +ATOM 49 CA SER A 49 254.878 250.691 247.809 1.00 0.00 C +ATOM 50 CA SER A 50 256.453 253.899 249.129 1.00 0.00 C +ATOM 51 CA GLY A 51 253.724 256.396 250.040 1.00 0.00 C +ATOM 52 CA PRO A 52 249.917 256.307 250.178 1.00 0.00 C +ATOM 53 CA ASP A 53 246.253 255.416 249.632 1.00 0.00 C +ATOM 54 CA ARG A 54 244.264 258.353 248.242 1.00 0.00 C +ATOM 55 CA ASN A 55 240.988 257.744 246.395 1.00 0.00 C +ATOM 56 CA HIS A 56 238.044 257.860 243.979 1.00 0.00 C +ATOM 57 CA HIS A 57 234.473 259.097 243.497 1.00 0.00 C +ATOM 58 CA GLY A 58 233.145 258.311 240.014 1.00 0.00 C +ATOM 59 CA GLY A 59 229.686 256.769 240.430 1.00 0.00 C +ATOM 60 CA ASN A 60 226.446 257.666 238.639 1.00 0.00 C +ATOM 61 CA ARG A 61 224.511 260.458 240.365 1.00 0.00 C +ATOM 62 CA SER A 62 223.240 263.638 242.034 1.00 0.00 C +ATOM 63 CA ARG A 63 223.531 264.652 245.695 1.00 0.00 C +ATOM 64 CA PRO A 64 222.238 263.255 248.996 1.00 0.00 C +ATOM 65 CA TYR A 65 223.183 262.047 252.483 1.00 0.00 C +TER 66 TYR A 65 +END diff --git a/Plants/Q8LCW4/Q8LCW4.dcd b/Plants/Q8LCW4/Q8LCW4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..647ce48aa89c3cc114c02b3e37fa859748156e22 --- /dev/null +++ b/Plants/Q8LCW4/Q8LCW4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:3d30c57d2fc4c3dde29b5fe33b2a8664fcc0f2c0dac64a90c0648e7bfc6b5f8f +size 8840276 diff --git a/Plants/Q8LCW4/top.pdb b/Plants/Q8LCW4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a434c984f77e459db1d427392f1f9999278ba89f --- /dev/null +++ b/Plants/Q8LCW4/top.pdb @@ -0,0 +1,71 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 250.031 248.818 289.585 1.00 0.00 C +ATOM 2 CA SER A 2 251.095 250.135 286.172 1.00 0.00 C +ATOM 3 CA ASN A 3 250.573 251.435 282.629 1.00 0.00 C +ATOM 4 CA ASN A 4 249.049 254.477 280.915 1.00 0.00 C +ATOM 5 CA SER A 5 249.612 256.009 277.472 1.00 0.00 C +ATOM 6 CA GLN A 6 250.379 254.735 273.964 1.00 0.00 C +ATOM 7 CA SER A 7 247.507 253.044 272.119 1.00 0.00 C +ATOM 8 CA MET A 8 243.906 253.513 273.271 1.00 0.00 C +ATOM 9 CA SER A 9 242.130 254.783 276.393 1.00 0.00 C +ATOM 10 CA PHE A 10 238.843 253.357 277.689 1.00 0.00 C +ATOM 11 CA ASN A 11 237.728 250.592 275.316 1.00 0.00 C +ATOM 12 CA ALA A 12 238.580 246.932 274.690 1.00 0.00 C +ATOM 13 CA GLY A 13 240.950 243.950 274.766 1.00 0.00 C +ATOM 14 CA GLN A 14 242.603 242.532 271.640 1.00 0.00 C +ATOM 15 CA ALA A 15 246.149 241.811 270.448 1.00 0.00 C +ATOM 16 CA LYS A 16 247.516 241.697 266.893 1.00 0.00 C +ATOM 17 CA GLY A 17 250.125 244.470 266.748 1.00 0.00 C +ATOM 18 CA GLN A 18 251.101 248.150 266.610 1.00 0.00 C +ATOM 19 CA THR A 19 251.583 251.850 265.841 1.00 0.00 C +ATOM 20 CA GLN A 20 251.211 253.840 262.613 1.00 0.00 C +ATOM 21 CA GLU A 21 253.673 255.154 260.020 1.00 0.00 C +ATOM 22 CA LYS A 22 251.892 258.039 258.282 1.00 0.00 C +ATOM 23 CA ALA A 23 248.782 260.151 257.660 1.00 0.00 C +ATOM 24 CA SER A 24 245.152 259.336 258.483 1.00 0.00 C +ATOM 25 CA ASN A 25 243.032 261.440 256.117 1.00 0.00 C +ATOM 26 CA LEU A 26 242.001 260.012 252.739 1.00 0.00 C +ATOM 27 CA MET A 27 240.418 257.213 250.695 1.00 0.00 C +ATOM 28 CA ASP A 28 239.291 254.613 248.148 1.00 0.00 C +ATOM 29 CA LYS A 29 241.895 251.945 247.362 1.00 0.00 C +ATOM 30 CA ALA A 30 242.433 249.029 244.970 1.00 0.00 C +ATOM 31 CA SER A 31 239.941 246.351 246.034 1.00 0.00 C +ATOM 32 CA ASN A 32 236.419 247.019 247.326 1.00 0.00 C +ATOM 33 CA ALA A 33 234.470 243.848 248.138 1.00 0.00 C +ATOM 34 CA ALA A 34 232.739 240.504 248.717 1.00 0.00 C +ATOM 35 CA GLN A 35 233.068 236.774 248.015 1.00 0.00 C +ATOM 36 CA SER A 36 233.830 233.601 246.047 1.00 0.00 C +ATOM 37 CA ALA A 37 234.184 234.559 242.376 1.00 0.00 C +ATOM 38 CA LYS A 38 235.770 238.015 242.153 1.00 0.00 C +ATOM 39 CA GLU A 39 237.396 241.255 240.978 1.00 0.00 C +ATOM 40 CA SER A 40 239.333 240.978 237.709 1.00 0.00 C +ATOM 41 CA ILE A 41 236.895 241.812 234.903 1.00 0.00 C +ATOM 42 CA GLN A 42 236.031 242.936 231.366 1.00 0.00 C +ATOM 43 CA GLU A 43 235.531 246.429 229.930 1.00 0.00 C +ATOM 44 CA GLY A 44 239.027 247.763 229.213 1.00 0.00 C +ATOM 45 CA GLY A 45 239.043 249.822 226.007 1.00 0.00 C +ATOM 46 CA GLN A 46 242.288 251.643 225.190 1.00 0.00 C +ATOM 47 CA GLN A 47 242.787 254.712 222.987 1.00 0.00 C +ATOM 48 CA LEU A 48 244.384 257.512 225.018 1.00 0.00 C +ATOM 49 CA LYS A 49 247.539 259.555 225.640 1.00 0.00 C +ATOM 50 CA GLN A 50 250.861 260.098 223.854 1.00 0.00 C +ATOM 51 CA LYS A 51 254.256 258.401 224.188 1.00 0.00 C +ATOM 52 CA ALA A 52 257.794 259.777 224.516 1.00 0.00 C +ATOM 53 CA GLN A 53 260.458 257.532 226.059 1.00 0.00 C +ATOM 54 CA GLY A 54 264.203 257.925 226.639 1.00 0.00 C +ATOM 55 CA ALA A 55 267.325 255.767 226.973 1.00 0.00 C +ATOM 56 CA SER A 56 266.492 252.212 225.884 1.00 0.00 C +ATOM 57 CA GLU A 57 268.017 249.492 228.073 1.00 0.00 C +ATOM 58 CA THR A 58 270.905 250.321 230.416 1.00 0.00 C +ATOM 59 CA ILE A 59 274.122 249.609 232.328 1.00 0.00 C +ATOM 60 CA LYS A 60 274.509 249.478 236.116 1.00 0.00 C +ATOM 61 CA GLU A 61 275.882 249.440 239.670 1.00 0.00 C +ATOM 62 CA LYS A 62 279.071 250.911 241.148 1.00 0.00 C +ATOM 63 CA THR A 63 279.126 251.372 244.929 1.00 0.00 C +ATOM 64 CA GLY A 64 279.090 248.605 247.548 1.00 0.00 C +ATOM 65 CA ILE A 65 277.146 246.128 249.692 1.00 0.00 C +ATOM 66 CA SER A 66 276.095 242.502 250.209 1.00 0.00 C +ATOM 67 CA LYS A 67 274.731 242.276 253.760 1.00 0.00 C +TER 68 LYS A 67 +END diff --git a/Plants/Q8LDQ8/Q8LDQ8.dcd b/Plants/Q8LDQ8/Q8LDQ8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..a8f789aeaaacfb311aadcd5e76c7dee156127085 --- /dev/null +++ b/Plants/Q8LDQ8/Q8LDQ8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:a20940286be254bfa8343cbcc6056cc95af2f9ec55d208ebdf6b6b575492dc44 +size 9800276 diff --git a/Plants/Q8LDQ8/top.pdb b/Plants/Q8LDQ8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..76edf419242b9d4a45465fc8bb68118163428942 --- /dev/null +++ b/Plants/Q8LDQ8/top.pdb @@ -0,0 +1,79 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 256.871 238.588 216.062 1.00 0.00 C +ATOM 2 CA ARG A 2 258.819 241.785 216.772 1.00 0.00 C +ATOM 3 CA ARG A 3 261.781 243.692 218.224 1.00 0.00 C +ATOM 4 CA ILE A 4 264.020 246.552 217.075 1.00 0.00 C +ATOM 5 CA PRO A 5 266.654 248.769 218.707 1.00 0.00 C +ATOM 6 CA ARG A 6 269.713 246.593 219.357 1.00 0.00 C +ATOM 7 CA ILE A 7 272.487 248.498 221.144 1.00 0.00 C +ATOM 8 CA LYS A 8 275.571 249.235 219.031 1.00 0.00 C +ATOM 9 CA PHE A 9 277.787 249.715 215.969 1.00 0.00 C +ATOM 10 CA PRO A 10 279.727 246.497 215.340 1.00 0.00 C +ATOM 11 CA GLN A 11 277.332 243.590 214.764 1.00 0.00 C +ATOM 12 CA ARG A 12 276.905 239.835 215.254 1.00 0.00 C +ATOM 13 CA HIS A 13 273.435 238.456 216.013 1.00 0.00 C +ATOM 14 CA SER A 14 270.575 240.192 217.836 1.00 0.00 C +ATOM 15 CA ILE A 15 269.497 240.583 221.469 1.00 0.00 C +ATOM 16 CA SER A 16 267.025 237.928 222.634 1.00 0.00 C +ATOM 17 CA SER A 17 263.652 237.017 224.153 1.00 0.00 C +ATOM 18 CA GLY A 18 262.069 235.662 227.343 1.00 0.00 C +ATOM 19 CA SER A 19 262.325 237.170 230.832 1.00 0.00 C +ATOM 20 CA GLY A 20 264.097 237.799 234.146 1.00 0.00 C +ATOM 21 CA PRO A 21 264.000 241.544 234.839 1.00 0.00 C +ATOM 22 CA ALA A 22 263.720 244.739 232.783 1.00 0.00 C +ATOM 23 CA PRO A 23 266.544 245.457 230.329 1.00 0.00 C +ATOM 24 CA GLY A 24 267.666 247.916 227.644 1.00 0.00 C +ATOM 25 CA SER A 25 269.381 251.306 227.354 1.00 0.00 C +ATOM 26 CA VAL A 26 268.676 254.507 229.297 1.00 0.00 C +ATOM 27 CA SER A 27 268.179 258.282 229.429 1.00 0.00 C +ATOM 28 CA GLY A 28 269.337 259.607 232.808 1.00 0.00 C +ATOM 29 CA VAL A 29 270.012 258.564 236.410 1.00 0.00 C +ATOM 30 CA LYS A 30 271.702 255.181 236.871 1.00 0.00 C +ATOM 31 CA LYS A 31 272.337 252.226 239.190 1.00 0.00 C +ATOM 32 CA ASN A 32 271.080 249.820 241.864 1.00 0.00 C +ATOM 33 CA VAL A 33 272.417 246.254 241.967 1.00 0.00 C +ATOM 34 CA THR A 34 270.663 243.257 243.534 1.00 0.00 C +ATOM 35 CA ALA A 35 271.642 242.049 247.012 1.00 0.00 C +ATOM 36 CA SER A 36 269.884 241.871 250.388 1.00 0.00 C +ATOM 37 CA SER A 37 266.695 241.351 252.406 1.00 0.00 C +ATOM 38 CA ASP A 38 265.087 238.176 253.767 1.00 0.00 C +ATOM 39 CA VAL A 39 261.814 236.524 252.730 1.00 0.00 C +ATOM 40 CA PRO A 40 258.996 239.073 252.450 1.00 0.00 C +ATOM 41 CA ALA A 41 255.870 240.075 254.383 1.00 0.00 C +ATOM 42 CA ALA A 42 252.556 238.194 254.367 1.00 0.00 C +ATOM 43 CA PRO A 43 250.801 238.474 257.737 1.00 0.00 C +ATOM 44 CA LYS A 44 246.998 238.252 257.747 1.00 0.00 C +ATOM 45 CA ASN A 45 244.260 240.585 256.489 1.00 0.00 C +ATOM 46 CA THR A 46 241.443 242.271 258.422 1.00 0.00 C +ATOM 47 CA ALA A 47 240.780 246.013 258.161 1.00 0.00 C +ATOM 48 CA ASP A 48 239.229 248.994 259.959 1.00 0.00 C +ATOM 49 CA GLY A 49 238.345 252.649 260.566 1.00 0.00 C +ATOM 50 CA GLY A 50 235.657 252.879 263.257 1.00 0.00 C +ATOM 51 CA LYS A 51 234.824 255.314 266.066 1.00 0.00 C +ATOM 52 CA ALA A 52 234.046 257.794 268.852 1.00 0.00 C +ATOM 53 CA SER A 53 231.467 260.517 269.522 1.00 0.00 C +ATOM 54 CA LEU A 54 227.930 259.465 270.474 1.00 0.00 C +ATOM 55 CA GLN A 55 226.097 262.758 271.034 1.00 0.00 C +ATOM 56 CA PRO A 56 224.324 262.867 274.404 1.00 0.00 C +ATOM 57 CA LYS A 57 221.883 264.949 276.460 1.00 0.00 C +ATOM 58 CA ARG A 58 218.198 264.535 277.334 1.00 0.00 C +ATOM 59 CA THR A 59 216.909 261.655 279.470 1.00 0.00 C +ATOM 60 CA PRO A 60 213.247 260.773 278.901 1.00 0.00 C +ATOM 61 CA VAL A 61 213.150 256.977 279.219 1.00 0.00 C +ATOM 62 CA SER A 62 215.321 254.341 280.909 1.00 0.00 C +ATOM 63 CA ASP A 63 217.176 251.013 280.901 1.00 0.00 C +ATOM 64 CA LYS A 64 219.744 248.218 280.567 1.00 0.00 C +ATOM 65 CA GLU A 65 222.811 249.444 282.466 1.00 0.00 C +ATOM 66 CA ILE A 66 223.639 252.691 284.279 1.00 0.00 C +ATOM 67 CA GLU A 67 224.528 256.311 283.488 1.00 0.00 C +ATOM 68 CA SER A 68 227.472 257.069 285.784 1.00 0.00 C +ATOM 69 CA ILE A 69 227.958 260.848 285.808 1.00 0.00 C +ATOM 70 CA MET A 70 225.447 263.687 286.200 1.00 0.00 C +ATOM 71 CA LEU A 71 225.039 266.842 284.103 1.00 0.00 C +ATOM 72 CA GLY A 72 225.279 270.231 282.379 1.00 0.00 C +ATOM 73 CA GLY A 73 222.736 273.068 282.395 1.00 0.00 C +ATOM 74 CA CYS A 74 219.037 273.034 281.484 1.00 0.00 C +ATOM 75 CA ILE A 75 215.627 271.356 281.215 1.00 0.00 C +TER 76 ILE A 75 +END diff --git a/Plants/Q8LDW3/Q8LDW3.dcd b/Plants/Q8LDW3/Q8LDW3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..40d6e70c596528edd5300dbe5cad49d4518495d6 --- /dev/null +++ b/Plants/Q8LDW3/Q8LDW3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:ae01987290b5a6a6e4041e0c34af749c3bbab02e754765b4e800659a89b022ab +size 14480276 diff --git a/Plants/Q8LDW3/top.pdb b/Plants/Q8LDW3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..14cc737607c953c486c90fe55391c11194ca229f --- /dev/null +++ b/Plants/Q8LDW3/top.pdb @@ -0,0 +1,118 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 226.036 263.801 263.980 1.00 0.00 C +ATOM 2 CA SER A 2 228.133 266.372 262.107 1.00 0.00 C +ATOM 3 CA SER A 3 227.451 270.120 262.099 1.00 0.00 C +ATOM 4 CA SER A 4 224.799 270.937 259.488 1.00 0.00 C +ATOM 5 CA GLN A 5 224.783 273.188 256.414 1.00 0.00 C +ATOM 6 CA GLN A 6 224.847 272.409 252.685 1.00 0.00 C +ATOM 7 CA LEU A 7 226.322 274.660 249.988 1.00 0.00 C +ATOM 8 CA SER A 8 229.604 274.685 248.054 1.00 0.00 C +ATOM 9 CA HIS A 9 233.203 273.726 247.250 1.00 0.00 C +ATOM 10 CA SER A 10 234.921 272.865 243.961 1.00 0.00 C +ATOM 11 CA ALA A 11 235.513 269.354 242.604 1.00 0.00 C +ATOM 12 CA GLY A 12 238.680 267.288 242.139 1.00 0.00 C +ATOM 13 CA GLU A 13 238.476 263.581 242.995 1.00 0.00 C +ATOM 14 CA VAL A 14 241.306 261.706 244.725 1.00 0.00 C +ATOM 15 CA THR A 15 245.099 262.061 244.641 1.00 0.00 C +ATOM 16 CA GLY A 16 246.785 259.223 246.543 1.00 0.00 C +ATOM 17 CA GLN A 17 247.150 255.439 246.798 1.00 0.00 C +ATOM 18 CA VAL A 18 250.276 253.263 246.922 1.00 0.00 C +ATOM 19 CA GLN A 19 252.901 250.999 245.341 1.00 0.00 C +ATOM 20 CA LEU A 20 254.173 250.301 241.819 1.00 0.00 C +ATOM 21 CA LYS A 21 256.037 247.059 241.088 1.00 0.00 C +ATOM 22 CA LYS A 22 258.217 246.057 244.047 1.00 0.00 C +ATOM 23 CA GLU A 23 258.631 242.270 243.966 1.00 0.00 C +ATOM 24 CA GLU A 24 260.449 239.712 241.806 1.00 0.00 C +ATOM 25 CA TYR A 25 263.730 240.075 239.903 1.00 0.00 C +ATOM 26 CA LEU A 26 265.904 240.861 236.875 1.00 0.00 C +ATOM 27 CA ASN A 27 268.928 242.654 238.342 1.00 0.00 C +ATOM 28 CA ASN A 28 271.834 243.917 236.226 1.00 0.00 C +ATOM 29 CA VAL A 29 271.499 247.602 235.320 1.00 0.00 C +ATOM 30 CA SER A 30 271.199 248.390 231.605 1.00 0.00 C +ATOM 31 CA HIS A 31 268.188 250.113 230.029 1.00 0.00 C +ATOM 32 CA ALA A 32 266.354 252.779 228.018 1.00 0.00 C +ATOM 33 CA MET A 33 263.424 255.155 227.485 1.00 0.00 C +ATOM 34 CA ASN A 34 259.752 254.271 227.990 1.00 0.00 C +ATOM 35 CA GLN A 35 258.307 250.959 229.196 1.00 0.00 C +ATOM 36 CA ASN A 36 258.075 247.893 231.447 1.00 0.00 C +ATOM 37 CA ALA A 37 261.103 246.919 233.544 1.00 0.00 C +ATOM 38 CA ASP A 38 261.037 246.797 237.351 1.00 0.00 C +ATOM 39 CA HIS A 39 261.086 249.944 239.498 1.00 0.00 C +ATOM 40 CA HIS A 40 261.649 253.527 240.665 1.00 0.00 C +ATOM 41 CA THR A 41 263.002 257.088 240.772 1.00 0.00 C +ATOM 42 CA HIS A 42 260.737 259.554 238.954 1.00 0.00 C +ATOM 43 CA SER A 43 257.178 259.566 240.314 1.00 0.00 C +ATOM 44 CA GLN A 44 255.891 258.989 243.853 1.00 0.00 C +ATOM 45 CA SER A 45 255.037 260.134 247.385 1.00 0.00 C +ATOM 46 CA GLN A 46 255.370 262.172 250.588 1.00 0.00 C +ATOM 47 CA LEU A 47 258.796 263.637 251.381 1.00 0.00 C +ATOM 48 CA HIS A 48 259.113 266.938 253.256 1.00 0.00 C +ATOM 49 CA SER A 49 256.024 268.396 254.945 1.00 0.00 C +ATOM 50 CA GLU A 50 253.034 268.539 252.588 1.00 0.00 C +ATOM 51 CA HIS A 51 250.013 268.177 254.882 1.00 0.00 C +ATOM 52 CA ASP A 52 249.565 269.368 258.473 1.00 0.00 C +ATOM 53 CA GLN A 53 252.057 272.052 259.522 1.00 0.00 C +ATOM 54 CA ASN A 54 255.591 273.252 260.288 1.00 0.00 C +ATOM 55 CA ASN A 55 256.946 276.608 259.097 1.00 0.00 C +ATOM 56 CA PRO A 56 258.479 278.448 262.061 1.00 0.00 C +ATOM 57 CA SER A 57 256.671 281.758 262.599 1.00 0.00 C +ATOM 58 CA LEU A 58 254.588 281.270 265.752 1.00 0.00 C +ATOM 59 CA ILE A 59 254.467 277.766 267.243 1.00 0.00 C +ATOM 60 CA SER A 60 255.480 275.221 269.891 1.00 0.00 C +ATOM 61 CA GLN A 61 256.675 272.117 271.748 1.00 0.00 C +ATOM 62 CA ALA A 62 259.127 269.477 270.508 1.00 0.00 C +ATOM 63 CA SER A 63 259.941 265.813 269.855 1.00 0.00 C +ATOM 64 CA SER A 64 259.598 263.631 266.750 1.00 0.00 C +ATOM 65 CA VAL A 65 263.154 262.590 265.863 1.00 0.00 C +ATOM 66 CA ILE A 66 264.714 262.791 262.393 1.00 0.00 C +ATOM 67 CA GLN A 67 262.909 262.251 259.082 1.00 0.00 C +ATOM 68 CA GLN A 68 264.066 259.862 256.350 1.00 0.00 C +ATOM 69 CA THR A 69 266.339 257.207 254.833 1.00 0.00 C +ATOM 70 CA GLY A 70 268.033 254.017 256.047 1.00 0.00 C +ATOM 71 CA GLY A 71 268.941 250.961 253.962 1.00 0.00 C +ATOM 72 CA GLN A 72 269.726 248.509 251.153 1.00 0.00 C +ATOM 73 CA VAL A 73 268.278 245.002 251.496 1.00 0.00 C +ATOM 74 CA LYS A 74 266.633 242.653 254.005 1.00 0.00 C +ATOM 75 CA ASN A 75 265.240 244.691 256.907 1.00 0.00 C +ATOM 76 CA MET A 76 263.142 247.636 255.708 1.00 0.00 C +ATOM 77 CA ALA A 77 259.454 247.721 254.754 1.00 0.00 C +ATOM 78 CA GLN A 78 258.079 247.730 251.201 1.00 0.00 C +ATOM 79 CA GLY A 79 255.253 245.324 250.343 1.00 0.00 C +ATOM 80 CA ALA A 80 253.692 242.547 252.433 1.00 0.00 C +ATOM 81 CA ALA A 81 250.968 242.878 255.076 1.00 0.00 C +ATOM 82 CA ASP A 82 247.979 244.392 256.891 1.00 0.00 C +ATOM 83 CA ALA A 83 244.425 244.152 258.242 1.00 0.00 C +ATOM 84 CA VAL A 84 242.255 242.401 260.839 1.00 0.00 C +ATOM 85 CA LYS A 85 241.585 238.878 259.553 1.00 0.00 C +ATOM 86 CA ASN A 86 242.801 236.304 257.021 1.00 0.00 C +ATOM 87 CA THR A 87 244.267 233.613 254.757 1.00 0.00 C +ATOM 88 CA LEU A 88 243.938 232.700 251.072 1.00 0.00 C +ATOM 89 CA GLY A 89 247.026 231.725 249.065 1.00 0.00 C +ATOM 90 CA MET A 90 250.033 229.465 248.463 1.00 0.00 C +ATOM 91 CA SER A 91 250.119 226.210 246.485 1.00 0.00 C +ATOM 92 CA PRO A 92 250.067 222.400 246.451 1.00 0.00 C +ATOM 93 CA ALA A 93 248.088 219.243 247.245 1.00 0.00 C +ATOM 94 CA THR A 94 244.674 220.453 248.428 1.00 0.00 C +ATOM 95 CA ASN A 95 242.886 220.126 251.776 1.00 0.00 C +ATOM 96 CA SER A 96 241.659 222.962 254.005 1.00 0.00 C +ATOM 97 CA PRO A 97 242.878 226.553 254.378 1.00 0.00 C +ATOM 98 CA SER A 98 241.768 228.349 257.549 1.00 0.00 C +ATOM 99 CA SER A 99 239.571 230.693 259.598 1.00 0.00 C +ATOM 100 CA PRO A 100 237.375 233.805 259.507 1.00 0.00 C +ATOM 101 CA ALA A 101 233.905 232.620 258.473 1.00 0.00 C +ATOM 102 CA GLY A 102 230.439 231.294 257.610 1.00 0.00 C +ATOM 103 CA THR A 103 227.298 229.163 257.283 1.00 0.00 C +ATOM 104 CA THR A 104 226.745 228.296 253.614 1.00 0.00 C +ATOM 105 CA ARG A 105 229.835 227.482 251.539 1.00 0.00 C +ATOM 106 CA SER A 106 232.032 224.932 249.752 1.00 0.00 C +ATOM 107 CA ASN A 107 231.900 224.990 245.945 1.00 0.00 C +ATOM 108 CA LYS A 108 234.586 224.147 243.378 1.00 0.00 C +ATOM 109 CA PRO A 109 234.166 226.081 240.122 1.00 0.00 C +ATOM 110 CA GLY A 110 234.276 224.019 236.921 1.00 0.00 C +ATOM 111 CA SER A 111 232.553 220.638 236.580 1.00 0.00 C +ATOM 112 CA LYS A 112 230.986 219.971 239.988 1.00 0.00 C +ATOM 113 CA ASN A 113 229.151 218.688 243.071 1.00 0.00 C +ATOM 114 CA ILE A 114 230.873 215.984 245.132 1.00 0.00 C +TER 115 ILE A 114 +END diff --git a/Plants/Q8LEP6/Q8LEP6.dcd b/Plants/Q8LEP6/Q8LEP6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..c0018fa41483b186c9d6c203beba86ce6afb7b70 --- /dev/null +++ b/Plants/Q8LEP6/Q8LEP6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f5d3c5dd28a227a2331f45d71782ad00764ee4ba3175092edbd51a33c35c92d3 +size 16520276 diff --git a/Plants/Q8LEP6/top.pdb b/Plants/Q8LEP6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..1536647a9b594a20489c7c4b13a578e89880f24c --- /dev/null +++ b/Plants/Q8LEP6/top.pdb @@ -0,0 +1,135 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 260.585 283.158 270.801 1.00 0.00 C +ATOM 2 CA GLY A 2 259.842 286.861 270.298 1.00 0.00 C +ATOM 3 CA LYS A 3 259.068 289.499 272.935 1.00 0.00 C +ATOM 4 CA ARG A 4 258.340 290.947 276.384 1.00 0.00 C +ATOM 5 CA ARG A 5 261.053 291.661 278.962 1.00 0.00 C +ATOM 6 CA PHE A 6 264.313 289.901 278.074 1.00 0.00 C +ATOM 7 CA GLN A 7 267.961 290.773 278.746 1.00 0.00 C +ATOM 8 CA LYS A 8 271.715 290.384 278.229 1.00 0.00 C +ATOM 9 CA ALA A 9 274.666 291.381 276.034 1.00 0.00 C +ATOM 10 CA LYS A 10 277.475 293.941 275.767 1.00 0.00 C +ATOM 11 CA GLU A 11 276.749 297.141 273.831 1.00 0.00 C +ATOM 12 CA THR A 12 274.287 298.563 271.294 1.00 0.00 C +ATOM 13 CA SER A 13 270.976 300.244 270.443 1.00 0.00 C +ATOM 14 CA SER A 14 268.166 297.674 270.327 1.00 0.00 C +ATOM 15 CA VAL A 15 267.484 293.926 270.360 1.00 0.00 C +ATOM 16 CA ALA A 16 266.365 290.693 268.682 1.00 0.00 C +ATOM 17 CA GLU A 17 266.815 286.910 268.678 1.00 0.00 C +ATOM 18 CA ALA A 18 265.354 284.542 266.076 1.00 0.00 C +ATOM 19 CA SER A 19 263.766 282.070 263.650 1.00 0.00 C +ATOM 20 CA SER A 20 263.439 283.784 260.263 1.00 0.00 C +ATOM 21 CA PRO A 21 260.504 285.567 258.613 1.00 0.00 C +ATOM 22 CA THR A 22 257.503 283.285 259.162 1.00 0.00 C +ATOM 23 CA GLU A 23 256.978 280.596 261.810 1.00 0.00 C +ATOM 24 CA SER A 24 254.220 278.689 263.618 1.00 0.00 C +ATOM 25 CA GLN A 25 255.051 274.978 263.860 1.00 0.00 C +ATOM 26 CA ALA A 26 256.607 271.501 263.903 1.00 0.00 C +ATOM 27 CA THR A 27 254.525 268.718 262.340 1.00 0.00 C +ATOM 28 CA ARG A 28 255.176 265.030 261.641 1.00 0.00 C +ATOM 29 CA ARG A 29 257.776 262.606 260.270 1.00 0.00 C +ATOM 30 CA ARG A 30 259.179 260.277 262.940 1.00 0.00 C +ATOM 31 CA ARG A 31 262.721 259.159 262.095 1.00 0.00 C +ATOM 32 CA GLY A 32 264.111 259.572 258.571 1.00 0.00 C +ATOM 33 CA ARG A 33 266.872 259.393 255.952 1.00 0.00 C +ATOM 34 CA PRO A 34 267.236 258.108 252.384 1.00 0.00 C +ATOM 35 CA ARG A 35 266.750 260.990 249.940 1.00 0.00 C +ATOM 36 CA LYS A 36 264.737 264.224 249.960 1.00 0.00 C +ATOM 37 CA ASN A 37 264.036 266.484 252.947 1.00 0.00 C +ATOM 38 CA LEU A 38 261.397 264.685 255.024 1.00 0.00 C +ATOM 39 CA GLU A 39 258.383 262.943 253.477 1.00 0.00 C +ATOM 40 CA ASN A 40 257.849 259.171 253.534 1.00 0.00 C +ATOM 41 CA PRO A 41 255.338 256.735 252.026 1.00 0.00 C +ATOM 42 CA GLU A 42 255.716 252.944 252.079 1.00 0.00 C +ATOM 43 CA ASP A 43 258.577 251.812 254.327 1.00 0.00 C +ATOM 44 CA PHE A 44 259.805 252.545 257.859 1.00 0.00 C +ATOM 45 CA LYS A 45 262.326 253.324 260.606 1.00 0.00 C +ATOM 46 CA LYS A 46 260.420 252.784 263.861 1.00 0.00 C +ATOM 47 CA GLU A 47 261.571 250.477 266.666 1.00 0.00 C +ATOM 48 CA GLU A 48 259.146 249.874 269.542 1.00 0.00 C +ATOM 49 CA SER A 49 255.441 250.559 268.974 1.00 0.00 C +ATOM 50 CA GLU A 50 253.965 250.378 265.467 1.00 0.00 C +ATOM 51 CA GLU A 51 254.758 246.979 263.938 1.00 0.00 C +ATOM 52 CA ASP A 52 251.522 245.498 262.577 1.00 0.00 C +ATOM 53 CA GLU A 53 252.612 242.525 260.457 1.00 0.00 C +ATOM 54 CA ASP A 54 252.233 238.739 260.634 1.00 0.00 C +ATOM 55 CA TYR A 55 255.194 237.318 258.703 1.00 0.00 C +ATOM 56 CA GLU A 56 253.991 235.557 255.545 1.00 0.00 C +ATOM 57 CA GLU A 57 251.453 232.970 256.720 1.00 0.00 C +ATOM 58 CA TYR A 58 247.668 232.865 257.142 1.00 0.00 C +ATOM 59 CA GLU A 59 244.547 234.590 258.483 1.00 0.00 C +ATOM 60 CA ASP A 60 243.817 237.420 260.928 1.00 0.00 C +ATOM 61 CA GLU A 61 241.425 240.212 261.929 1.00 0.00 C +ATOM 62 CA GLU A 62 241.756 243.987 262.319 1.00 0.00 C +ATOM 63 CA GLU A 63 239.586 245.795 259.762 1.00 0.00 C +ATOM 64 CA GLU A 64 242.072 247.463 257.405 1.00 0.00 C +ATOM 65 CA ASP A 65 243.964 250.034 255.325 1.00 0.00 C +ATOM 66 CA GLU A 66 244.161 253.635 254.096 1.00 0.00 C +ATOM 67 CA GLU A 67 245.992 254.739 250.943 1.00 0.00 C +ATOM 68 CA ALA A 68 247.107 258.352 250.471 1.00 0.00 C +ATOM 69 CA GLU A 69 248.346 261.903 249.868 1.00 0.00 C +ATOM 70 CA VAL A 70 245.900 264.073 247.912 1.00 0.00 C +ATOM 71 CA VAL A 71 245.628 267.668 246.681 1.00 0.00 C +ATOM 72 CA ILE A 72 242.680 269.965 247.423 1.00 0.00 C +ATOM 73 CA ASN A 73 239.189 268.884 248.498 1.00 0.00 C +ATOM 74 CA ARG A 74 235.398 268.507 248.495 1.00 0.00 C +ATOM 75 CA GLU A 75 234.407 265.653 250.818 1.00 0.00 C +ATOM 76 CA LYS A 76 234.651 263.216 253.736 1.00 0.00 C +ATOM 77 CA LEU A 77 237.743 260.992 253.852 1.00 0.00 C +ATOM 78 CA LYS A 78 238.638 257.651 252.255 1.00 0.00 C +ATOM 79 CA LYS A 79 238.410 254.060 251.002 1.00 0.00 C +ATOM 80 CA LYS A 80 238.300 250.274 250.591 1.00 0.00 C +ATOM 81 CA VAL A 81 238.482 248.945 247.024 1.00 0.00 C +ATOM 82 CA ARG A 82 238.642 245.781 244.908 1.00 0.00 C +ATOM 83 CA SER A 83 237.862 242.519 243.101 1.00 0.00 C +ATOM 84 CA SER A 84 234.798 240.369 243.815 1.00 0.00 C +ATOM 85 CA SER A 85 234.925 236.580 243.437 1.00 0.00 C +ATOM 86 CA GLY A 86 236.091 232.963 243.712 1.00 0.00 C +ATOM 87 CA SER A 87 236.694 230.653 246.681 1.00 0.00 C +ATOM 88 CA MET A 88 235.546 230.522 250.312 1.00 0.00 C +ATOM 89 CA GLU A 89 237.099 232.650 253.065 1.00 0.00 C +ATOM 90 CA GLU A 90 236.909 236.453 252.941 1.00 0.00 C +ATOM 91 CA GLU A 91 235.419 238.301 249.960 1.00 0.00 C +ATOM 92 CA GLN A 92 231.743 239.302 249.952 1.00 0.00 C +ATOM 93 CA LYS A 93 228.931 236.732 249.992 1.00 0.00 C +ATOM 94 CA MET A 94 226.244 235.791 247.459 1.00 0.00 C +ATOM 95 CA LYS A 95 226.543 235.870 243.662 1.00 0.00 C +ATOM 96 CA HIS A 96 225.930 238.992 241.566 1.00 0.00 C +ATOM 97 CA GLU A 97 224.691 238.492 237.998 1.00 0.00 C +ATOM 98 CA GLU A 98 227.590 237.712 235.651 1.00 0.00 C +ATOM 99 CA LEU A 99 228.151 233.949 235.454 1.00 0.00 C +ATOM 100 CA GLU A 100 228.913 230.338 236.399 1.00 0.00 C +ATOM 101 CA GLU A 101 232.502 230.031 237.639 1.00 0.00 C +ATOM 102 CA GLU A 102 235.805 228.506 238.772 1.00 0.00 C +ATOM 103 CA GLU A 103 238.893 230.425 237.635 1.00 0.00 C +ATOM 104 CA LYS A 104 238.518 233.338 235.208 1.00 0.00 C +ATOM 105 CA PRO A 105 241.317 234.242 232.786 1.00 0.00 C +ATOM 106 CA GLU A 106 241.360 236.093 229.456 1.00 0.00 C +ATOM 107 CA MET A 107 239.376 234.972 226.403 1.00 0.00 C +ATOM 108 CA THR A 108 240.983 236.330 223.227 1.00 0.00 C +ATOM 109 CA VAL A 109 243.451 233.654 222.102 1.00 0.00 C +ATOM 110 CA LYS A 110 243.387 230.852 224.683 1.00 0.00 C +ATOM 111 CA VAL A 111 243.403 227.453 222.961 1.00 0.00 C +ATOM 112 CA VAL A 112 241.194 224.753 221.431 1.00 0.00 C +ATOM 113 CA VAL A 113 241.099 221.285 223.007 1.00 0.00 C +ATOM 114 CA PRO A 114 241.225 218.365 225.451 1.00 0.00 C +ATOM 115 CA PRO A 115 241.548 214.748 226.605 1.00 0.00 C +ATOM 116 CA PRO A 116 240.286 212.070 229.003 1.00 0.00 C +ATOM 117 CA SER A 117 242.877 209.850 230.698 1.00 0.00 C +ATOM 118 CA SER A 118 242.509 207.139 233.349 1.00 0.00 C +ATOM 119 CA ARG A 119 245.816 206.378 235.081 1.00 0.00 C +ATOM 120 CA ARG A 120 249.517 206.271 234.181 1.00 0.00 C +ATOM 121 CA SER A 121 252.063 205.138 231.583 1.00 0.00 C +ATOM 122 CA ARG A 122 253.884 206.818 228.689 1.00 0.00 C +ATOM 123 CA ARG A 123 255.892 208.954 226.256 1.00 0.00 C +ATOM 124 CA LYS A 124 257.665 209.235 222.895 1.00 0.00 C +ATOM 125 CA SER A 125 255.396 207.625 220.292 1.00 0.00 C +ATOM 126 CA THR A 126 256.823 208.009 216.780 1.00 0.00 C +ATOM 127 CA PRO A 127 254.729 210.462 214.752 1.00 0.00 C +ATOM 128 CA VAL A 128 253.590 213.337 212.526 1.00 0.00 C +ATOM 129 CA LYS A 129 256.124 214.099 209.784 1.00 0.00 C +ATOM 130 CA SER A 130 259.369 216.065 209.447 1.00 0.00 C +ATOM 131 CA TRP A 131 262.707 217.604 208.444 1.00 0.00 C +TER 132 TRP A 131 +END diff --git a/Plants/Q8LF43/Q8LF43.dcd b/Plants/Q8LF43/Q8LF43.dcd new file mode 100644 index 0000000000000000000000000000000000000000..149a83f9be7973e88c68295108a6dd79b953f978 --- /dev/null +++ b/Plants/Q8LF43/Q8LF43.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:3ca80a2e43f707a4eef7e35595cba0d176970ef1fe2e20fd3219029ab003ab9c +size 8000276 diff --git a/Plants/Q8LF43/top.pdb b/Plants/Q8LF43/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..ca2ce58f8865394242838d345fd8a35c101fd9f5 --- /dev/null +++ b/Plants/Q8LF43/top.pdb @@ -0,0 +1,64 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 276.440 241.611 260.792 1.00 0.00 C +ATOM 2 CA SER A 2 276.797 240.320 257.226 1.00 0.00 C +ATOM 3 CA SER A 3 273.620 238.805 255.765 1.00 0.00 C +ATOM 4 CA MET A 4 273.946 237.582 252.171 1.00 0.00 C +ATOM 5 CA GLY A 5 270.643 236.159 250.913 1.00 0.00 C +ATOM 6 CA ALA A 6 267.967 235.687 253.584 1.00 0.00 C +ATOM 7 CA ASN A 7 264.483 236.838 252.559 1.00 0.00 C +ATOM 8 CA TYR A 8 260.757 237.625 252.445 1.00 0.00 C +ATOM 9 CA ALA A 9 258.856 240.658 253.751 1.00 0.00 C +ATOM 10 CA GLN A 10 257.652 242.736 256.709 1.00 0.00 C +ATOM 11 CA LEU A 11 257.955 246.342 257.901 1.00 0.00 C +ATOM 12 CA GLN A 12 254.955 248.000 259.565 1.00 0.00 C +ATOM 13 CA VAL A 13 253.558 251.456 260.351 1.00 0.00 C +ATOM 14 CA MET A 14 250.080 252.359 261.616 1.00 0.00 C +ATOM 15 CA GLN A 15 246.332 252.687 261.014 1.00 0.00 C +ATOM 16 CA LYS A 16 245.396 256.380 260.922 1.00 0.00 C +ATOM 17 CA LYS A 17 244.157 259.664 259.440 1.00 0.00 C +ATOM 18 CA GLN A 18 245.078 262.579 261.713 1.00 0.00 C +ATOM 19 CA LYS A 19 243.848 264.659 264.659 1.00 0.00 C +ATOM 20 CA GLU A 20 245.574 268.054 264.560 1.00 0.00 C +ATOM 21 CA LYS A 21 249.322 267.369 264.495 1.00 0.00 C +ATOM 22 CA MET A 22 251.717 265.329 262.347 1.00 0.00 C +ATOM 23 CA MET A 23 251.854 263.277 259.139 1.00 0.00 C +ATOM 24 CA LYS A 24 255.493 262.639 258.208 1.00 0.00 C +ATOM 25 CA LYS A 25 255.483 260.425 255.107 1.00 0.00 C +ATOM 26 CA LYS A 26 255.691 257.864 252.294 1.00 0.00 C +ATOM 27 CA LEU A 27 252.874 255.415 253.056 1.00 0.00 C +ATOM 28 CA GLU A 28 251.686 251.878 253.825 1.00 0.00 C +ATOM 29 CA LYS A 29 250.431 248.281 253.726 1.00 0.00 C +ATOM 30 CA ARG A 30 250.980 244.556 253.145 1.00 0.00 C +ATOM 31 CA ARG A 31 247.740 243.202 251.666 1.00 0.00 C +ATOM 32 CA ASP A 32 244.931 240.828 252.659 1.00 0.00 C +ATOM 33 CA GLY A 33 244.274 238.678 255.735 1.00 0.00 C +ATOM 34 CA GLY A 34 244.165 235.487 257.813 1.00 0.00 C +ATOM 35 CA VAL A 35 240.851 234.033 259.006 1.00 0.00 C +ATOM 36 CA ASP A 36 239.241 230.806 257.777 1.00 0.00 C +ATOM 37 CA GLY A 37 237.638 229.050 254.800 1.00 0.00 C +ATOM 38 CA GLU A 38 236.347 231.006 251.796 1.00 0.00 C +ATOM 39 CA GLU A 39 236.122 234.653 250.717 1.00 0.00 C +ATOM 40 CA GLY A 40 238.335 237.753 250.793 1.00 0.00 C +ATOM 41 CA GLY A 41 238.554 241.007 248.823 1.00 0.00 C +ATOM 42 CA GLY A 42 235.583 243.056 247.603 1.00 0.00 C +ATOM 43 CA VAL A 43 232.922 245.781 247.708 1.00 0.00 C +ATOM 44 CA SER A 44 231.336 249.137 246.850 1.00 0.00 C +ATOM 45 CA SER A 45 233.271 252.398 246.478 1.00 0.00 C +ATOM 46 CA ALA A 46 236.139 254.466 247.896 1.00 0.00 C +ATOM 47 CA GLY A 47 238.794 255.020 245.220 1.00 0.00 C +ATOM 48 CA ASN A 48 242.162 256.476 244.193 1.00 0.00 C +ATOM 49 CA ARG A 49 242.932 260.202 244.005 1.00 0.00 C +ATOM 50 CA VAL A 50 244.162 261.067 240.504 1.00 0.00 C +ATOM 51 CA PHE A 51 245.673 258.344 238.309 1.00 0.00 C +ATOM 52 CA PRO A 52 246.427 259.131 234.658 1.00 0.00 C +ATOM 53 CA VAL A 53 248.467 259.159 231.440 1.00 0.00 C +ATOM 54 CA LYS A 54 247.161 258.305 227.965 1.00 0.00 C +ATOM 55 CA SER A 55 249.906 258.209 225.325 1.00 0.00 C +ATOM 56 CA SER A 56 251.568 261.327 223.898 1.00 0.00 C +ATOM 57 CA PRO A 57 254.305 263.758 224.954 1.00 0.00 C +ATOM 58 CA LEU A 58 257.896 262.550 225.352 1.00 0.00 C +ATOM 59 CA SER A 59 259.636 260.440 222.699 1.00 0.00 C +ATOM 60 CA THR A 60 259.838 257.440 220.360 1.00 0.00 C +TER 61 THR A 60 +END diff --git a/Plants/Q8LFA8/Q8LFA8.dcd b/Plants/Q8LFA8/Q8LFA8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..196ad9670c00e988908ca7919ea3770332e1c2a2 --- /dev/null +++ b/Plants/Q8LFA8/Q8LFA8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f30ae11b78cb5de1c85a66d9288ca388b54bbf5cf44a1f9d411ab44e47575c17 +size 17840276 diff --git a/Plants/Q8LFA8/top.pdb b/Plants/Q8LFA8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..0fa50a443395fd4b7f14cdb1990299fdc66bd3d9 --- /dev/null +++ b/Plants/Q8LFA8/top.pdb @@ -0,0 +1,146 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 209.907 279.286 270.416 1.00 0.00 C +ATOM 2 CA ARG A 2 211.118 280.750 273.718 1.00 0.00 C +ATOM 3 CA ARG A 3 210.079 284.415 273.637 1.00 0.00 C +ATOM 4 CA GLY A 4 209.178 287.701 275.341 1.00 0.00 C +ATOM 5 CA ARG A 5 210.799 287.698 278.789 1.00 0.00 C +ATOM 6 CA GLY A 6 212.216 284.766 280.767 1.00 0.00 C +ATOM 7 CA LYS A 7 213.841 284.229 284.171 1.00 0.00 C +ATOM 8 CA GLY A 8 217.532 284.655 285.016 1.00 0.00 C +ATOM 9 CA LYS A 9 219.542 282.474 282.624 1.00 0.00 C +ATOM 10 CA LYS A 10 218.135 278.966 282.152 1.00 0.00 C +ATOM 11 CA GLN A 11 217.967 278.102 278.445 1.00 0.00 C +ATOM 12 CA ASN A 12 217.926 274.706 276.718 1.00 0.00 C +ATOM 13 CA ALA A 13 216.435 274.467 273.220 1.00 0.00 C +ATOM 14 CA SER A 14 214.573 274.214 269.906 1.00 0.00 C +ATOM 15 CA ALA A 15 216.915 275.085 267.030 1.00 0.00 C +ATOM 16 CA ARG A 16 220.184 276.847 267.880 1.00 0.00 C +ATOM 17 CA GLU A 17 222.300 278.230 265.029 1.00 0.00 C +ATOM 18 CA ASP A 18 225.367 280.291 264.105 1.00 0.00 C +ATOM 19 CA ARG A 19 228.253 282.637 264.933 1.00 0.00 C +ATOM 20 CA GLY A 20 229.097 285.385 262.433 1.00 0.00 C +ATOM 21 CA SER A 21 226.644 288.183 263.249 1.00 0.00 C +ATOM 22 CA GLY A 22 226.975 290.760 266.035 1.00 0.00 C +ATOM 23 CA ASP A 23 228.453 288.884 269.004 1.00 0.00 C +ATOM 24 CA GLU A 24 227.963 288.246 272.728 1.00 0.00 C +ATOM 25 CA GLU A 25 227.468 284.499 273.207 1.00 0.00 C +ATOM 26 CA LYS A 26 229.193 282.071 275.584 1.00 0.00 C +ATOM 27 CA ILE A 27 229.611 280.335 278.949 1.00 0.00 C +ATOM 28 CA PRO A 28 230.826 281.123 282.473 1.00 0.00 C +ATOM 29 CA ALA A 29 233.894 283.284 283.131 1.00 0.00 C +ATOM 30 CA TYR A 30 236.733 281.089 284.411 1.00 0.00 C +ATOM 31 CA ARG A 31 237.039 277.303 284.106 1.00 0.00 C +ATOM 32 CA ARG A 32 239.316 275.921 281.382 1.00 0.00 C +ATOM 33 CA ARG A 33 242.062 278.427 280.544 1.00 0.00 C +ATOM 34 CA GLY A 34 243.340 279.593 277.150 1.00 0.00 C +ATOM 35 CA ARG A 35 242.753 278.053 273.715 1.00 0.00 C +ATOM 36 CA PRO A 36 241.837 276.263 270.479 1.00 0.00 C +ATOM 37 CA GLN A 37 239.014 275.683 267.988 1.00 0.00 C +ATOM 38 CA LYS A 38 237.142 272.455 267.218 1.00 0.00 C +ATOM 39 CA PRO A 39 237.789 269.494 264.909 1.00 0.00 C +ATOM 40 CA MET A 40 236.538 267.374 262.001 1.00 0.00 C +ATOM 41 CA LYS A 41 234.195 265.254 259.871 1.00 0.00 C +ATOM 42 CA ASP A 42 232.983 263.649 256.636 1.00 0.00 C +ATOM 43 CA ASP A 43 233.204 261.106 253.807 1.00 0.00 C +ATOM 44 CA PHE A 44 231.088 261.148 250.639 1.00 0.00 C +ATOM 45 CA GLU A 45 231.525 259.752 247.121 1.00 0.00 C +ATOM 46 CA GLU A 46 233.884 258.708 244.317 1.00 0.00 C +ATOM 47 CA GLU A 47 234.924 255.476 242.589 1.00 0.00 C +ATOM 48 CA GLU A 48 234.577 252.140 240.782 1.00 0.00 C +ATOM 49 CA GLU A 49 236.799 252.348 237.694 1.00 0.00 C +ATOM 50 CA GLU A 50 240.586 252.751 237.583 1.00 0.00 C +ATOM 51 CA ASP A 51 244.005 253.557 236.108 1.00 0.00 C +ATOM 52 CA ASP A 52 246.676 252.298 238.514 1.00 0.00 C +ATOM 53 CA GLU A 53 247.916 253.027 242.042 1.00 0.00 C +ATOM 54 CA GLU A 54 249.343 251.547 245.250 1.00 0.00 C +ATOM 55 CA MET A 55 248.117 251.864 248.844 1.00 0.00 C +ATOM 56 CA VAL A 56 247.923 248.871 251.193 1.00 0.00 C +ATOM 57 CA GLU A 57 248.413 245.829 253.434 1.00 0.00 C +ATOM 58 CA LYS A 58 250.100 242.723 254.856 1.00 0.00 C +ATOM 59 CA MET A 59 252.416 243.259 257.834 1.00 0.00 C +ATOM 60 CA GLU A 60 251.397 241.039 260.757 1.00 0.00 C +ATOM 61 CA VAL A 61 250.223 239.517 264.047 1.00 0.00 C +ATOM 62 CA GLU A 62 248.739 236.355 265.569 1.00 0.00 C +ATOM 63 CA ASP A 63 251.053 234.391 267.873 1.00 0.00 C +ATOM 64 CA GLU A 64 252.586 233.979 271.337 1.00 0.00 C +ATOM 65 CA ASP A 65 254.751 236.539 273.145 1.00 0.00 C +ATOM 66 CA GLU A 66 257.709 235.499 275.311 1.00 0.00 C +ATOM 67 CA GLU A 67 261.177 233.975 274.911 1.00 0.00 C +ATOM 68 CA ILE A 68 261.219 230.860 277.103 1.00 0.00 C +ATOM 69 CA ASP A 69 263.700 230.739 279.992 1.00 0.00 C +ATOM 70 CA ASP A 70 266.010 227.779 279.344 1.00 0.00 C +ATOM 71 CA GLY A 71 266.173 224.561 277.311 1.00 0.00 C +ATOM 72 CA SER A 72 267.920 223.207 274.208 1.00 0.00 C +ATOM 73 CA VAL A 73 266.210 224.317 270.989 1.00 0.00 C +ATOM 74 CA THR A 74 265.313 225.233 267.402 1.00 0.00 C +ATOM 75 CA SER A 75 262.825 228.106 267.133 1.00 0.00 C +ATOM 76 CA LYS A 76 262.029 230.526 269.966 1.00 0.00 C +ATOM 77 CA ASP A 77 263.170 234.055 269.096 1.00 0.00 C +ATOM 78 CA LEU A 78 262.158 234.652 265.472 1.00 0.00 C +ATOM 79 CA LYS A 79 264.582 236.965 263.658 1.00 0.00 C +ATOM 80 CA LYS A 80 265.624 240.525 264.525 1.00 0.00 C +ATOM 81 CA GLU A 81 269.093 241.905 265.289 1.00 0.00 C +ATOM 82 CA ARG A 82 270.940 244.669 263.428 1.00 0.00 C +ATOM 83 CA LYS A 83 271.741 246.479 260.172 1.00 0.00 C +ATOM 84 CA ARG A 84 271.192 245.211 256.622 1.00 0.00 C +ATOM 85 CA LYS A 85 268.315 242.732 256.321 1.00 0.00 C +ATOM 86 CA MET A 86 265.515 241.089 254.327 1.00 0.00 C +ATOM 87 CA SER A 87 265.161 238.370 251.681 1.00 0.00 C +ATOM 88 CA ASN A 88 261.689 237.035 250.858 1.00 0.00 C +ATOM 89 CA GLY A 89 259.701 233.921 249.928 1.00 0.00 C +ATOM 90 CA SER A 90 257.689 232.548 246.998 1.00 0.00 C +ATOM 91 CA ASN A 91 256.616 233.786 243.558 1.00 0.00 C +ATOM 92 CA THR A 92 253.623 233.275 241.258 1.00 0.00 C +ATOM 93 CA ASP A 93 250.339 231.884 239.916 1.00 0.00 C +ATOM 94 CA LEU A 94 249.545 228.327 238.808 1.00 0.00 C +ATOM 95 CA THR A 95 252.533 226.225 237.727 1.00 0.00 C +ATOM 96 CA GLU A 96 254.822 227.018 234.787 1.00 0.00 C +ATOM 97 CA GLU A 97 258.213 228.331 235.925 1.00 0.00 C +ATOM 98 CA GLU A 98 261.805 227.078 236.125 1.00 0.00 C +ATOM 99 CA ASN A 99 265.088 225.840 234.639 1.00 0.00 C +ATOM 100 CA GLY A 100 264.680 223.842 231.421 1.00 0.00 C +ATOM 101 CA LEU A 101 264.525 225.542 228.014 1.00 0.00 C +ATOM 102 CA GLY A 102 267.242 224.143 225.739 1.00 0.00 C +ATOM 103 CA SER A 103 269.544 227.075 224.955 1.00 0.00 C +ATOM 104 CA LYS A 104 271.214 228.482 228.077 1.00 0.00 C +ATOM 105 CA PRO A 105 270.782 232.254 227.757 1.00 0.00 C +ATOM 106 CA ASN A 106 270.911 233.812 224.283 1.00 0.00 C +ATOM 107 CA THR A 107 267.638 235.738 223.964 1.00 0.00 C +ATOM 108 CA ASP A 108 267.054 237.962 227.001 1.00 0.00 C +ATOM 109 CA ASP A 109 263.935 239.879 228.056 1.00 0.00 C +ATOM 110 CA SER A 110 260.287 239.982 229.150 1.00 0.00 C +ATOM 111 CA THR A 111 259.349 237.698 232.051 1.00 0.00 C +ATOM 112 CA ARG A 112 256.448 235.837 233.676 1.00 0.00 C +ATOM 113 CA SER A 113 254.950 233.170 231.405 1.00 0.00 C +ATOM 114 CA THR A 114 252.149 234.125 229.005 1.00 0.00 C +ATOM 115 CA SER A 115 248.937 235.712 227.710 1.00 0.00 C +ATOM 116 CA ILE A 116 249.938 239.124 226.342 1.00 0.00 C +ATOM 117 CA GLY A 117 251.807 241.807 224.386 1.00 0.00 C +ATOM 118 CA PHE A 118 253.251 240.879 220.984 1.00 0.00 C +ATOM 119 CA ARG A 119 253.579 244.220 219.182 1.00 0.00 C +ATOM 120 CA GLN A 120 255.524 247.128 217.674 1.00 0.00 C +ATOM 121 CA ASN A 121 257.921 245.923 214.969 1.00 0.00 C +ATOM 122 CA GLY A 122 261.720 245.945 214.672 1.00 0.00 C +ATOM 123 CA SER A 123 264.489 243.528 215.676 1.00 0.00 C +ATOM 124 CA ARG A 124 268.051 242.570 214.724 1.00 0.00 C +ATOM 125 CA ARG A 125 269.155 239.988 217.300 1.00 0.00 C +ATOM 126 CA LYS A 126 268.945 241.500 220.791 1.00 0.00 C +ATOM 127 CA SER A 127 271.481 241.711 223.625 1.00 0.00 C +ATOM 128 CA LYS A 128 275.157 242.307 222.817 1.00 0.00 C +ATOM 129 CA PRO A 129 275.699 243.205 219.155 1.00 0.00 C +ATOM 130 CA ARG A 130 275.322 240.771 216.248 1.00 0.00 C +ATOM 131 CA ARG A 131 276.278 237.134 216.864 1.00 0.00 C +ATOM 132 CA ALA A 132 278.959 236.432 214.249 1.00 0.00 C +ATOM 133 CA ALA A 133 282.331 234.661 214.159 1.00 0.00 C +ATOM 134 CA GLU A 134 282.978 232.558 211.049 1.00 0.00 C +ATOM 135 CA ALA A 135 282.584 228.826 211.707 1.00 0.00 C +ATOM 136 CA VAL A 136 280.668 225.863 210.269 1.00 0.00 C +ATOM 137 CA VAL A 137 276.910 225.372 209.883 1.00 0.00 C +ATOM 138 CA GLU A 138 273.627 226.032 208.066 1.00 0.00 C +ATOM 139 CA CYS A 139 269.946 226.134 207.087 1.00 0.00 C +ATOM 140 CA ASN A 140 266.341 225.515 206.022 1.00 0.00 C +ATOM 141 CA GLY A 141 264.247 223.826 208.719 1.00 0.00 C +ATOM 142 CA VAL A 142 260.627 223.994 209.898 1.00 0.00 C +TER 143 VAL A 142 +END diff --git a/Plants/Q8LGD1/Q8LGD1.dcd b/Plants/Q8LGD1/Q8LGD1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..ccb17da92de1832062b88d665c8dd7b96ddef82f --- /dev/null +++ b/Plants/Q8LGD1/Q8LGD1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:301b65eadc9606897f71b1e3ddb15f2fbf7bc5e52fc3adc83fec760e50d0a518 +size 12680276 diff --git a/Plants/Q8LGD1/top.pdb b/Plants/Q8LGD1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..49a70efaff7a6d9075696bbf9eb716237d0b5dee --- /dev/null +++ b/Plants/Q8LGD1/top.pdb @@ -0,0 +1,103 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 244.890 289.586 252.967 1.00 0.00 C +ATOM 2 CA SER A 2 246.980 292.727 253.495 1.00 0.00 C +ATOM 3 CA ARG A 3 248.624 293.777 256.768 1.00 0.00 C +ATOM 4 CA GLY A 4 247.127 293.210 260.225 1.00 0.00 C +ATOM 5 CA GLY A 5 249.313 292.083 263.134 1.00 0.00 C +ATOM 6 CA SER A 6 251.689 289.729 264.960 1.00 0.00 C +ATOM 7 CA PHE A 7 253.714 286.729 263.772 1.00 0.00 C +ATOM 8 CA GLY A 8 254.976 283.886 261.572 1.00 0.00 C +ATOM 9 CA GLY A 9 252.405 283.087 258.876 1.00 0.00 C +ATOM 10 CA GLY A 10 248.653 282.478 259.149 1.00 0.00 C +ATOM 11 CA GLN A 11 244.939 282.024 258.430 1.00 0.00 C +ATOM 12 CA SER A 12 244.492 278.276 257.913 1.00 0.00 C +ATOM 13 CA SER A 13 242.112 275.763 256.320 1.00 0.00 C +ATOM 14 CA LEU A 14 239.450 273.382 257.649 1.00 0.00 C +ATOM 15 CA GLY A 15 235.690 273.895 257.988 1.00 0.00 C +ATOM 16 CA TYR A 16 233.981 272.662 261.162 1.00 0.00 C +ATOM 17 CA LEU A 17 232.462 269.233 260.491 1.00 0.00 C +ATOM 18 CA PHE A 18 231.598 268.573 256.840 1.00 0.00 C +ATOM 19 CA GLY A 19 229.201 270.214 254.374 1.00 0.00 C +ATOM 20 CA SER A 20 228.333 267.957 251.430 1.00 0.00 C +ATOM 21 CA ASP A 21 227.469 267.904 247.719 1.00 0.00 C +ATOM 22 CA ASN A 22 224.457 266.360 245.970 1.00 0.00 C +ATOM 23 CA GLU A 23 224.147 267.737 242.431 1.00 0.00 C +ATOM 24 CA ILE A 24 224.163 270.692 240.026 1.00 0.00 C +ATOM 25 CA PRO A 25 225.356 272.878 237.142 1.00 0.00 C +ATOM 26 CA LYS A 26 227.809 272.254 234.295 1.00 0.00 C +ATOM 27 CA THR A 27 227.936 274.398 231.148 1.00 0.00 C +ATOM 28 CA PRO A 28 231.080 275.112 229.119 1.00 0.00 C +ATOM 29 CA ALA A 29 234.609 275.937 227.942 1.00 0.00 C +ATOM 30 CA PRO A 30 237.471 277.796 229.634 1.00 0.00 C +ATOM 31 CA PRO A 31 239.060 280.656 231.588 1.00 0.00 C +ATOM 32 CA VAL A 32 242.819 281.224 231.838 1.00 0.00 C +ATOM 33 CA ALA A 33 246.628 281.195 231.878 1.00 0.00 C +ATOM 34 CA PRO A 34 247.546 281.628 235.551 1.00 0.00 C +ATOM 35 CA LYS A 35 249.571 279.041 237.479 1.00 0.00 C +ATOM 36 CA PRO A 36 249.783 278.045 241.151 1.00 0.00 C +ATOM 37 CA ALA A 37 251.594 275.246 242.995 1.00 0.00 C +ATOM 38 CA PRO A 38 254.574 273.312 241.616 1.00 0.00 C +ATOM 39 CA PRO A 39 254.350 269.511 241.768 1.00 0.00 C +ATOM 40 CA TYR A 40 252.621 267.182 239.299 1.00 0.00 C +ATOM 41 CA GLY A 41 255.164 264.527 238.299 1.00 0.00 C +ATOM 42 CA VAL A 42 258.932 264.224 237.818 1.00 0.00 C +ATOM 43 CA ASP A 43 260.325 261.611 235.421 1.00 0.00 C +ATOM 44 CA SER A 44 259.545 261.956 231.708 1.00 0.00 C +ATOM 45 CA THR A 45 259.517 262.773 227.987 1.00 0.00 C +ATOM 46 CA GLU A 46 260.052 263.008 224.222 1.00 0.00 C +ATOM 47 CA GLU A 47 260.491 259.545 222.694 1.00 0.00 C +ATOM 48 CA ASP A 48 262.190 257.401 225.345 1.00 0.00 C +ATOM 49 CA HIS A 49 260.282 256.837 228.594 1.00 0.00 C +ATOM 50 CA GLU A 50 258.186 253.816 229.595 1.00 0.00 C +ATOM 51 CA ALA A 51 255.566 255.236 231.971 1.00 0.00 C +ATOM 52 CA ASP A 52 252.817 257.461 230.555 1.00 0.00 C +ATOM 53 CA GLN A 53 249.080 256.900 231.047 1.00 0.00 C +ATOM 54 CA LYS A 54 246.326 255.348 233.173 1.00 0.00 C +ATOM 55 CA PRO A 55 243.490 254.753 235.647 1.00 0.00 C +ATOM 56 CA LYS A 56 240.259 253.006 234.636 1.00 0.00 C +ATOM 57 CA ILE A 57 239.969 249.230 235.048 1.00 0.00 C +ATOM 58 CA SER A 58 241.538 245.789 234.581 1.00 0.00 C +ATOM 59 CA ASN A 59 242.311 244.646 238.133 1.00 0.00 C +ATOM 60 CA ASN A 60 245.886 243.336 238.264 1.00 0.00 C +ATOM 61 CA ASN A 61 248.010 240.194 238.628 1.00 0.00 C +ATOM 62 CA TYR A 62 247.801 237.025 240.733 1.00 0.00 C +ATOM 63 CA GLN A 63 248.981 234.511 243.342 1.00 0.00 C +ATOM 64 CA ARG A 64 252.261 232.579 243.495 1.00 0.00 C +ATOM 65 CA VAL A 65 251.661 229.235 245.219 1.00 0.00 C +ATOM 66 CA GLN A 66 252.306 227.306 248.441 1.00 0.00 C +ATOM 67 CA GLY A 67 250.254 224.102 248.636 1.00 0.00 C +ATOM 68 CA GLN A 68 249.800 223.199 252.309 1.00 0.00 C +ATOM 69 CA ASN A 69 246.894 224.696 254.267 1.00 0.00 C +ATOM 70 CA SER A 70 243.457 223.484 253.155 1.00 0.00 C +ATOM 71 CA GLY A 71 244.004 220.218 251.271 1.00 0.00 C +ATOM 72 CA ASN A 72 243.894 216.625 250.007 1.00 0.00 C +ATOM 73 CA PHE A 73 242.803 213.371 248.354 1.00 0.00 C +ATOM 74 CA VAL A 74 244.851 210.346 249.438 1.00 0.00 C +ATOM 75 CA THR A 75 248.164 211.162 251.132 1.00 0.00 C +ATOM 76 CA ASP A 76 250.477 209.474 253.646 1.00 0.00 C +ATOM 77 CA ARG A 77 252.850 209.652 256.621 1.00 0.00 C +ATOM 78 CA PRO A 78 254.531 206.253 256.994 1.00 0.00 C +ATOM 79 CA THR A 79 255.226 203.643 259.682 1.00 0.00 C +ATOM 80 CA THR A 80 257.515 203.024 262.664 1.00 0.00 C +ATOM 81 CA LYS A 81 259.699 203.775 265.694 1.00 0.00 C +ATOM 82 CA VAL A 82 257.659 205.043 268.651 1.00 0.00 C +ATOM 83 CA LYS A 83 257.553 208.795 269.307 1.00 0.00 C +ATOM 84 CA SER A 84 260.796 210.789 269.146 1.00 0.00 C +ATOM 85 CA VAL A 85 264.440 211.861 268.855 1.00 0.00 C +ATOM 86 CA PRO A 86 267.829 210.718 270.169 1.00 0.00 C +ATOM 87 CA GLY A 87 270.891 209.503 272.084 1.00 0.00 C +ATOM 88 CA GLY A 88 274.324 211.149 272.214 1.00 0.00 C +ATOM 89 CA GLY A 89 275.174 214.837 272.653 1.00 0.00 C +ATOM 90 CA SER A 90 273.838 216.513 269.503 1.00 0.00 C +ATOM 91 CA SER A 91 270.131 216.202 268.677 1.00 0.00 C +ATOM 92 CA LEU A 92 267.464 217.020 271.272 1.00 0.00 C +ATOM 93 CA GLY A 93 267.226 218.614 274.724 1.00 0.00 C +ATOM 94 CA TYR A 94 265.904 222.168 275.100 1.00 0.00 C +ATOM 95 CA LEU A 95 265.438 225.744 276.329 1.00 0.00 C +ATOM 96 CA PHE A 96 268.898 227.264 276.809 1.00 0.00 C +ATOM 97 CA GLY A 97 268.652 229.175 280.096 1.00 0.00 C +ATOM 98 CA ASP A 98 270.718 229.298 283.295 1.00 0.00 C +ATOM 99 CA LYS A 99 272.029 232.648 284.551 1.00 0.00 C +TER 100 LYS A 99 +END diff --git a/Plants/Q8LGV9/Q8LGV9.dcd b/Plants/Q8LGV9/Q8LGV9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..bd6b3671aea318c64e5369d5bdd95a55bc479a84 --- /dev/null +++ b/Plants/Q8LGV9/Q8LGV9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:787cbe4311fa86e601f2c2cc73d4907e2c989b13e39c7ba2156f48d34a62b1e3 +size 18320276 diff --git a/Plants/Q8LGV9/top.pdb b/Plants/Q8LGV9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..c2dc00c9ec7a380b545651e2d3b8e02e67fef573 --- /dev/null +++ b/Plants/Q8LGV9/top.pdb @@ -0,0 +1,150 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 267.831 292.527 248.307 1.00 0.00 C +ATOM 2 CA PRO A 2 264.771 290.316 248.818 1.00 0.00 C +ATOM 3 CA ALA A 3 264.098 288.031 245.844 1.00 0.00 C +ATOM 4 CA GLN A 4 260.844 287.636 243.903 1.00 0.00 C +ATOM 5 CA SER A 5 261.955 287.450 240.264 1.00 0.00 C +ATOM 6 CA ALA A 6 260.059 284.821 238.262 1.00 0.00 C +ATOM 7 CA GLY A 7 257.303 284.996 235.637 1.00 0.00 C +ATOM 8 CA GLY A 8 254.840 287.880 235.279 1.00 0.00 C +ATOM 9 CA GLY A 9 256.358 291.373 235.393 1.00 0.00 C +ATOM 10 CA ALA A 10 256.845 293.580 238.460 1.00 0.00 C +ATOM 11 CA PRO A 11 256.771 293.763 242.265 1.00 0.00 C +ATOM 12 CA ALA A 12 253.604 293.268 244.324 1.00 0.00 C +ATOM 13 CA PRO A 13 253.681 290.602 247.045 1.00 0.00 C +ATOM 14 CA ARG A 14 256.341 288.618 248.917 1.00 0.00 C +ATOM 15 CA TRP A 15 258.699 286.477 251.007 1.00 0.00 C +ATOM 16 CA SER A 16 260.331 283.053 251.365 1.00 0.00 C +ATOM 17 CA PRO A 17 257.909 280.829 253.291 1.00 0.00 C +ATOM 18 CA PRO A 18 254.718 278.749 253.227 1.00 0.00 C +ATOM 19 CA THR A 19 253.702 275.437 254.813 1.00 0.00 C +ATOM 20 CA THR A 20 252.973 272.590 252.389 1.00 0.00 C +ATOM 21 CA THR A 21 251.817 271.324 248.986 1.00 0.00 C +ATOM 22 CA GLY A 22 248.407 269.734 249.587 1.00 0.00 C +ATOM 23 CA ALA A 23 246.171 268.667 246.692 1.00 0.00 C +ATOM 24 CA ALA A 24 247.666 265.435 245.336 1.00 0.00 C +ATOM 25 CA GLU A 25 249.475 263.677 242.481 1.00 0.00 C +ATOM 26 CA ARG A 26 253.075 264.852 242.061 1.00 0.00 C +ATOM 27 CA ARG A 27 254.048 267.761 244.321 1.00 0.00 C +ATOM 28 CA PRO A 28 257.501 267.284 245.860 1.00 0.00 C +ATOM 29 CA ARG A 29 257.359 268.266 249.539 1.00 0.00 C +ATOM 30 CA GLU A 30 259.568 270.378 251.814 1.00 0.00 C +ATOM 31 CA GLY A 31 262.864 271.175 253.551 1.00 0.00 C +ATOM 32 CA GLY A 32 266.400 269.954 252.827 1.00 0.00 C +ATOM 33 CA LYS A 33 270.089 270.809 252.408 1.00 0.00 C +ATOM 34 CA GLY A 34 273.314 272.675 253.201 1.00 0.00 C +ATOM 35 CA GLU A 35 273.894 273.549 256.864 1.00 0.00 C +ATOM 36 CA ARG A 36 276.444 271.498 258.814 1.00 0.00 C +ATOM 37 CA ARG A 37 276.467 267.830 257.786 1.00 0.00 C +ATOM 38 CA ARG A 38 276.856 265.985 254.475 1.00 0.00 C +ATOM 39 CA ARG A 39 279.306 263.864 252.472 1.00 0.00 C +ATOM 40 CA SER A 40 279.976 260.795 250.315 1.00 0.00 C +ATOM 41 CA THR A 41 278.370 257.441 249.487 1.00 0.00 C +ATOM 42 CA ALA A 42 279.439 255.223 246.579 1.00 0.00 C +ATOM 43 CA HIS A 43 276.690 252.643 246.028 1.00 0.00 C +ATOM 44 CA PRO A 44 273.469 252.313 244.020 1.00 0.00 C +ATOM 45 CA GLY A 45 271.691 252.284 240.650 1.00 0.00 C +ATOM 46 CA ALA A 46 269.640 249.095 240.281 1.00 0.00 C +ATOM 47 CA THR A 47 266.611 248.410 242.488 1.00 0.00 C +ATOM 48 CA ALA A 48 263.953 245.883 241.453 1.00 0.00 C +ATOM 49 CA ALA A 49 260.638 246.127 243.315 1.00 0.00 C +ATOM 50 CA THR A 50 257.288 247.916 243.011 1.00 0.00 C +ATOM 51 CA GLU A 51 254.638 246.857 240.487 1.00 0.00 C +ATOM 52 CA GLU A 52 251.918 248.692 238.550 1.00 0.00 C +ATOM 53 CA ALA A 53 248.303 249.743 239.131 1.00 0.00 C +ATOM 54 CA ALA A 54 248.103 252.872 241.296 1.00 0.00 C +ATOM 55 CA GLY A 55 246.074 255.487 243.183 1.00 0.00 C +ATOM 56 CA ALA A 56 245.441 254.412 246.783 1.00 0.00 C +ATOM 57 CA GLU A 57 246.397 251.122 248.449 1.00 0.00 C +ATOM 58 CA GLU A 58 245.969 247.459 249.405 1.00 0.00 C +ATOM 59 CA ALA A 59 246.091 246.399 253.063 1.00 0.00 C +ATOM 60 CA VAL A 60 244.462 245.090 256.249 1.00 0.00 C +ATOM 61 CA ALA A 61 244.595 241.906 258.336 1.00 0.00 C +ATOM 62 CA ARG A 62 245.850 241.069 261.834 1.00 0.00 C +ATOM 63 CA LEU A 63 245.461 243.056 265.062 1.00 0.00 C +ATOM 64 CA GLY A 64 246.370 246.579 266.191 1.00 0.00 C +ATOM 65 CA SER A 65 249.039 248.271 264.061 1.00 0.00 C +ATOM 66 CA THR A 66 251.582 250.922 263.054 1.00 0.00 C +ATOM 67 CA GLY A 67 251.259 254.169 265.020 1.00 0.00 C +ATOM 68 CA THR A 68 252.617 255.048 268.470 1.00 0.00 C +ATOM 69 CA ALA A 69 256.162 256.314 267.885 1.00 0.00 C +ATOM 70 CA ALA A 70 258.949 255.699 270.410 1.00 0.00 C +ATOM 71 CA LEU A 71 258.544 254.271 273.919 1.00 0.00 C +ATOM 72 CA ARG A 72 259.168 251.173 276.045 1.00 0.00 C +ATOM 73 CA ARG A 73 258.024 247.678 275.048 1.00 0.00 C +ATOM 74 CA SER A 74 255.857 247.834 271.919 1.00 0.00 C +ATOM 75 CA ALA A 75 254.952 245.459 269.080 1.00 0.00 C +ATOM 76 CA THR A 76 256.837 243.080 266.777 1.00 0.00 C +ATOM 77 CA GLU A 77 259.612 240.982 268.330 1.00 0.00 C +ATOM 78 CA THR A 78 262.201 238.950 266.409 1.00 0.00 C +ATOM 79 CA GLU A 79 264.299 236.003 265.213 1.00 0.00 C +ATOM 80 CA ARG A 80 263.017 233.404 262.740 1.00 0.00 C +ATOM 81 CA TRP A 81 261.700 234.811 259.454 1.00 0.00 C +ATOM 82 CA THR A 82 263.380 233.208 256.433 1.00 0.00 C +ATOM 83 CA ARG A 83 261.988 229.707 255.862 1.00 0.00 C +ATOM 84 CA SER A 84 259.333 227.750 253.956 1.00 0.00 C +ATOM 85 CA ALA A 85 256.943 226.875 251.121 1.00 0.00 C +ATOM 86 CA ARG A 86 253.996 227.265 248.738 1.00 0.00 C +ATOM 87 CA MET A 87 254.513 225.213 245.569 1.00 0.00 C +ATOM 88 CA ARG A 88 256.696 222.355 244.310 1.00 0.00 C +ATOM 89 CA ARG A 89 259.854 221.132 242.566 1.00 0.00 C +ATOM 90 CA SER A 90 260.739 222.343 239.063 1.00 0.00 C +ATOM 91 CA ARG A 91 258.582 222.010 235.941 1.00 0.00 C +ATOM 92 CA ARG A 92 257.099 218.501 235.889 1.00 0.00 C +ATOM 93 CA ARG A 93 255.729 215.368 237.570 1.00 0.00 C +ATOM 94 CA ARG A 94 254.282 214.629 241.017 1.00 0.00 C +ATOM 95 CA ARG A 95 256.145 215.948 244.067 1.00 0.00 C +ATOM 96 CA ARG A 96 256.263 216.044 247.874 1.00 0.00 C +ATOM 97 CA GLY A 97 254.965 214.881 251.262 1.00 0.00 C +ATOM 98 CA GLY A 98 254.272 215.858 254.879 1.00 0.00 C +ATOM 99 CA ARG A 99 251.360 217.822 256.355 1.00 0.00 C +ATOM 100 CA ARG A 100 248.722 220.116 254.840 1.00 0.00 C +ATOM 101 CA SER A 101 249.724 221.832 251.589 1.00 0.00 C +ATOM 102 CA GLY A 102 247.047 223.394 249.374 1.00 0.00 C +ATOM 103 CA ALA A 103 243.492 224.281 248.330 1.00 0.00 C +ATOM 104 CA THR A 104 242.135 225.419 244.956 1.00 0.00 C +ATOM 105 CA THR A 105 239.010 223.345 244.289 1.00 0.00 C +ATOM 106 CA VAL A 106 235.887 225.029 242.902 1.00 0.00 C +ATOM 107 CA ALA A 107 232.947 227.372 242.279 1.00 0.00 C +ATOM 108 CA ASP A 108 232.733 229.768 245.234 1.00 0.00 C +ATOM 109 CA ARG A 109 234.701 232.839 244.133 1.00 0.00 C +ATOM 110 CA SER A 110 236.859 235.955 243.748 1.00 0.00 C +ATOM 111 CA SER A 111 236.982 238.250 240.709 1.00 0.00 C +ATOM 112 CA ALA A 112 235.152 239.664 237.681 1.00 0.00 C +ATOM 113 CA ALA A 113 234.304 243.342 237.158 1.00 0.00 C +ATOM 114 CA THR A 114 236.073 246.438 238.500 1.00 0.00 C +ATOM 115 CA VAL A 115 239.352 248.016 239.630 1.00 0.00 C +ATOM 116 CA GLU A 116 240.474 251.053 241.639 1.00 0.00 C +ATOM 117 CA ARG A 117 240.080 254.803 241.093 1.00 0.00 C +ATOM 118 CA GLU A 118 240.666 256.234 237.611 1.00 0.00 C +ATOM 119 CA SER A 119 239.088 256.738 234.179 1.00 0.00 C +ATOM 120 CA ASP A 120 236.113 254.780 232.827 1.00 0.00 C +ATOM 121 CA VAL A 121 235.201 251.713 234.895 1.00 0.00 C +ATOM 122 CA ALA A 122 233.004 248.789 233.825 1.00 0.00 C +ATOM 123 CA SER A 123 229.221 248.935 233.401 1.00 0.00 C +ATOM 124 CA SER A 124 225.416 249.119 233.315 1.00 0.00 C +ATOM 125 CA ASN A 125 223.295 247.541 230.571 1.00 0.00 C +ATOM 126 CA PRO A 126 220.505 245.565 232.254 1.00 0.00 C +ATOM 127 CA ALA A 127 220.258 243.689 235.560 1.00 0.00 C +ATOM 128 CA ARG A 128 221.341 244.528 239.116 1.00 0.00 C +ATOM 129 CA ARG A 129 222.022 241.324 241.062 1.00 0.00 C +ATOM 130 CA LYS A 130 219.854 239.796 243.797 1.00 0.00 C +ATOM 131 CA GLY A 131 217.270 239.164 246.525 1.00 0.00 C +ATOM 132 CA GLY A 132 215.772 237.719 249.716 1.00 0.00 C +ATOM 133 CA GLU A 133 214.182 237.924 253.172 1.00 0.00 C +ATOM 134 CA ARG A 134 214.806 238.107 256.926 1.00 0.00 C +ATOM 135 CA ARG A 135 217.886 239.686 258.518 1.00 0.00 C +ATOM 136 CA LYS A 136 221.127 237.686 258.412 1.00 0.00 C +ATOM 137 CA ARG A 137 224.031 237.704 260.878 1.00 0.00 C +ATOM 138 CA THR A 138 224.660 234.960 263.446 1.00 0.00 C +ATOM 139 CA GLU A 139 227.933 234.866 265.394 1.00 0.00 C +ATOM 140 CA GLU A 140 231.377 236.354 266.055 1.00 0.00 C +ATOM 141 CA VAL A 141 234.462 238.481 266.744 1.00 0.00 C +ATOM 142 CA ARG A 142 235.883 241.774 268.032 1.00 0.00 C +ATOM 143 CA GLY A 143 239.684 241.757 267.770 1.00 0.00 C +ATOM 144 CA GLY A 144 241.494 238.821 269.390 1.00 0.00 C +ATOM 145 CA PHE A 145 241.844 235.249 268.113 1.00 0.00 C +ATOM 146 CA LYS A 146 244.187 233.519 270.569 1.00 0.00 C +TER 147 LYS A 146 +END diff --git a/Plants/Q8LH66/Q8LH66.dcd b/Plants/Q8LH66/Q8LH66.dcd new file mode 100644 index 0000000000000000000000000000000000000000..665de086a234819db53674fb5370da3cdef19e21 --- /dev/null +++ b/Plants/Q8LH66/Q8LH66.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:a7aea5b412b7faaea5670452e48115576f49ebb412be09838c8bc98d44b6598c +size 20000276 diff --git a/Plants/Q8LH66/top.pdb b/Plants/Q8LH66/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..59b231a5a84005aee7dc549c1dd653895c07ebe0 --- /dev/null +++ b/Plants/Q8LH66/top.pdb @@ -0,0 +1,164 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 270.933 270.841 207.011 1.00 0.00 C +ATOM 2 CA GLY A 2 268.679 268.964 209.442 1.00 0.00 C +ATOM 3 CA TYR A 3 268.968 265.631 211.265 1.00 0.00 C +ATOM 4 CA VAL A 4 269.642 261.926 211.844 1.00 0.00 C +ATOM 5 CA GLY A 5 269.876 261.192 215.575 1.00 0.00 C +ATOM 6 CA VAL A 6 272.707 262.513 217.756 1.00 0.00 C +ATOM 7 CA THR A 7 275.601 263.307 215.409 1.00 0.00 C +ATOM 8 CA ASN A 8 275.736 266.859 214.038 1.00 0.00 C +ATOM 9 CA THR A 9 276.079 270.647 214.265 1.00 0.00 C +ATOM 10 CA THR A 10 278.320 273.473 215.491 1.00 0.00 C +ATOM 11 CA ALA A 11 281.462 274.858 213.838 1.00 0.00 C +ATOM 12 CA LYS A 12 281.111 273.846 210.182 1.00 0.00 C +ATOM 13 CA ALA A 13 278.433 275.482 208.021 1.00 0.00 C +ATOM 14 CA THR A 14 275.807 278.056 209.018 1.00 0.00 C +ATOM 15 CA THR A 15 272.609 280.119 209.199 1.00 0.00 C +ATOM 16 CA ALA A 16 268.891 279.443 209.680 1.00 0.00 C +ATOM 17 CA ALA A 17 268.583 278.618 213.387 1.00 0.00 C +ATOM 18 CA ALA A 18 268.610 275.313 215.281 1.00 0.00 C +ATOM 19 CA GLU A 19 267.384 276.047 218.813 1.00 0.00 C +ATOM 20 CA ALA A 20 269.186 276.652 222.115 1.00 0.00 C +ATOM 21 CA ALA A 21 271.883 279.279 222.699 1.00 0.00 C +ATOM 22 CA ALA A 22 275.426 278.005 223.282 1.00 0.00 C +ATOM 23 CA ARG A 23 278.035 275.235 223.468 1.00 0.00 C +ATOM 24 CA ARG A 24 281.336 276.389 221.956 1.00 0.00 C +ATOM 25 CA GLY A 25 282.726 273.550 219.830 1.00 0.00 C +ATOM 26 CA GLU A 26 281.240 270.266 221.066 1.00 0.00 C +ATOM 27 CA ALA A 27 283.593 268.373 223.388 1.00 0.00 C +ATOM 28 CA ARG A 28 285.997 267.248 226.121 1.00 0.00 C +ATOM 29 CA ARG A 29 287.736 264.730 228.391 1.00 0.00 C +ATOM 30 CA ARG A 30 291.193 263.519 229.438 1.00 0.00 C +ATOM 31 CA ARG A 31 294.312 263.323 231.617 1.00 0.00 C +ATOM 32 CA TRP A 32 293.254 264.334 235.135 1.00 0.00 C +ATOM 33 CA ARG A 33 293.866 261.382 237.464 1.00 0.00 C +ATOM 34 CA ARG A 34 297.210 261.587 239.280 1.00 0.00 C +ATOM 35 CA GLY A 35 300.903 260.688 239.533 1.00 0.00 C +ATOM 36 CA GLU A 36 303.697 259.968 237.044 1.00 0.00 C +ATOM 37 CA ALA A 37 302.408 260.182 233.465 1.00 0.00 C +ATOM 38 CA ALA A 38 300.698 257.878 230.958 1.00 0.00 C +ATOM 39 CA ALA A 39 301.590 259.324 227.548 1.00 0.00 C +ATOM 40 CA GLU A 40 304.772 260.379 225.738 1.00 0.00 C +ATOM 41 CA GLU A 41 306.015 258.440 222.703 1.00 0.00 C +ATOM 42 CA ALA A 42 305.236 255.976 219.904 1.00 0.00 C +ATOM 43 CA ARG A 43 306.400 257.673 216.697 1.00 0.00 C +ATOM 44 CA GLY A 44 306.607 256.380 213.120 1.00 0.00 C +ATOM 45 CA TRP A 45 303.181 254.899 212.352 1.00 0.00 C +ATOM 46 CA ARG A 46 300.793 255.147 215.311 1.00 0.00 C +ATOM 47 CA GLY A 47 297.225 253.868 215.692 1.00 0.00 C +ATOM 48 CA GLU A 48 296.244 253.658 219.367 1.00 0.00 C +ATOM 49 CA ARG A 49 296.839 255.109 222.840 1.00 0.00 C +ATOM 50 CA VAL A 50 294.263 257.679 223.969 1.00 0.00 C +ATOM 51 CA GLY A 51 290.754 257.962 225.424 1.00 0.00 C +ATOM 52 CA LYS A 52 290.070 256.543 228.893 1.00 0.00 C +ATOM 53 CA ALA A 53 292.454 256.765 231.857 1.00 0.00 C +ATOM 54 CA ARG A 54 290.823 256.148 235.245 1.00 0.00 C +ATOM 55 CA ARG A 55 290.040 254.393 238.535 1.00 0.00 C +ATOM 56 CA ARG A 56 292.098 251.187 238.584 1.00 0.00 C +ATOM 57 CA ARG A 57 290.625 248.286 240.566 1.00 0.00 C +ATOM 58 CA ARG A 58 288.348 245.266 241.028 1.00 0.00 C +ATOM 59 CA ARG A 59 286.958 242.695 238.584 1.00 0.00 C +ATOM 60 CA GLN A 60 284.042 240.357 237.846 1.00 0.00 C +ATOM 61 CA GLY A 61 281.919 237.201 238.068 1.00 0.00 C +ATOM 62 CA GLY A 62 278.338 236.881 239.329 1.00 0.00 C +ATOM 63 CA GLY A 63 276.879 233.613 240.637 1.00 0.00 C +ATOM 64 CA GLU A 64 275.773 230.120 239.592 1.00 0.00 C +ATOM 65 CA ALA A 65 273.051 229.053 242.036 1.00 0.00 C +ATOM 66 CA ARG A 66 271.710 227.239 245.106 1.00 0.00 C +ATOM 67 CA ARG A 67 269.023 224.564 245.484 1.00 0.00 C +ATOM 68 CA LEU A 68 267.244 222.438 248.098 1.00 0.00 C +ATOM 69 CA ARG A 69 263.512 221.726 248.384 1.00 0.00 C +ATOM 70 CA VAL A 70 260.402 222.763 250.326 1.00 0.00 C +ATOM 71 CA ALA A 71 260.254 226.507 251.015 1.00 0.00 C +ATOM 72 CA ARG A 72 261.918 229.934 251.037 1.00 0.00 C +ATOM 73 CA ASP A 73 264.721 230.829 253.458 1.00 0.00 C +ATOM 74 CA THR A 74 263.914 234.371 254.606 1.00 0.00 C +ATOM 75 CA THR A 75 264.923 237.892 253.560 1.00 0.00 C +ATOM 76 CA ALA A 76 262.369 240.324 255.002 1.00 0.00 C +ATOM 77 CA ALA A 77 258.906 240.768 253.478 1.00 0.00 C +ATOM 78 CA ALA A 78 255.644 240.089 255.325 1.00 0.00 C +ATOM 79 CA SER A 79 253.171 241.605 257.796 1.00 0.00 C +ATOM 80 CA SER A 80 250.400 242.885 260.077 1.00 0.00 C +ATOM 81 CA ALA A 81 249.881 246.657 260.213 1.00 0.00 C +ATOM 82 CA ALA A 82 246.555 248.471 259.809 1.00 0.00 C +ATOM 83 CA PRO A 83 244.512 246.984 256.958 1.00 0.00 C +ATOM 84 CA ARG A 84 241.610 248.703 255.187 1.00 0.00 C +ATOM 85 CA ARG A 85 239.313 250.179 257.844 1.00 0.00 C +ATOM 86 CA ARG A 86 237.571 249.720 261.202 1.00 0.00 C +ATOM 87 CA ALA A 87 235.630 246.459 260.872 1.00 0.00 C +ATOM 88 CA ARG A 88 237.373 243.934 263.131 1.00 0.00 C +ATOM 89 CA LEU A 89 235.522 240.626 263.520 1.00 0.00 C +ATOM 90 CA LEU A 90 234.263 238.861 266.653 1.00 0.00 C +ATOM 91 CA ARG A 91 232.400 236.008 268.356 1.00 0.00 C +ATOM 92 CA ARG A 92 231.293 232.504 269.364 1.00 0.00 C +ATOM 93 CA ASN A 93 228.489 231.431 271.709 1.00 0.00 C +ATOM 94 CA PRO A 94 224.947 232.831 271.843 1.00 0.00 C +ATOM 95 CA PRO A 95 221.147 232.587 271.738 1.00 0.00 C +ATOM 96 CA PRO A 96 219.396 235.825 270.755 1.00 0.00 C +ATOM 97 CA LEU A 97 220.259 238.875 272.870 1.00 0.00 C +ATOM 98 CA VAL A 98 222.434 242.000 272.730 1.00 0.00 C +ATOM 99 CA SER A 99 223.994 243.025 276.052 1.00 0.00 C +ATOM 100 CA SER A 100 225.621 246.177 277.444 1.00 0.00 C +ATOM 101 CA ALA A 101 229.316 247.080 277.670 1.00 0.00 C +ATOM 102 CA THR A 102 230.132 250.731 276.948 1.00 0.00 C +ATOM 103 CA SER A 103 231.296 251.725 273.459 1.00 0.00 C +ATOM 104 CA HIS A 104 229.060 254.364 271.862 1.00 0.00 C +ATOM 105 CA ARG A 105 226.143 256.662 272.713 1.00 0.00 C +ATOM 106 CA ARG A 106 223.862 256.610 269.662 1.00 0.00 C +ATOM 107 CA SER A 107 220.179 257.434 269.141 1.00 0.00 C +ATOM 108 CA SER A 108 216.589 258.706 269.017 1.00 0.00 C +ATOM 109 CA HIS A 109 213.858 260.634 267.188 1.00 0.00 C +ATOM 110 CA PRO A 110 212.301 259.651 263.853 1.00 0.00 C +ATOM 111 CA PRO A 111 212.286 262.890 261.847 1.00 0.00 C +ATOM 112 CA HIS A 112 213.105 266.542 261.130 1.00 0.00 C +ATOM 113 CA PRO A 113 214.097 268.980 258.376 1.00 0.00 C +ATOM 114 CA ALA A 114 212.568 269.513 254.927 1.00 0.00 C +ATOM 115 CA ALA A 115 210.063 269.024 252.099 1.00 0.00 C +ATOM 116 CA ALA A 116 208.774 265.440 252.003 1.00 0.00 C +ATOM 117 CA ARG A 117 209.724 261.999 250.672 1.00 0.00 C +ATOM 118 CA LEU A 118 213.078 261.115 252.248 1.00 0.00 C +ATOM 119 CA LEU A 119 212.367 258.394 254.818 1.00 0.00 C +ATOM 120 CA ARG A 120 212.651 254.675 255.598 1.00 0.00 C +ATOM 121 CA ARG A 121 210.358 252.181 253.856 1.00 0.00 C +ATOM 122 CA MET A 122 206.855 251.777 255.301 1.00 0.00 C +ATOM 123 CA PRO A 123 204.507 251.977 258.294 1.00 0.00 C +ATOM 124 CA PRO A 124 200.907 251.678 259.507 1.00 0.00 C +ATOM 125 CA PRO A 125 198.172 250.291 261.767 1.00 0.00 C +ATOM 126 CA LEU A 126 198.882 247.563 264.331 1.00 0.00 C +ATOM 127 CA ALA A 127 200.437 244.915 266.586 1.00 0.00 C +ATOM 128 CA SER A 128 200.363 243.318 270.044 1.00 0.00 C +ATOM 129 CA SER A 129 199.797 244.416 273.648 1.00 0.00 C +ATOM 130 CA ALA A 130 202.490 246.646 275.161 1.00 0.00 C +ATOM 131 CA ALA A 131 202.960 250.269 276.240 1.00 0.00 C +ATOM 132 CA PRO A 132 204.202 251.877 279.464 1.00 0.00 C +ATOM 133 CA ALA A 133 206.536 253.916 281.679 1.00 0.00 C +ATOM 134 CA ALA A 134 209.896 252.120 281.723 1.00 0.00 C +ATOM 135 CA ALA A 135 213.351 253.086 280.440 1.00 0.00 C +ATOM 136 CA ARG A 136 216.055 251.209 278.522 1.00 0.00 C +ATOM 137 CA ARG A 137 219.527 250.733 280.017 1.00 0.00 C +ATOM 138 CA LEU A 138 221.246 250.497 283.409 1.00 0.00 C +ATOM 139 CA ILE A 139 222.673 247.497 285.275 1.00 0.00 C +ATOM 140 CA PRO A 140 225.621 245.142 285.801 1.00 0.00 C +ATOM 141 CA ARG A 141 226.206 241.619 287.129 1.00 0.00 C +ATOM 142 CA ARG A 142 227.565 238.756 285.014 1.00 0.00 C +ATOM 143 CA SER A 143 228.168 235.612 287.081 1.00 0.00 C +ATOM 144 CA PRO A 144 227.180 235.652 290.760 1.00 0.00 C +ATOM 145 CA PRO A 145 223.380 235.580 291.027 1.00 0.00 C +ATOM 146 CA PRO A 146 220.924 236.172 288.174 1.00 0.00 C +ATOM 147 CA PRO A 147 220.242 235.984 284.431 1.00 0.00 C +ATOM 148 CA PRO A 148 217.027 234.628 282.900 1.00 0.00 C +ATOM 149 CA PRO A 149 214.298 232.008 282.449 1.00 0.00 C +ATOM 150 CA LEU A 150 212.670 229.810 279.797 1.00 0.00 C +ATOM 151 CA PRO A 151 211.571 226.825 277.700 1.00 0.00 C +ATOM 152 CA VAL A 152 212.558 225.837 274.155 1.00 0.00 C +ATOM 153 CA ALA A 153 212.963 222.216 273.040 1.00 0.00 C +ATOM 154 CA ARG A 154 210.150 219.760 272.287 1.00 0.00 C +ATOM 155 CA LEU A 155 211.075 216.067 272.137 1.00 0.00 C +ATOM 156 CA PRO A 156 209.780 213.172 274.248 1.00 0.00 C +ATOM 157 CA PRO A 157 210.325 209.866 276.062 1.00 0.00 C +ATOM 158 CA ARG A 158 213.468 208.275 274.611 1.00 0.00 C +ATOM 159 CA HIS A 159 213.815 206.025 271.556 1.00 0.00 C +ATOM 160 CA ALA A 160 214.564 202.345 270.912 1.00 0.00 C +TER 161 ALA A 160 +END diff --git a/Plants/Q8LH76/Q8LH76.dcd b/Plants/Q8LH76/Q8LH76.dcd new file mode 100644 index 0000000000000000000000000000000000000000..9ac569eaa436deecc34f091e87ce522c538f007f --- /dev/null +++ b/Plants/Q8LH76/Q8LH76.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e52ed957c5186f7546130fa5f3eee7cd5d029434205907567be80261b71c2a4e +size 10400276 diff --git a/Plants/Q8LH76/top.pdb b/Plants/Q8LH76/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..9134f22cb45419ac2ac5faee680ec40d32387ea0 --- /dev/null +++ b/Plants/Q8LH76/top.pdb @@ -0,0 +1,84 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 189.633 222.526 258.582 1.00 0.00 C +ATOM 2 CA ALA A 2 193.429 222.662 258.290 1.00 0.00 C +ATOM 3 CA GLY A 3 194.589 220.789 255.181 1.00 0.00 C +ATOM 4 CA PRO A 4 197.751 220.337 253.104 1.00 0.00 C +ATOM 5 CA ARG A 5 201.095 220.529 254.919 1.00 0.00 C +ATOM 6 CA ARG A 6 204.304 221.333 256.809 1.00 0.00 C +ATOM 7 CA ARG A 7 206.903 218.547 256.860 1.00 0.00 C +ATOM 8 CA ALA A 8 209.575 215.836 257.025 1.00 0.00 C +ATOM 9 CA PRO A 9 212.459 213.473 256.242 1.00 0.00 C +ATOM 10 CA GLY A 10 215.710 212.396 254.572 1.00 0.00 C +ATOM 11 CA LEU A 11 217.849 213.145 251.510 1.00 0.00 C +ATOM 12 CA ALA A 12 221.190 214.362 250.141 1.00 0.00 C +ATOM 13 CA ALA A 13 222.318 217.813 248.985 1.00 0.00 C +ATOM 14 CA SER A 14 225.648 219.633 248.645 1.00 0.00 C +ATOM 15 CA ARG A 15 227.318 222.205 246.384 1.00 0.00 C +ATOM 16 CA ALA A 16 228.845 224.132 243.474 1.00 0.00 C +ATOM 17 CA HIS A 17 230.391 224.274 239.994 1.00 0.00 C +ATOM 18 CA GLU A 18 228.939 226.526 237.286 1.00 0.00 C +ATOM 19 CA GLN A 19 226.372 224.942 234.958 1.00 0.00 C +ATOM 20 CA ALA A 20 225.186 226.323 231.611 1.00 0.00 C +ATOM 21 CA LEU A 21 226.736 229.232 229.701 1.00 0.00 C +ATOM 22 CA GLY A 22 229.156 232.131 229.195 1.00 0.00 C +ATOM 23 CA GLY A 23 231.992 234.318 230.495 1.00 0.00 C +ATOM 24 CA SER A 24 232.303 237.138 233.039 1.00 0.00 C +ATOM 25 CA ASP A 25 233.118 240.316 234.976 1.00 0.00 C +ATOM 26 CA THR A 26 232.094 243.959 234.534 1.00 0.00 C +ATOM 27 CA ALA A 27 232.251 247.608 235.617 1.00 0.00 C +ATOM 28 CA LEU A 28 229.083 249.337 234.396 1.00 0.00 C +ATOM 29 CA LEU A 29 228.573 251.781 231.518 1.00 0.00 C +ATOM 30 CA LEU A 30 229.205 251.372 227.783 1.00 0.00 C +ATOM 31 CA PRO A 31 231.379 254.092 226.238 1.00 0.00 C +ATOM 32 CA PRO A 32 229.542 257.112 224.815 1.00 0.00 C +ATOM 33 CA SER A 33 229.268 260.090 227.176 1.00 0.00 C +ATOM 34 CA ALA A 34 231.439 259.192 230.175 1.00 0.00 C +ATOM 35 CA PRO A 35 234.198 261.675 231.036 1.00 0.00 C +ATOM 36 CA PRO A 36 234.354 264.509 228.494 1.00 0.00 C +ATOM 37 CA GLN A 37 234.194 268.309 228.711 1.00 0.00 C +ATOM 38 CA GLY A 38 237.122 270.087 230.381 1.00 0.00 C +ATOM 39 CA ARG A 39 237.975 273.788 230.684 1.00 0.00 C +ATOM 40 CA ARG A 40 241.515 275.108 230.196 1.00 0.00 C +ATOM 41 CA GLN A 41 243.317 273.607 227.193 1.00 0.00 C +ATOM 42 CA ARG A 42 247.036 273.076 226.560 1.00 0.00 C +ATOM 43 CA ARG A 43 249.164 273.617 229.674 1.00 0.00 C +ATOM 44 CA PRO A 44 251.584 271.385 231.592 1.00 0.00 C +ATOM 45 CA LEU A 45 252.908 267.848 232.096 1.00 0.00 C +ATOM 46 CA PRO A 46 255.213 267.288 235.077 1.00 0.00 C +ATOM 47 CA LEU A 47 257.807 265.173 236.898 1.00 0.00 C +ATOM 48 CA ALA A 48 260.531 266.105 239.393 1.00 0.00 C +ATOM 49 CA PRO A 49 262.871 263.582 241.030 1.00 0.00 C +ATOM 50 CA SER A 50 266.589 262.827 241.380 1.00 0.00 C +ATOM 51 CA PRO A 51 269.029 265.640 240.576 1.00 0.00 C +ATOM 52 CA PRO A 52 272.460 264.844 239.122 1.00 0.00 C +ATOM 53 CA PRO A 53 275.489 262.845 237.964 1.00 0.00 C +ATOM 54 CA VAL A 54 278.589 262.062 240.036 1.00 0.00 C +ATOM 55 CA PRO A 55 280.690 260.747 242.930 1.00 0.00 C +ATOM 56 CA THR A 56 279.652 257.480 244.593 1.00 0.00 C +ATOM 57 CA CYS A 57 277.958 257.008 247.972 1.00 0.00 C +ATOM 58 CA ARG A 58 278.461 259.804 250.511 1.00 0.00 C +ATOM 59 CA LEU A 59 280.169 260.230 253.889 1.00 0.00 C +ATOM 60 CA PRO A 60 283.598 261.890 253.973 1.00 0.00 C +ATOM 61 CA ALA A 61 286.612 260.799 256.032 1.00 0.00 C +ATOM 62 CA SER A 62 285.821 259.263 259.428 1.00 0.00 C +ATOM 63 CA LEU A 63 282.904 257.297 260.889 1.00 0.00 C +ATOM 64 CA PRO A 64 279.900 258.834 262.658 1.00 0.00 C +ATOM 65 CA ASN A 65 279.191 259.856 266.259 1.00 0.00 C +ATOM 66 CA HIS A 66 280.285 256.952 268.469 1.00 0.00 C +ATOM 67 CA ARG A 67 283.261 256.549 270.814 1.00 0.00 C +ATOM 68 CA HIS A 68 283.861 259.817 272.679 1.00 0.00 C +ATOM 69 CA ALA A 69 283.388 261.901 275.833 1.00 0.00 C +ATOM 70 CA LEU A 70 285.577 260.385 278.558 1.00 0.00 C +ATOM 71 CA LEU A 71 288.482 260.185 281.015 1.00 0.00 C +ATOM 72 CA CYS A 72 291.136 261.852 283.181 1.00 0.00 C +ATOM 73 CA THR A 73 291.430 261.354 286.947 1.00 0.00 C +ATOM 74 CA PRO A 74 292.965 261.297 290.434 1.00 0.00 C +ATOM 75 CA ARG A 75 294.797 264.396 291.681 1.00 0.00 C +ATOM 76 CA GLU A 76 293.856 267.481 293.710 1.00 0.00 C +ATOM 77 CA ARG A 77 292.050 267.641 297.060 1.00 0.00 C +ATOM 78 CA GLU A 78 289.962 266.841 300.146 1.00 0.00 C +ATOM 79 CA ARG A 79 291.456 268.331 303.318 1.00 0.00 C +ATOM 80 CA ASP A 80 294.948 268.976 304.699 1.00 0.00 C +TER 81 ASP A 80 +END diff --git a/Plants/Q8LH86/Q8LH86.dcd b/Plants/Q8LH86/Q8LH86.dcd new file mode 100644 index 0000000000000000000000000000000000000000..c211609e60800786bf65a9219723534eb80de0dd --- /dev/null +++ b/Plants/Q8LH86/Q8LH86.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:95b0f4a6fd260789c50b6d4666dbff896c4f4626c5e1f93e3fc277718662488c +size 21800276 diff --git a/Plants/Q8LH86/top.pdb b/Plants/Q8LH86/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..f115acabab34e93956b6290a1a81d45119a65360 --- /dev/null +++ b/Plants/Q8LH86/top.pdb @@ -0,0 +1,179 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 271.469 230.334 305.242 1.00 0.00 C +ATOM 2 CA SER A 2 268.792 227.691 304.636 1.00 0.00 C +ATOM 3 CA ALA A 3 269.624 223.975 304.515 1.00 0.00 C +ATOM 4 CA SER A 4 268.847 220.849 306.550 1.00 0.00 C +ATOM 5 CA ASN A 5 269.777 217.835 304.415 1.00 0.00 C +ATOM 6 CA THR A 6 266.554 215.857 303.948 1.00 0.00 C +ATOM 7 CA HIS A 7 262.893 214.812 304.087 1.00 0.00 C +ATOM 8 CA PRO A 8 259.274 214.490 305.232 1.00 0.00 C +ATOM 9 CA ARG A 9 256.667 211.779 305.845 1.00 0.00 C +ATOM 10 CA ALA A 10 253.345 211.399 307.670 1.00 0.00 C +ATOM 11 CA THR A 11 250.299 211.423 309.959 1.00 0.00 C +ATOM 12 CA LEU A 12 248.780 210.232 313.244 1.00 0.00 C +ATOM 13 CA THR A 13 248.731 209.210 316.914 1.00 0.00 C +ATOM 14 CA SER A 14 245.411 208.000 318.340 1.00 0.00 C +ATOM 15 CA ARG A 15 245.010 204.596 320.004 1.00 0.00 C +ATOM 16 CA CYS A 16 241.763 202.961 321.146 1.00 0.00 C +ATOM 17 CA GLN A 17 239.718 201.736 324.118 1.00 0.00 C +ATOM 18 CA PRO A 18 239.460 202.385 327.863 1.00 0.00 C +ATOM 19 CA ARG A 19 238.652 205.959 328.907 1.00 0.00 C +ATOM 20 CA LYS A 20 240.805 207.298 331.751 1.00 0.00 C +ATOM 21 CA LEU A 21 242.376 206.850 335.193 1.00 0.00 C +ATOM 22 CA THR A 22 244.193 203.501 335.256 1.00 0.00 C +ATOM 23 CA PRO A 23 245.228 202.764 331.665 1.00 0.00 C +ATOM 24 CA HIS A 24 246.353 203.316 328.067 1.00 0.00 C +ATOM 25 CA ARG A 25 245.799 206.759 326.532 1.00 0.00 C +ATOM 26 CA PRO A 26 243.949 209.850 325.291 1.00 0.00 C +ATOM 27 CA PRO A 27 242.827 213.365 326.241 1.00 0.00 C +ATOM 28 CA ALA A 28 240.372 214.023 329.080 1.00 0.00 C +ATOM 29 CA ALA A 29 237.288 216.258 328.996 1.00 0.00 C +ATOM 30 CA PRO A 30 234.722 218.928 328.101 1.00 0.00 C +ATOM 31 CA SER A 31 231.423 220.647 328.925 1.00 0.00 C +ATOM 32 CA HIS A 32 229.390 223.858 329.203 1.00 0.00 C +ATOM 33 CA ILE A 33 230.506 226.994 327.350 1.00 0.00 C +ATOM 34 CA ASN A 34 232.796 229.978 326.744 1.00 0.00 C +ATOM 35 CA SER A 35 233.608 233.693 326.505 1.00 0.00 C +ATOM 36 CA CYS A 36 230.776 236.082 325.620 1.00 0.00 C +ATOM 37 CA ARG A 37 228.498 238.611 323.908 1.00 0.00 C +ATOM 38 CA ALA A 38 227.168 236.792 320.836 1.00 0.00 C +ATOM 39 CA ALA A 39 226.381 233.570 318.961 1.00 0.00 C +ATOM 40 CA TYR A 40 226.490 230.936 316.210 1.00 0.00 C +ATOM 41 CA ARG A 41 227.373 227.442 317.446 1.00 0.00 C +ATOM 42 CA ARG A 42 227.242 225.079 314.460 1.00 0.00 C +ATOM 43 CA ARG A 43 229.653 223.309 312.100 1.00 0.00 C +ATOM 44 CA ARG A 44 231.137 220.216 313.758 1.00 0.00 C +ATOM 45 CA PRO A 45 233.516 218.166 311.600 1.00 0.00 C +ATOM 46 CA HIS A 46 235.176 215.707 309.210 1.00 0.00 C +ATOM 47 CA ALA A 47 237.336 213.859 306.673 1.00 0.00 C +ATOM 48 CA THR A 48 240.846 214.446 305.312 1.00 0.00 C +ATOM 49 CA SER A 49 243.840 214.366 302.957 1.00 0.00 C +ATOM 50 CA MET A 50 245.028 216.629 300.131 1.00 0.00 C +ATOM 51 CA LEU A 51 244.819 219.304 297.426 1.00 0.00 C +ATOM 52 CA HIS A 52 243.539 222.830 298.095 1.00 0.00 C +ATOM 53 CA SER A 53 243.792 225.328 295.230 1.00 0.00 C +ATOM 54 CA PRO A 54 243.165 228.513 293.235 1.00 0.00 C +ATOM 55 CA ALA A 55 243.379 229.126 289.481 1.00 0.00 C +ATOM 56 CA THR A 56 242.481 225.822 287.810 1.00 0.00 C +ATOM 57 CA SER A 57 244.064 222.918 289.702 1.00 0.00 C +ATOM 58 CA LEU A 58 242.716 219.358 289.532 1.00 0.00 C +ATOM 59 CA HIS A 59 242.239 217.556 286.210 1.00 0.00 C +ATOM 60 CA PRO A 60 243.536 214.203 284.949 1.00 0.00 C +ATOM 61 CA ALA A 61 247.326 214.594 285.006 1.00 0.00 C +ATOM 62 CA LEU A 62 249.969 214.552 282.263 1.00 0.00 C +ATOM 63 CA SER A 63 251.735 213.566 279.034 1.00 0.00 C +ATOM 64 CA THR A 64 254.087 210.569 278.950 1.00 0.00 C +ATOM 65 CA HIS A 65 253.907 206.842 279.719 1.00 0.00 C +ATOM 66 CA PRO A 66 256.051 204.603 277.504 1.00 0.00 C +ATOM 67 CA LEU A 67 257.144 201.328 279.115 1.00 0.00 C +ATOM 68 CA PRO A 68 258.099 197.879 277.808 1.00 0.00 C +ATOM 69 CA ALA A 69 254.912 196.361 276.374 1.00 0.00 C +ATOM 70 CA THR A 70 254.838 195.579 272.646 1.00 0.00 C +ATOM 71 CA GLY A 71 255.729 198.630 270.544 1.00 0.00 C +ATOM 72 CA ALA A 72 253.746 198.209 267.317 1.00 0.00 C +ATOM 73 CA GLY A 73 253.655 201.546 265.482 1.00 0.00 C +ATOM 74 CA LEU A 74 255.329 203.696 262.819 1.00 0.00 C +ATOM 75 CA PRO A 75 257.578 206.687 262.100 1.00 0.00 C +ATOM 76 CA LEU A 76 255.866 210.090 262.050 1.00 0.00 C +ATOM 77 CA PRO A 77 255.795 212.211 265.215 1.00 0.00 C +ATOM 78 CA SER A 78 258.518 212.092 267.876 1.00 0.00 C +ATOM 79 CA VAL A 79 260.253 214.834 269.873 1.00 0.00 C +ATOM 80 CA PRO A 80 260.325 218.438 271.108 1.00 0.00 C +ATOM 81 CA SER A 81 257.955 221.410 271.368 1.00 0.00 C +ATOM 82 CA THR A 82 258.586 224.579 273.386 1.00 0.00 C +ATOM 83 CA ARG A 83 257.914 228.004 271.858 1.00 0.00 C +ATOM 84 CA SER A 84 260.248 230.997 271.523 1.00 0.00 C +ATOM 85 CA ARG A 85 262.957 233.471 270.495 1.00 0.00 C +ATOM 86 CA PRO A 86 264.878 236.209 272.319 1.00 0.00 C +ATOM 87 CA TRP A 87 266.540 238.621 269.882 1.00 0.00 C +ATOM 88 CA ALA A 88 269.439 240.124 267.920 1.00 0.00 C +ATOM 89 CA PRO A 89 268.363 243.143 265.859 1.00 0.00 C +ATOM 90 CA THR A 90 268.030 244.894 262.492 1.00 0.00 C +ATOM 91 CA ALA A 91 266.460 244.151 259.101 1.00 0.00 C +ATOM 92 CA ARG A 92 266.911 244.706 255.358 1.00 0.00 C +ATOM 93 CA CYS A 93 266.043 243.805 251.759 1.00 0.00 C +ATOM 94 CA HIS A 94 267.624 243.782 248.293 1.00 0.00 C +ATOM 95 CA PRO A 95 265.260 244.198 245.334 1.00 0.00 C +ATOM 96 CA HIS A 96 262.743 245.404 242.741 1.00 0.00 C +ATOM 97 CA HIS A 97 260.192 248.144 243.449 1.00 0.00 C +ATOM 98 CA THR A 98 260.017 250.190 240.241 1.00 0.00 C +ATOM 99 CA GLN A 99 258.704 248.382 237.155 1.00 0.00 C +ATOM 100 CA PRO A 100 257.183 248.362 233.662 1.00 0.00 C +ATOM 101 CA PRO A 101 257.256 250.891 230.813 1.00 0.00 C +ATOM 102 CA SER A 102 259.723 253.635 229.863 1.00 0.00 C +ATOM 103 CA PRO A 103 258.972 255.459 226.603 1.00 0.00 C +ATOM 104 CA ALA A 104 260.086 253.402 223.596 1.00 0.00 C +ATOM 105 CA ALA A 105 258.017 252.634 220.491 1.00 0.00 C +ATOM 106 CA PRO A 106 257.963 255.767 218.323 1.00 0.00 C +ATOM 107 CA ARG A 107 256.325 258.947 217.014 1.00 0.00 C +ATOM 108 CA PRO A 108 254.915 262.380 216.151 1.00 0.00 C +ATOM 109 CA ASP A 109 253.110 265.294 214.488 1.00 0.00 C +ATOM 110 CA LEU A 110 251.406 266.562 211.325 1.00 0.00 C +ATOM 111 CA ARG A 111 252.193 268.603 208.206 1.00 0.00 C +ATOM 112 CA GLY A 112 253.707 272.071 207.765 1.00 0.00 C +ATOM 113 CA GLY A 113 254.430 275.790 208.174 1.00 0.00 C +ATOM 114 CA THR A 114 257.651 277.644 207.336 1.00 0.00 C +ATOM 115 CA GLY A 115 261.146 277.456 208.841 1.00 0.00 C +ATOM 116 CA SER A 116 262.029 274.673 211.289 1.00 0.00 C +ATOM 117 CA GLY A 117 264.368 274.424 214.286 1.00 0.00 C +ATOM 118 CA HIS A 118 266.055 277.814 214.706 1.00 0.00 C +ATOM 119 CA GLY A 119 265.452 281.501 213.957 1.00 0.00 C +ATOM 120 CA GLY A 120 266.978 284.339 211.925 1.00 0.00 C +ATOM 121 CA THR A 121 265.255 285.630 208.782 1.00 0.00 C +ATOM 122 CA GLY A 122 262.882 285.112 205.847 1.00 0.00 C +ATOM 123 CA SER A 123 259.644 286.328 204.250 1.00 0.00 C +ATOM 124 CA SER A 124 257.766 283.224 203.088 1.00 0.00 C +ATOM 125 CA ARG A 125 254.546 283.837 201.144 1.00 0.00 C +ATOM 126 CA GLY A 126 251.333 283.735 199.100 1.00 0.00 C +ATOM 127 CA GLY A 127 248.130 285.709 199.701 1.00 0.00 C +ATOM 128 CA ALA A 128 245.301 286.551 197.292 1.00 0.00 C +ATOM 129 CA GLY A 129 246.053 287.187 193.612 1.00 0.00 C +ATOM 130 CA SER A 130 245.941 288.275 189.962 1.00 0.00 C +ATOM 131 CA THR A 131 244.122 286.940 186.892 1.00 0.00 C +ATOM 132 CA ALA A 132 245.995 285.719 183.807 1.00 0.00 C +ATOM 133 CA SER A 133 248.453 286.601 181.033 1.00 0.00 C +ATOM 134 CA SER A 134 248.143 289.614 178.723 1.00 0.00 C +ATOM 135 CA ARG A 135 250.016 291.361 175.902 1.00 0.00 C +ATOM 136 CA ARG A 136 249.260 292.736 172.430 1.00 0.00 C +ATOM 137 CA ILE A 137 246.088 291.787 170.546 1.00 0.00 C +ATOM 138 CA PRO A 138 242.568 290.461 169.938 1.00 0.00 C +ATOM 139 CA ARG A 139 238.844 289.769 169.527 1.00 0.00 C +ATOM 140 CA PRO A 140 237.028 286.420 169.463 1.00 0.00 C +ATOM 141 CA MET A 141 234.413 285.093 171.896 1.00 0.00 C +ATOM 142 CA CYS A 142 233.937 286.583 175.370 1.00 0.00 C +ATOM 143 CA THR A 143 235.087 290.144 176.086 1.00 0.00 C +ATOM 144 CA ALA A 144 237.873 291.868 178.030 1.00 0.00 C +ATOM 145 CA PRO A 145 239.766 294.620 179.864 1.00 0.00 C +ATOM 146 CA PRO A 146 241.921 295.737 182.800 1.00 0.00 C +ATOM 147 CA ALA A 147 244.967 295.222 185.030 1.00 0.00 C +ATOM 148 CA ALA A 148 246.785 298.461 185.875 1.00 0.00 C +ATOM 149 CA THR A 149 246.233 299.275 189.556 1.00 0.00 C +ATOM 150 CA SER A 150 244.512 300.644 192.668 1.00 0.00 C +ATOM 151 CA HIS A 151 242.505 303.808 191.974 1.00 0.00 C +ATOM 152 CA PRO A 152 242.257 306.958 189.846 1.00 0.00 C +ATOM 153 CA THR A 153 245.748 307.718 188.523 1.00 0.00 C +ATOM 154 CA ARG A 154 249.259 308.904 189.408 1.00 0.00 C +ATOM 155 CA SER A 155 252.696 310.136 188.321 1.00 0.00 C +ATOM 156 CA ALA A 156 255.534 312.439 189.398 1.00 0.00 C +ATOM 157 CA PRO A 157 256.755 314.910 186.769 1.00 0.00 C +ATOM 158 CA PRO A 158 256.801 317.583 184.054 1.00 0.00 C +ATOM 159 CA PRO A 159 253.224 318.595 183.216 1.00 0.00 C +ATOM 160 CA VAL A 160 250.164 318.023 181.020 1.00 0.00 C +ATOM 161 CA PRO A 161 249.462 314.885 178.976 1.00 0.00 C +ATOM 162 CA ARG A 162 247.423 312.224 180.786 1.00 0.00 C +ATOM 163 CA ARG A 163 247.477 308.538 179.823 1.00 0.00 C +ATOM 164 CA SER A 164 244.981 306.424 177.868 1.00 0.00 C +ATOM 165 CA PHE A 165 242.323 305.642 175.254 1.00 0.00 C +ATOM 166 CA ALA A 166 240.088 303.932 172.685 1.00 0.00 C +ATOM 167 CA GLY A 167 241.196 302.402 169.376 1.00 0.00 C +ATOM 168 CA SER A 168 244.645 303.373 168.081 1.00 0.00 C +ATOM 169 CA VAL A 169 246.106 301.640 165.019 1.00 0.00 C +ATOM 170 CA SER A 170 249.837 300.870 165.086 1.00 0.00 C +ATOM 171 CA PRO A 171 251.905 303.735 163.661 1.00 0.00 C +ATOM 172 CA PRO A 172 255.018 305.677 164.688 1.00 0.00 C +ATOM 173 CA LEU A 173 255.063 307.466 168.051 1.00 0.00 C +ATOM 174 CA ARG A 174 251.733 308.940 169.171 1.00 0.00 C +ATOM 175 CA SER A 175 251.359 312.592 170.190 1.00 0.00 C +TER 176 SER A 175 +END diff --git a/Plants/Q8LHH4/Q8LHH4.dcd b/Plants/Q8LHH4/Q8LHH4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..72dff47d6d6ba5dce818e80557885282c33030d4 --- /dev/null +++ b/Plants/Q8LHH4/Q8LHH4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:4f8111c3083e52ce5bfb3fd263f46545f876692a4a01ededf45bafa93e5d535d +size 47460276 diff --git a/Plants/Q8LHH4/top.pdb b/Plants/Q8LHH4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..16f2043655efa3b2f91ac62eb0890147692e119a --- /dev/null +++ b/Plants/Q8LHH4/top.pdb @@ -0,0 +1,261 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 291.574 272.783 247.573 1.00 0.00 C +ATOM 2 CA LEU A 2 289.120 271.276 245.079 1.00 0.00 C +ATOM 3 CA GLU A 3 287.362 273.290 242.364 1.00 0.00 C +ATOM 4 CA LYS A 4 283.998 271.583 241.829 1.00 0.00 C +ATOM 5 CA VAL A 5 280.840 269.497 241.395 1.00 0.00 C +ATOM 6 CA VAL A 6 278.167 271.814 239.980 1.00 0.00 C +ATOM 7 CA VAL A 7 274.746 271.677 241.651 1.00 0.00 C +ATOM 8 CA GLN A 8 274.112 270.454 245.203 1.00 0.00 C +ATOM 9 CA ARG A 9 276.192 272.146 247.910 1.00 0.00 C +ATOM 10 CA GLY A 10 278.410 270.227 250.341 1.00 0.00 C +ATOM 11 CA ASP A 11 276.893 267.857 252.910 1.00 0.00 C +ATOM 12 CA GLU A 12 274.698 264.866 253.778 1.00 0.00 C +ATOM 13 CA PRO A 13 271.095 263.965 254.625 1.00 0.00 C +ATOM 14 CA THR A 14 270.954 261.620 257.624 1.00 0.00 C +ATOM 15 CA ARG A 15 269.935 261.231 261.275 1.00 0.00 C +ATOM 16 CA ARG A 16 269.774 259.773 264.791 1.00 0.00 C +ATOM 17 CA ASN A 17 271.374 256.547 266.037 1.00 0.00 C +ATOM 18 CA GLY A 18 271.676 254.919 269.468 1.00 0.00 C +ATOM 19 CA TRP A 19 269.660 252.897 271.991 1.00 0.00 C +ATOM 20 CA PRO A 20 266.757 250.835 270.635 1.00 0.00 C +ATOM 21 CA LYS A 21 265.562 247.492 269.253 1.00 0.00 C +ATOM 22 CA GLY A 22 265.697 247.165 265.459 1.00 0.00 C +ATOM 23 CA ARG A 23 263.037 246.880 262.746 1.00 0.00 C +ATOM 24 CA ARG A 24 261.403 244.450 260.309 1.00 0.00 C +ATOM 25 CA ARG A 25 258.594 242.634 262.133 1.00 0.00 C +ATOM 26 CA ARG A 26 254.997 243.582 261.308 1.00 0.00 C +ATOM 27 CA ARG A 27 251.313 243.039 262.113 1.00 0.00 C +ATOM 28 CA GLY A 28 250.068 239.524 261.333 1.00 0.00 C +ATOM 29 CA TRP A 29 246.437 239.673 260.188 1.00 0.00 C +ATOM 30 CA ARG A 30 244.276 242.610 259.083 1.00 0.00 C +ATOM 31 CA GLY A 31 246.273 245.460 257.533 1.00 0.00 C +ATOM 32 CA ARG A 32 247.627 249.013 257.787 1.00 0.00 C +ATOM 33 CA ARG A 33 249.709 251.515 255.807 1.00 0.00 C +ATOM 34 CA GLY A 34 252.971 252.803 257.294 1.00 0.00 C +ATOM 35 CA ASP A 35 252.407 256.490 258.073 1.00 0.00 C +ATOM 36 CA GLY A 36 250.089 258.761 260.069 1.00 0.00 C +ATOM 37 CA VAL A 37 251.390 259.067 263.636 1.00 0.00 C +ATOM 38 CA PRO A 38 254.605 261.107 263.786 1.00 0.00 C +ATOM 39 CA ALA A 39 257.994 261.919 265.326 1.00 0.00 C +ATOM 40 CA LYS A 40 261.587 260.883 266.057 1.00 0.00 C +ATOM 41 CA PRO A 41 264.388 263.223 267.149 1.00 0.00 C +ATOM 42 CA ARG A 42 264.642 266.432 265.111 1.00 0.00 C +ATOM 43 CA SER A 43 262.794 269.670 264.324 1.00 0.00 C +ATOM 44 CA SER A 44 261.145 271.752 267.055 1.00 0.00 C +ATOM 45 CA TRP A 45 257.716 271.029 268.550 1.00 0.00 C +ATOM 46 CA ARG A 46 255.134 272.677 266.285 1.00 0.00 C +ATOM 47 CA ARG A 47 252.480 275.331 265.632 1.00 0.00 C +ATOM 48 CA GLY A 48 250.795 277.103 262.710 1.00 0.00 C +ATOM 49 CA GLN A 49 249.471 275.732 259.411 1.00 0.00 C +ATOM 50 CA HIS A 50 247.833 272.315 259.803 1.00 0.00 C +ATOM 51 CA SER A 51 247.526 269.188 257.647 1.00 0.00 C +ATOM 52 CA ASP A 52 245.495 266.006 258.159 1.00 0.00 C +ATOM 53 CA VAL A 53 243.495 263.824 255.760 1.00 0.00 C +ATOM 54 CA ASP A 54 242.200 266.231 253.105 1.00 0.00 C +ATOM 55 CA ARG A 55 238.608 265.699 251.950 1.00 0.00 C +ATOM 56 CA ARG A 56 235.067 266.228 250.647 1.00 0.00 C +ATOM 57 CA THR A 57 233.540 267.997 247.639 1.00 0.00 C +ATOM 58 CA GLY A 58 229.893 267.004 247.159 1.00 0.00 C +ATOM 59 CA ASP A 59 226.750 266.383 249.221 1.00 0.00 C +ATOM 60 CA VAL A 60 225.498 262.936 250.257 1.00 0.00 C +ATOM 61 CA GLN A 61 224.536 261.172 247.019 1.00 0.00 C +ATOM 62 CA GLU A 62 223.306 257.733 248.103 1.00 0.00 C +ATOM 63 CA PRO A 63 222.698 254.509 250.041 1.00 0.00 C +ATOM 64 CA ALA A 64 225.186 252.283 251.876 1.00 0.00 C +ATOM 65 CA GLY A 65 223.769 248.859 252.764 1.00 0.00 C +ATOM 66 CA GLY A 66 223.909 246.845 249.533 1.00 0.00 C +ATOM 67 CA GLY A 67 221.610 245.934 246.635 1.00 0.00 C +ATOM 68 CA GLU A 68 218.160 246.819 245.283 1.00 0.00 C +ATOM 69 CA VAL A 69 215.082 246.474 247.502 1.00 0.00 C +ATOM 70 CA LEU A 70 214.640 243.981 250.349 1.00 0.00 C +ATOM 71 CA ASP A 71 216.145 241.100 252.337 1.00 0.00 C +ATOM 72 CA ALA A 72 216.040 238.250 254.864 1.00 0.00 C +ATOM 73 CA ASP A 73 217.826 236.300 257.606 1.00 0.00 C +ATOM 74 CA GLU A 74 216.723 236.738 261.227 1.00 0.00 C +ATOM 75 CA GLU A 75 218.713 238.789 263.747 1.00 0.00 C +ATOM 76 CA ALA A 76 217.884 237.473 267.225 1.00 0.00 C +ATOM 77 CA THR A 77 216.220 238.340 270.541 1.00 0.00 C +ATOM 78 CA PRO A 78 218.147 238.493 273.824 1.00 0.00 C +ATOM 79 CA ALA A 79 219.210 239.279 277.397 1.00 0.00 C +ATOM 80 CA SER A 80 218.675 237.045 280.437 1.00 0.00 C +ATOM 81 CA PHE A 81 219.045 233.554 281.918 1.00 0.00 C +ATOM 82 CA GLY A 82 219.539 230.087 283.419 1.00 0.00 C +ATOM 83 CA ARG A 83 221.200 227.658 280.999 1.00 0.00 C +ATOM 84 CA GLY A 84 223.761 228.686 278.372 1.00 0.00 C +ATOM 85 CA GLY A 85 224.686 226.510 275.385 1.00 0.00 C +ATOM 86 CA GLY A 86 227.799 224.483 274.537 1.00 0.00 C +ATOM 87 CA ASP A 87 230.772 223.433 276.677 1.00 0.00 C +ATOM 88 CA ALA A 88 234.322 223.132 278.027 1.00 0.00 C +ATOM 89 CA GLY A 89 235.822 219.726 277.211 1.00 0.00 C +ATOM 90 CA ASP A 90 233.268 217.127 276.098 1.00 0.00 C +ATOM 91 CA GLU A 91 234.569 214.072 274.230 1.00 0.00 C +ATOM 92 CA GLY A 92 236.166 213.019 270.935 1.00 0.00 C +ATOM 93 CA GLY A 93 238.906 210.471 271.651 1.00 0.00 C +ATOM 94 CA VAL A 94 241.225 207.786 273.040 1.00 0.00 C +ATOM 95 CA ALA A 95 243.558 208.367 275.996 1.00 0.00 C +ATOM 96 CA GLU A 96 247.082 209.802 276.188 1.00 0.00 C +ATOM 97 CA PRO A 97 249.405 212.745 275.514 1.00 0.00 C +ATOM 98 CA ARG A 98 249.456 215.779 273.210 1.00 0.00 C +ATOM 99 CA GLU A 99 245.897 216.648 272.165 1.00 0.00 C +ATOM 100 CA VAL A 100 242.869 216.165 269.904 1.00 0.00 C +ATOM 101 CA VAL A 101 243.962 215.876 266.266 1.00 0.00 C +ATOM 102 CA ALA A 102 245.594 216.653 262.911 1.00 0.00 C +ATOM 103 CA THR A 103 248.847 215.084 261.699 1.00 0.00 C +ATOM 104 CA SER A 104 251.963 214.348 259.635 1.00 0.00 C +ATOM 105 CA ALA A 105 255.473 214.043 261.085 1.00 0.00 C +ATOM 106 CA GLY A 106 258.402 213.085 263.326 1.00 0.00 C +ATOM 107 CA ALA A 107 258.350 215.475 266.293 1.00 0.00 C +ATOM 108 CA ARG A 108 260.517 217.938 268.231 1.00 0.00 C +ATOM 109 CA GLU A 109 259.536 219.247 271.672 1.00 0.00 C +ATOM 110 CA THR A 110 257.243 222.069 272.809 1.00 0.00 C +ATOM 111 CA ARG A 111 254.486 224.699 272.819 1.00 0.00 C +ATOM 112 CA GLN A 112 252.389 224.603 269.639 1.00 0.00 C +ATOM 113 CA TRP A 113 253.430 222.118 266.945 1.00 0.00 C +ATOM 114 CA ARG A 114 251.675 220.966 263.765 1.00 0.00 C +ATOM 115 CA PRO A 115 251.145 222.526 260.329 1.00 0.00 C +ATOM 116 CA GLU A 116 249.419 222.615 256.934 1.00 0.00 C +ATOM 117 CA VAL A 117 248.196 219.047 256.398 1.00 0.00 C +ATOM 118 CA GLU A 118 249.490 217.312 253.263 1.00 0.00 C +ATOM 119 CA GLN A 119 248.498 213.652 253.637 1.00 0.00 C +ATOM 120 CA TRP A 120 247.757 211.334 250.705 1.00 0.00 C +ATOM 121 CA ARG A 121 248.118 211.194 246.915 1.00 0.00 C +ATOM 122 CA GLN A 122 250.502 210.518 244.021 1.00 0.00 C +ATOM 123 CA ARG A 123 252.319 212.971 241.741 1.00 0.00 C +ATOM 124 CA HIS A 124 252.546 213.803 238.030 1.00 0.00 C +ATOM 125 CA CYS A 125 250.621 214.687 234.864 1.00 0.00 C +ATOM 126 CA PHE A 126 248.526 215.522 231.792 1.00 0.00 C +ATOM 127 CA ALA A 127 247.884 212.557 229.487 1.00 0.00 C +ATOM 128 CA GLY A 128 245.256 210.085 230.711 1.00 0.00 C +ATOM 129 CA GLU A 129 241.494 210.468 231.176 1.00 0.00 C +ATOM 130 CA ASP A 130 238.449 212.643 230.458 1.00 0.00 C +ATOM 131 CA ALA A 131 236.547 215.934 230.706 1.00 0.00 C +ATOM 132 CA SER A 132 233.130 216.936 229.351 1.00 0.00 C +ATOM 133 CA PRO A 133 229.634 217.188 227.858 1.00 0.00 C +ATOM 134 CA VAL A 134 226.536 217.158 225.640 1.00 0.00 C +ATOM 135 CA LEU A 135 224.575 218.796 222.814 1.00 0.00 C +ATOM 136 CA SER A 136 221.220 219.857 224.273 1.00 0.00 C +ATOM 137 CA PRO A 137 219.234 223.008 223.470 1.00 0.00 C +ATOM 138 CA ARG A 138 217.135 226.133 224.057 1.00 0.00 C +ATOM 139 CA ASN A 139 216.420 228.602 226.869 1.00 0.00 C +ATOM 140 CA GLY A 140 216.388 231.631 229.180 1.00 0.00 C +ATOM 141 CA GLY A 141 217.495 234.006 231.946 1.00 0.00 C +ATOM 142 CA LEU A 142 219.309 236.356 234.333 1.00 0.00 C +ATOM 143 CA THR A 143 219.553 237.659 237.905 1.00 0.00 C +ATOM 144 CA GLU A 144 220.502 241.326 237.494 1.00 0.00 C +ATOM 145 CA GLY A 145 221.583 243.194 240.634 1.00 0.00 C +ATOM 146 CA GLU A 146 224.993 244.750 239.952 1.00 0.00 C +ATOM 147 CA GLU A 147 226.936 246.156 242.912 1.00 0.00 C +ATOM 148 CA VAL A 148 229.033 249.337 242.910 1.00 0.00 C +ATOM 149 CA ALA A 149 228.003 252.462 244.831 1.00 0.00 C +ATOM 150 CA ALA A 150 230.472 255.165 243.776 1.00 0.00 C +ATOM 151 CA ARG A 151 232.595 257.046 241.232 1.00 0.00 C +ATOM 152 CA PRO A 152 234.796 256.990 238.123 1.00 0.00 C +ATOM 153 CA ARG A 153 233.244 256.261 234.721 1.00 0.00 C +ATOM 154 CA GLU A 154 233.268 254.516 231.334 1.00 0.00 C +ATOM 155 CA LYS A 155 230.173 253.589 229.315 1.00 0.00 C +ATOM 156 CA THR A 156 230.537 251.573 226.103 1.00 0.00 C +ATOM 157 CA ALA A 157 229.708 252.547 222.514 1.00 0.00 C +ATOM 158 CA ARG A 158 227.125 255.346 222.424 1.00 0.00 C +ATOM 159 CA PRO A 159 225.123 256.878 225.281 1.00 0.00 C +ATOM 160 CA ASP A 160 222.251 257.976 227.530 1.00 0.00 C +ATOM 161 CA GLY A 161 219.345 257.966 229.995 1.00 0.00 C +ATOM 162 CA ALA A 162 219.605 259.944 233.240 1.00 0.00 C +ATOM 163 CA PRO A 163 218.573 261.069 236.731 1.00 0.00 C +ATOM 164 CA ALA A 164 217.645 261.501 240.401 1.00 0.00 C +ATOM 165 CA ARG A 165 214.909 262.226 242.951 1.00 0.00 C +ATOM 166 CA ARG A 166 211.623 260.512 242.066 1.00 0.00 C +ATOM 167 CA GLU A 167 209.884 261.200 238.747 1.00 0.00 C +ATOM 168 CA ARG A 168 206.831 263.480 238.710 1.00 0.00 C +ATOM 169 CA ARG A 169 203.384 265.076 238.999 1.00 0.00 C +ATOM 170 CA LEU A 170 200.755 267.796 238.544 1.00 0.00 C +ATOM 171 CA GLU A 171 197.102 268.276 237.575 1.00 0.00 C +ATOM 172 CA ALA A 172 195.671 271.699 236.710 1.00 0.00 C +ATOM 173 CA ALA A 173 197.946 274.185 238.489 1.00 0.00 C +ATOM 174 CA GLY A 174 199.235 277.765 238.306 1.00 0.00 C +ATOM 175 CA ALA A 175 202.497 278.095 236.365 1.00 0.00 C +ATOM 176 CA GLU A 176 203.786 275.485 233.906 1.00 0.00 C +ATOM 177 CA GLU A 177 205.031 274.219 230.536 1.00 0.00 C +ATOM 178 CA ARG A 178 207.816 273.641 228.001 1.00 0.00 C +ATOM 179 CA GLU A 179 206.569 270.834 225.745 1.00 0.00 C +ATOM 180 CA GLY A 180 206.844 267.035 225.696 1.00 0.00 C +ATOM 181 CA ARG A 181 206.272 263.330 226.377 1.00 0.00 C +ATOM 182 CA ARG A 182 207.960 259.948 226.855 1.00 0.00 C +ATOM 183 CA ARG A 183 211.731 260.126 227.371 1.00 0.00 C +ATOM 184 CA GLU A 184 212.661 263.761 228.030 1.00 0.00 C +ATOM 185 CA ARG A 185 213.846 267.367 228.359 1.00 0.00 C +ATOM 186 CA ALA A 186 217.442 267.522 229.609 1.00 0.00 C +ATOM 187 CA SER A 187 220.772 265.851 230.408 1.00 0.00 C +ATOM 188 CA GLY A 188 222.966 268.614 231.847 1.00 0.00 C +ATOM 189 CA GLY A 189 225.402 269.844 234.505 1.00 0.00 C +ATOM 190 CA HIS A 190 228.956 271.200 234.718 1.00 0.00 C +ATOM 191 CA ARG A 191 232.590 272.215 234.185 1.00 0.00 C +ATOM 192 CA ALA A 192 234.482 269.173 232.889 1.00 0.00 C +ATOM 193 CA LYS A 193 236.634 267.163 235.307 1.00 0.00 C +ATOM 194 CA ARG A 194 239.862 265.992 236.957 1.00 0.00 C +ATOM 195 CA ARG A 195 241.093 263.871 239.873 1.00 0.00 C +ATOM 196 CA ALA A 196 241.746 263.085 243.543 1.00 0.00 C +ATOM 197 CA GLY A 197 244.298 260.258 243.473 1.00 0.00 C +ATOM 198 CA ARG A 198 243.091 257.270 241.441 1.00 0.00 C +ATOM 199 CA GLY A 199 243.477 253.643 242.543 1.00 0.00 C +ATOM 200 CA GLY A 200 245.836 250.654 242.662 1.00 0.00 C +ATOM 201 CA GLY A 201 247.895 250.949 239.470 1.00 0.00 C +ATOM 202 CA GLY A 202 251.504 249.861 240.022 1.00 0.00 C +ATOM 203 CA GLY A 203 253.170 246.741 241.438 1.00 0.00 C +ATOM 204 CA GLY A 204 256.704 246.186 240.126 1.00 0.00 C +ATOM 205 CA ASP A 205 259.998 245.461 241.898 1.00 0.00 C +ATOM 206 CA VAL A 206 263.701 245.696 241.032 1.00 0.00 C +ATOM 207 CA GLY A 207 266.009 246.816 243.849 1.00 0.00 C +ATOM 208 CA GLY A 208 266.463 247.689 247.530 1.00 0.00 C +ATOM 209 CA GLY A 209 265.490 249.710 250.609 1.00 0.00 C +ATOM 210 CA ASP A 210 263.607 249.673 253.922 1.00 0.00 C +ATOM 211 CA GLY A 211 265.618 249.642 257.158 1.00 0.00 C +ATOM 212 CA ALA A 212 268.439 252.164 257.603 1.00 0.00 C +ATOM 213 CA ALA A 213 271.847 253.718 258.301 1.00 0.00 C +ATOM 214 CA GLY A 214 274.412 251.499 260.036 1.00 0.00 C +ATOM 215 CA ARG A 215 278.056 252.475 260.568 1.00 0.00 C +ATOM 216 CA ARG A 216 280.385 250.580 258.222 1.00 0.00 C +ATOM 217 CA THR A 217 282.710 252.034 255.578 1.00 0.00 C +ATOM 218 CA VAL A 218 284.065 250.455 252.386 1.00 0.00 C +ATOM 219 CA GLU A 219 287.763 251.169 251.810 1.00 0.00 C +ATOM 220 CA ALA A 220 288.712 254.057 254.106 1.00 0.00 C +ATOM 221 CA ALA A 221 287.475 257.155 252.265 1.00 0.00 C +ATOM 222 CA GLN A 222 286.026 258.611 249.056 1.00 0.00 C +ATOM 223 CA ALA A 223 282.911 260.536 250.109 1.00 0.00 C +ATOM 224 CA ALA A 224 282.376 263.475 247.744 1.00 0.00 C +ATOM 225 CA GLY A 225 282.636 267.242 247.240 1.00 0.00 C +ATOM 226 CA GLY A 226 284.631 269.872 249.143 1.00 0.00 C +ATOM 227 CA GLY A 227 285.805 269.402 252.737 1.00 0.00 C +ATOM 228 CA ARG A 228 289.321 269.774 254.158 1.00 0.00 C +ATOM 229 CA ARG A 229 293.053 269.861 253.400 1.00 0.00 C +ATOM 230 CA ARG A 230 296.212 270.013 251.275 1.00 0.00 C +ATOM 231 CA GLY A 231 299.212 269.114 253.445 1.00 0.00 C +ATOM 232 CA ARG A 232 300.361 272.152 255.436 1.00 0.00 C +ATOM 233 CA GLU A 233 303.820 273.353 256.490 1.00 0.00 C +ATOM 234 CA ARG A 234 306.438 270.585 256.529 1.00 0.00 C +ATOM 235 CA ARG A 235 307.706 267.950 258.972 1.00 0.00 C +ATOM 236 CA ALA A 236 308.699 264.570 260.423 1.00 0.00 C +ATOM 237 CA ALA A 237 310.617 262.409 262.906 1.00 0.00 C +ATOM 238 CA GLY A 238 314.146 262.075 261.509 1.00 0.00 C +ATOM 239 CA ARG A 239 314.552 265.041 259.153 1.00 0.00 C +ATOM 240 CA TRP A 240 313.335 265.557 255.579 1.00 0.00 C +ATOM 241 CA LEU A 241 310.207 264.255 253.836 1.00 0.00 C +ATOM 242 CA GLY A 242 310.355 262.360 250.535 1.00 0.00 C +ATOM 243 CA THR A 243 310.733 264.905 247.725 1.00 0.00 C +ATOM 244 CA THR A 244 308.577 264.504 244.610 1.00 0.00 C +ATOM 245 CA GLY A 245 310.382 264.594 241.256 1.00 0.00 C +ATOM 246 CA ARG A 246 311.742 268.108 240.691 1.00 0.00 C +ATOM 247 CA LEU A 247 312.241 271.717 239.575 1.00 0.00 C +ATOM 248 CA GLY A 248 310.172 274.868 240.129 1.00 0.00 C +ATOM 249 CA ARG A 249 311.213 278.311 241.385 1.00 0.00 C +ATOM 250 CA GLY A 250 313.234 281.492 240.827 1.00 0.00 C +ATOM 251 CA LEU A 251 313.897 281.811 237.089 1.00 0.00 C +ATOM 252 CA LYS A 252 312.652 281.551 233.497 1.00 0.00 C +ATOM 253 CA ARG A 253 311.558 280.023 230.183 1.00 0.00 C +ATOM 254 CA GLU A 254 310.080 281.465 226.981 1.00 0.00 C +ATOM 255 CA ASN A 255 306.535 280.072 226.892 1.00 0.00 C +ATOM 256 CA GLY A 256 306.004 276.302 226.739 1.00 0.00 C +ATOM 257 CA GLY A 257 303.097 274.186 227.999 1.00 0.00 C +TER 258 GLY A 257 +END diff --git a/Plants/Q8LHP1/Q8LHP1.dcd b/Plants/Q8LHP1/Q8LHP1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..ab0c9bc90ef1d146d033dfd583a371bb181e13bc --- /dev/null +++ b/Plants/Q8LHP1/Q8LHP1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:dc5f74de1d7f5e1a0215abe260ee126928bb6bd275979053daf49b4e80c50657 +size 11840276 diff --git a/Plants/Q8LHP1/top.pdb b/Plants/Q8LHP1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..4fa8457de9c917ec47c3ac05a6c6cba5fdc2539f --- /dev/null +++ b/Plants/Q8LHP1/top.pdb @@ -0,0 +1,96 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 245.097 233.585 226.654 1.00 0.00 C +ATOM 2 CA ALA A 2 241.655 232.929 228.149 1.00 0.00 C +ATOM 3 CA GLN A 3 241.106 231.035 231.409 1.00 0.00 C +ATOM 4 CA HIS A 4 242.094 228.809 234.339 1.00 0.00 C +ATOM 5 CA ILE A 5 239.478 228.088 237.014 1.00 0.00 C +ATOM 6 CA LYS A 6 235.852 229.072 236.383 1.00 0.00 C +ATOM 7 CA VAL A 7 233.825 226.273 237.987 1.00 0.00 C +ATOM 8 CA LYS A 8 232.818 222.894 239.431 1.00 0.00 C +ATOM 9 CA LYS A 9 233.594 221.672 242.955 1.00 0.00 C +ATOM 10 CA ILE A 10 234.480 223.897 245.918 1.00 0.00 C +ATOM 11 CA SER A 11 234.825 227.090 247.967 1.00 0.00 C +ATOM 12 CA GLY A 12 233.025 229.617 250.179 1.00 0.00 C +ATOM 13 CA GLY A 13 234.397 233.095 250.911 1.00 0.00 C +ATOM 14 CA GLY A 14 232.471 236.376 250.705 1.00 0.00 C +ATOM 15 CA GLY A 15 233.824 238.800 253.314 1.00 0.00 C +ATOM 16 CA GLU A 16 237.367 239.350 254.602 1.00 0.00 C +ATOM 17 CA TRP A 17 239.985 237.722 256.840 1.00 0.00 C +ATOM 18 CA ALA A 18 242.847 236.132 254.892 1.00 0.00 C +ATOM 19 CA ASP A 19 246.469 235.699 255.993 1.00 0.00 C +ATOM 20 CA PRO A 20 247.923 239.124 256.811 1.00 0.00 C +ATOM 21 CA GLU A 21 251.199 241.011 256.341 1.00 0.00 C +ATOM 22 CA PRO A 22 254.182 243.372 256.549 1.00 0.00 C +ATOM 23 CA ASP A 23 255.065 246.789 255.114 1.00 0.00 C +ATOM 24 CA ARG A 24 256.302 248.191 251.795 1.00 0.00 C +ATOM 25 CA GLY A 25 259.525 247.579 249.857 1.00 0.00 C +ATOM 26 CA GLU A 26 262.187 247.214 247.156 1.00 0.00 C +ATOM 27 CA VAL A 27 265.539 246.078 245.745 1.00 0.00 C +ATOM 28 CA MET A 28 269.200 246.255 246.785 1.00 0.00 C +ATOM 29 CA GLU A 29 271.093 246.099 250.087 1.00 0.00 C +ATOM 30 CA PRO A 30 274.721 247.261 250.064 1.00 0.00 C +ATOM 31 CA GLY A 31 277.163 248.226 247.303 1.00 0.00 C +ATOM 32 CA ALA A 32 275.294 249.790 244.373 1.00 0.00 C +ATOM 33 CA SER A 33 272.274 251.524 242.828 1.00 0.00 C +ATOM 34 CA PRO A 34 269.960 249.514 240.566 1.00 0.00 C +ATOM 35 CA GLU A 35 268.422 252.022 238.145 1.00 0.00 C +ATOM 36 CA PRO A 36 264.750 252.223 237.149 1.00 0.00 C +ATOM 37 CA VAL A 37 263.778 253.054 233.560 1.00 0.00 C +ATOM 38 CA ALA A 38 260.854 255.005 232.090 1.00 0.00 C +ATOM 39 CA GLY A 39 258.253 257.283 233.690 1.00 0.00 C +ATOM 40 CA GLY A 40 255.129 259.101 232.485 1.00 0.00 C +ATOM 41 CA GLU A 41 255.661 261.996 230.066 1.00 0.00 C +ATOM 42 CA ASP A 42 258.746 263.825 231.352 1.00 0.00 C +ATOM 43 CA ASP A 43 262.422 262.951 231.836 1.00 0.00 C +ATOM 44 CA GLU A 44 266.042 263.653 232.794 1.00 0.00 C +ATOM 45 CA GLN A 45 268.327 262.283 235.517 1.00 0.00 C +ATOM 46 CA PRO A 46 267.768 259.738 238.296 1.00 0.00 C +ATOM 47 CA TRP A 47 264.308 258.728 239.529 1.00 0.00 C +ATOM 48 CA GLU A 48 261.441 258.748 242.039 1.00 0.00 C +ATOM 49 CA GLY A 49 260.072 260.219 245.276 1.00 0.00 C +ATOM 50 CA GLY A 50 256.780 260.157 247.193 1.00 0.00 C +ATOM 51 CA CYS A 51 254.953 258.065 249.801 1.00 0.00 C +ATOM 52 CA GLN A 52 251.976 255.799 250.518 1.00 0.00 C +ATOM 53 CA ARG A 53 252.765 252.368 249.064 1.00 0.00 C +ATOM 54 CA ARG A 54 254.226 250.160 246.323 1.00 0.00 C +ATOM 55 CA ILE A 55 253.938 249.906 242.532 1.00 0.00 C +ATOM 56 CA SER A 56 255.177 249.179 239.004 1.00 0.00 C +ATOM 57 CA PRO A 57 256.308 252.475 237.463 1.00 0.00 C +ATOM 58 CA GLU A 58 255.617 255.603 239.526 1.00 0.00 C +ATOM 59 CA GLU A 59 254.948 259.152 240.737 1.00 0.00 C +ATOM 60 CA LEU A 60 252.117 260.162 243.079 1.00 0.00 C +ATOM 61 CA PRO A 61 248.799 260.665 244.884 1.00 0.00 C +ATOM 62 CA GLY A 62 245.776 258.419 245.459 1.00 0.00 C +ATOM 63 CA GLN A 63 242.235 259.252 246.593 1.00 0.00 C +ATOM 64 CA ALA A 64 239.152 257.135 247.317 1.00 0.00 C +ATOM 65 CA GLU A 65 236.704 258.790 249.723 1.00 0.00 C +ATOM 66 CA GLY A 66 237.421 261.009 252.736 1.00 0.00 C +ATOM 67 CA ARG A 67 237.621 259.282 256.126 1.00 0.00 C +ATOM 68 CA ARG A 68 240.825 257.905 257.660 1.00 0.00 C +ATOM 69 CA GLY A 69 243.626 258.844 255.253 1.00 0.00 C +ATOM 70 CA MET A 70 245.756 256.551 253.081 1.00 0.00 C +ATOM 71 CA ARG A 71 243.817 253.286 252.772 1.00 0.00 C +ATOM 72 CA GLY A 72 246.514 250.670 252.141 1.00 0.00 C +ATOM 73 CA ALA A 73 246.554 248.395 255.196 1.00 0.00 C +ATOM 74 CA ARG A 74 244.100 248.525 258.108 1.00 0.00 C +ATOM 75 CA GLU A 75 244.764 251.817 259.908 1.00 0.00 C +ATOM 76 CA ARG A 76 241.703 253.252 261.664 1.00 0.00 C +ATOM 77 CA VAL A 77 237.967 253.547 260.976 1.00 0.00 C +ATOM 78 CA GLY A 78 235.278 251.973 263.169 1.00 0.00 C +ATOM 79 CA ARG A 79 234.579 253.118 266.735 1.00 0.00 C +ATOM 80 CA ASP A 80 235.918 256.592 267.543 1.00 0.00 C +ATOM 81 CA TRP A 81 239.061 257.369 269.552 1.00 0.00 C +ATOM 82 CA GLY A 82 240.316 260.940 269.981 1.00 0.00 C +ATOM 83 CA GLU A 83 243.357 263.235 270.055 1.00 0.00 C +ATOM 84 CA LYS A 84 247.088 262.793 270.687 1.00 0.00 C +ATOM 85 CA MET A 85 248.972 259.527 270.140 1.00 0.00 C +ATOM 86 CA GLU A 86 250.910 256.604 271.629 1.00 0.00 C +ATOM 87 CA GLY A 87 251.493 254.757 274.910 1.00 0.00 C +ATOM 88 CA VAL A 88 252.084 257.341 277.647 1.00 0.00 C +ATOM 89 CA HIS A 89 250.666 259.872 280.116 1.00 0.00 C +ATOM 90 CA THR A 90 247.891 262.372 279.361 1.00 0.00 C +ATOM 91 CA ARG A 91 244.406 262.763 280.849 1.00 0.00 C +ATOM 92 CA ARG A 92 243.037 259.382 281.950 1.00 0.00 C +TER 93 ARG A 92 +END diff --git a/Plants/Q8LHU3/Q8LHU3.dcd b/Plants/Q8LHU3/Q8LHU3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..331f5c5d68c109e1870756c8d7a8c73871a6e3f9 --- /dev/null +++ b/Plants/Q8LHU3/Q8LHU3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:176f7412ca4a634c56f1c502c5e2be2bd50f801dd4eb3f41aaf545e3c00d4458 +size 19760276 diff --git a/Plants/Q8LHU3/top.pdb b/Plants/Q8LHU3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..24a4ecc00297d35ab167f73a6269b59d80368296 --- /dev/null +++ b/Plants/Q8LHU3/top.pdb @@ -0,0 +1,162 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 257.815 291.898 222.745 1.00 0.00 C +ATOM 2 CA SER A 2 256.382 288.555 223.878 1.00 0.00 C +ATOM 3 CA VAL A 3 253.659 286.087 224.884 1.00 0.00 C +ATOM 4 CA GLN A 4 250.006 287.141 224.640 1.00 0.00 C +ATOM 5 CA LEU A 5 247.041 289.246 225.776 1.00 0.00 C +ATOM 6 CA THR A 6 243.857 290.863 227.104 1.00 0.00 C +ATOM 7 CA LEU A 7 244.193 294.469 228.286 1.00 0.00 C +ATOM 8 CA LEU A 8 245.080 298.169 228.079 1.00 0.00 C +ATOM 9 CA SER A 9 247.540 300.960 227.258 1.00 0.00 C +ATOM 10 CA PRO A 10 251.245 301.040 226.371 1.00 0.00 C +ATOM 11 CA HIS A 11 253.084 299.013 223.721 1.00 0.00 C +ATOM 12 CA LEU A 12 252.223 296.163 221.343 1.00 0.00 C +ATOM 13 CA PRO A 13 250.907 293.197 223.340 1.00 0.00 C +ATOM 14 CA SER A 14 251.635 293.560 227.062 1.00 0.00 C +ATOM 15 CA SER A 15 253.419 290.820 229.018 1.00 0.00 C +ATOM 16 CA SER A 16 255.900 288.791 231.078 1.00 0.00 C +ATOM 17 CA ILE A 17 258.315 285.934 231.804 1.00 0.00 C +ATOM 18 CA SER A 18 261.560 283.939 231.805 1.00 0.00 C +ATOM 19 CA PRO A 19 263.522 280.752 232.519 1.00 0.00 C +ATOM 20 CA LEU A 20 266.844 280.243 230.725 1.00 0.00 C +ATOM 21 CA LEU A 21 269.094 278.690 233.378 1.00 0.00 C +ATOM 22 CA SER A 22 268.354 277.643 236.966 1.00 0.00 C +ATOM 23 CA PRO A 23 265.398 275.496 238.048 1.00 0.00 C +ATOM 24 CA GLY A 24 261.609 275.829 238.258 1.00 0.00 C +ATOM 25 CA ASP A 25 258.220 275.281 239.910 1.00 0.00 C +ATOM 26 CA GLY A 26 258.496 272.847 242.829 1.00 0.00 C +ATOM 27 CA GLU A 27 258.200 269.259 241.583 1.00 0.00 C +ATOM 28 CA ALA A 28 256.187 266.399 240.070 1.00 0.00 C +ATOM 29 CA ALA A 29 253.672 265.490 237.357 1.00 0.00 C +ATOM 30 CA ALA A 30 252.894 268.345 234.957 1.00 0.00 C +ATOM 31 CA ARG A 31 250.292 266.974 232.535 1.00 0.00 C +ATOM 32 CA GLY A 32 249.056 263.403 232.052 1.00 0.00 C +ATOM 33 CA GLY A 33 248.636 259.894 233.477 1.00 0.00 C +ATOM 34 CA ARG A 34 248.172 256.371 234.851 1.00 0.00 C +ATOM 35 CA LEU A 35 250.254 254.534 237.459 1.00 0.00 C +ATOM 36 CA PRO A 36 250.800 251.313 239.421 1.00 0.00 C +ATOM 37 CA ALA A 37 249.614 248.219 241.301 1.00 0.00 C +ATOM 38 CA GLY A 38 249.808 245.581 244.043 1.00 0.00 C +ATOM 39 CA GLU A 39 248.613 244.693 247.550 1.00 0.00 C +ATOM 40 CA GLU A 40 247.549 245.827 251.029 1.00 0.00 C +ATOM 41 CA GLY A 41 247.236 245.668 254.822 1.00 0.00 C +ATOM 42 CA ALA A 42 249.300 244.762 257.894 1.00 0.00 C +ATOM 43 CA ALA A 43 251.235 241.881 259.466 1.00 0.00 C +ATOM 44 CA GLN A 44 251.329 239.121 262.091 1.00 0.00 C +ATOM 45 CA PRO A 45 250.960 235.376 261.500 1.00 0.00 C +ATOM 46 CA GLY A 46 253.515 233.432 263.554 1.00 0.00 C +ATOM 47 CA ALA A 47 252.701 233.237 267.271 1.00 0.00 C +ATOM 48 CA ALA A 48 254.773 231.507 269.959 1.00 0.00 C +ATOM 49 CA TYR A 49 253.267 229.976 273.106 1.00 0.00 C +ATOM 50 CA GLY A 50 249.722 229.184 274.255 1.00 0.00 C +ATOM 51 CA GLY A 51 246.580 228.375 272.259 1.00 0.00 C +ATOM 52 CA SER A 52 243.663 227.707 274.617 1.00 0.00 C +ATOM 53 CA LEU A 53 242.097 230.301 276.927 1.00 0.00 C +ATOM 54 CA ALA A 54 240.943 232.121 280.069 1.00 0.00 C +ATOM 55 CA ARG A 55 240.994 232.470 283.862 1.00 0.00 C +ATOM 56 CA ARG A 56 240.414 229.145 285.630 1.00 0.00 C +ATOM 57 CA ARG A 57 242.729 229.223 288.655 1.00 0.00 C +ATOM 58 CA GLY A 58 243.470 232.589 290.278 1.00 0.00 C +ATOM 59 CA THR A 59 244.740 235.921 291.621 1.00 0.00 C +ATOM 60 CA GLY A 60 247.994 236.084 293.596 1.00 0.00 C +ATOM 61 CA ASN A 61 248.352 233.021 295.834 1.00 0.00 C +ATOM 62 CA GLU A 62 252.114 232.490 296.111 1.00 0.00 C +ATOM 63 CA GLY A 63 254.277 234.717 298.320 1.00 0.00 C +ATOM 64 CA GLU A 64 254.882 238.417 297.645 1.00 0.00 C +ATOM 65 CA GLU A 65 257.673 239.395 300.047 1.00 0.00 C +ATOM 66 CA GLY A 66 258.681 242.784 301.467 1.00 0.00 C +ATOM 67 CA GLU A 67 257.183 246.282 301.274 1.00 0.00 C +ATOM 68 CA GLY A 68 253.397 246.002 300.944 1.00 0.00 C +ATOM 69 CA SER A 69 250.487 246.371 298.513 1.00 0.00 C +ATOM 70 CA SER A 70 250.902 247.344 294.853 1.00 0.00 C +ATOM 71 CA MET A 71 253.308 244.906 293.185 1.00 0.00 C +ATOM 72 CA GLY A 72 256.659 243.309 292.326 1.00 0.00 C +ATOM 73 CA GLY A 73 258.076 242.247 288.953 1.00 0.00 C +ATOM 74 CA GLY A 74 258.898 238.726 287.749 1.00 0.00 C +ATOM 75 CA GLY A 75 262.454 237.812 286.734 1.00 0.00 C +ATOM 76 CA PHE A 76 264.780 234.918 285.877 1.00 0.00 C +ATOM 77 CA GLY A 77 264.987 233.796 282.242 1.00 0.00 C +ATOM 78 CA GLU A 78 265.557 233.518 278.485 1.00 0.00 C +ATOM 79 CA GLY A 79 262.874 231.256 277.000 1.00 0.00 C +ATOM 80 CA LEU A 80 259.514 231.292 275.205 1.00 0.00 C +ATOM 81 CA ALA A 81 258.955 234.927 274.212 1.00 0.00 C +ATOM 82 CA ALA A 82 258.780 237.808 271.725 1.00 0.00 C +ATOM 83 CA ALA A 83 258.091 239.405 268.335 1.00 0.00 C +ATOM 84 CA GLY A 84 255.263 241.835 267.556 1.00 0.00 C +ATOM 85 CA SER A 85 252.292 244.211 267.777 1.00 0.00 C +ATOM 86 CA SER A 86 249.409 245.104 270.102 1.00 0.00 C +ATOM 87 CA VAL A 87 246.697 247.646 270.939 1.00 0.00 C +ATOM 88 CA VAL A 88 246.140 247.412 274.701 1.00 0.00 C +ATOM 89 CA ALA A 89 248.025 247.078 277.995 1.00 0.00 C +ATOM 90 CA GLY A 90 247.902 248.859 281.360 1.00 0.00 C +ATOM 91 CA MET A 91 251.092 248.085 283.294 1.00 0.00 C +ATOM 92 CA GLU A 92 253.833 245.798 281.963 1.00 0.00 C +ATOM 93 CA VAL A 93 255.693 242.963 280.224 1.00 0.00 C +ATOM 94 CA ARG A 94 253.421 240.595 278.288 1.00 0.00 C +ATOM 95 CA SER A 95 251.753 237.256 279.051 1.00 0.00 C +ATOM 96 CA ALA A 96 248.395 235.467 279.257 1.00 0.00 C +ATOM 97 CA ARG A 97 247.124 234.984 275.698 1.00 0.00 C +ATOM 98 CA GLY A 98 244.522 235.638 272.993 1.00 0.00 C +ATOM 99 CA GLY A 99 242.557 234.965 269.799 1.00 0.00 C +ATOM 100 CA THR A 100 244.928 235.578 266.880 1.00 0.00 C +ATOM 101 CA GLU A 101 244.935 238.875 264.971 1.00 0.00 C +ATOM 102 CA ARG A 102 242.819 239.858 261.959 1.00 0.00 C +ATOM 103 CA SER A 103 242.069 238.205 258.609 1.00 0.00 C +ATOM 104 CA ALA A 104 241.749 238.704 254.846 1.00 0.00 C +ATOM 105 CA ARG A 105 240.276 240.161 251.648 1.00 0.00 C +ATOM 106 CA ARG A 106 242.079 242.381 249.131 1.00 0.00 C +ATOM 107 CA GLN A 107 241.504 245.546 247.089 1.00 0.00 C +ATOM 108 CA GLN A 108 238.444 245.709 244.825 1.00 0.00 C +ATOM 109 CA HIS A 109 237.972 243.687 241.630 1.00 0.00 C +ATOM 110 CA ARG A 110 240.508 240.929 240.938 1.00 0.00 C +ATOM 111 CA PRO A 111 243.113 238.554 242.383 1.00 0.00 C +ATOM 112 CA GLY A 112 245.423 235.954 243.936 1.00 0.00 C +ATOM 113 CA ALA A 113 247.121 232.837 242.550 1.00 0.00 C +ATOM 114 CA VAL A 114 247.563 230.876 239.313 1.00 0.00 C +ATOM 115 CA ALA A 115 247.324 231.634 235.587 1.00 0.00 C +ATOM 116 CA ARG A 116 248.491 233.833 232.703 1.00 0.00 C +ATOM 117 CA GLN A 117 247.485 236.064 229.782 1.00 0.00 C +ATOM 118 CA CYS A 118 249.274 235.043 226.577 1.00 0.00 C +ATOM 119 CA ALA A 119 251.844 236.587 224.226 1.00 0.00 C +ATOM 120 CA ALA A 120 255.334 236.928 225.717 1.00 0.00 C +ATOM 121 CA ARG A 121 258.084 236.703 228.344 1.00 0.00 C +ATOM 122 CA LYS A 122 261.660 235.871 227.327 1.00 0.00 C +ATOM 123 CA TRP A 123 262.070 233.950 224.062 1.00 0.00 C +ATOM 124 CA ARG A 124 258.864 233.409 222.075 1.00 0.00 C +ATOM 125 CA MET A 125 256.434 231.190 220.153 1.00 0.00 C +ATOM 126 CA GLY A 126 252.943 232.632 219.652 1.00 0.00 C +ATOM 127 CA GLU A 127 251.139 231.399 216.531 1.00 0.00 C +ATOM 128 CA GLU A 128 249.863 231.786 212.963 1.00 0.00 C +ATOM 129 CA SER A 129 250.167 234.868 210.743 1.00 0.00 C +ATOM 130 CA GLY A 130 249.913 237.634 208.135 1.00 0.00 C +ATOM 131 CA ALA A 131 247.774 239.898 205.941 1.00 0.00 C +ATOM 132 CA ALA A 132 247.820 243.272 204.171 1.00 0.00 C +ATOM 133 CA PRO A 133 249.101 246.796 203.495 1.00 0.00 C +ATOM 134 CA GLY A 134 250.719 247.844 206.781 1.00 0.00 C +ATOM 135 CA ARG A 135 248.776 250.123 209.137 1.00 0.00 C +ATOM 136 CA GLY A 136 248.550 249.498 212.888 1.00 0.00 C +ATOM 137 CA GLY A 137 248.740 252.404 215.345 1.00 0.00 C +ATOM 138 CA ARG A 138 250.135 254.963 217.799 1.00 0.00 C +ATOM 139 CA GLU A 139 251.071 256.972 220.897 1.00 0.00 C +ATOM 140 CA GLY A 140 251.848 254.634 223.803 1.00 0.00 C +ATOM 141 CA GLU A 141 255.640 254.565 224.170 1.00 0.00 C +ATOM 142 CA LEU A 142 258.038 252.002 222.689 1.00 0.00 C +ATOM 143 CA HIS A 143 258.263 248.584 224.356 1.00 0.00 C +ATOM 144 CA GLY A 144 254.732 247.785 225.543 1.00 0.00 C +ATOM 145 CA ALA A 145 251.984 249.100 227.831 1.00 0.00 C +ATOM 146 CA ALA A 146 248.547 249.083 229.475 1.00 0.00 C +ATOM 147 CA VAL A 147 244.969 250.369 229.717 1.00 0.00 C +ATOM 148 CA ASP A 148 242.443 249.792 232.511 1.00 0.00 C +ATOM 149 CA TRP A 149 239.627 248.939 234.931 1.00 0.00 C +ATOM 150 CA GLU A 150 237.777 250.123 238.044 1.00 0.00 C +ATOM 151 CA GLY A 151 235.258 251.616 240.481 1.00 0.00 C +ATOM 152 CA ARG A 152 231.513 252.163 240.924 1.00 0.00 C +ATOM 153 CA ARG A 153 228.138 252.311 242.685 1.00 0.00 C +ATOM 154 CA SER A 154 225.535 255.073 242.349 1.00 0.00 C +ATOM 155 CA GLY A 155 224.670 255.074 238.639 1.00 0.00 C +ATOM 156 CA GLY A 156 222.086 257.215 236.836 1.00 0.00 C +ATOM 157 CA LEU A 157 218.383 256.405 237.225 1.00 0.00 C +ATOM 158 CA ASP A 158 214.670 256.362 238.076 1.00 0.00 C +TER 159 ASP A 158 +END diff --git a/Plants/Q8LI09/Q8LI09.dcd b/Plants/Q8LI09/Q8LI09.dcd new file mode 100644 index 0000000000000000000000000000000000000000..861e8455ed1e5fa05ec5f3e020dc627600c7d241 --- /dev/null +++ b/Plants/Q8LI09/Q8LI09.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f8cbde3185c76caef25e627a68f91019782622eedeab8a38c3c7c69abc20d83c +size 12920276 diff --git a/Plants/Q8LI09/top.pdb b/Plants/Q8LI09/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..5d996243adce63689fba8e2f32c3eff8d970cc01 --- /dev/null +++ b/Plants/Q8LI09/top.pdb @@ -0,0 +1,105 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 246.521 239.358 258.765 1.00 0.00 C +ATOM 2 CA VAL A 2 243.768 239.629 256.145 1.00 0.00 C +ATOM 3 CA PHE A 3 241.472 242.533 255.247 1.00 0.00 C +ATOM 4 CA PRO A 4 241.586 246.274 254.533 1.00 0.00 C +ATOM 5 CA ASP A 5 243.660 248.957 256.270 1.00 0.00 C +ATOM 6 CA ALA A 6 245.717 251.940 257.448 1.00 0.00 C +ATOM 7 CA ALA A 7 249.234 251.121 258.662 1.00 0.00 C +ATOM 8 CA HIS A 8 252.521 250.248 256.945 1.00 0.00 C +ATOM 9 CA LEU A 9 254.210 253.017 254.945 1.00 0.00 C +ATOM 10 CA GLY A 10 252.736 254.742 251.884 1.00 0.00 C +ATOM 11 CA ARG A 11 250.930 258.074 251.492 1.00 0.00 C +ATOM 12 CA VAL A 12 253.603 260.789 251.537 1.00 0.00 C +ATOM 13 CA GLN A 13 253.732 264.595 251.660 1.00 0.00 C +ATOM 14 CA GLU A 14 255.221 266.631 248.804 1.00 0.00 C +ATOM 15 CA GLY A 15 254.456 270.307 248.160 1.00 0.00 C +ATOM 16 CA ARG A 16 253.842 274.067 248.165 1.00 0.00 C +ATOM 17 CA ASP A 17 252.203 277.259 246.882 1.00 0.00 C +ATOM 18 CA ARG A 18 250.394 277.116 243.532 1.00 0.00 C +ATOM 19 CA GLU A 19 246.669 276.484 243.036 1.00 0.00 C +ATOM 20 CA GLU A 20 245.159 273.190 241.860 1.00 0.00 C +ATOM 21 CA ASP A 21 244.262 270.162 243.992 1.00 0.00 C +ATOM 22 CA GLY A 22 243.938 266.510 245.029 1.00 0.00 C +ATOM 23 CA ARG A 23 245.963 265.075 247.921 1.00 0.00 C +ATOM 24 CA ASN A 24 247.655 261.767 247.075 1.00 0.00 C +ATOM 25 CA GLY A 25 246.372 258.189 247.335 1.00 0.00 C +ATOM 26 CA GLU A 26 244.898 255.147 245.579 1.00 0.00 C +ATOM 27 CA TYR A 27 243.421 252.627 243.132 1.00 0.00 C +ATOM 28 CA ASN A 28 241.498 254.119 240.201 1.00 0.00 C +ATOM 29 CA ASN A 29 241.586 254.609 236.423 1.00 0.00 C +ATOM 30 CA ASP A 30 244.342 252.418 234.967 1.00 0.00 C +ATOM 31 CA GLY A 31 248.001 253.303 235.552 1.00 0.00 C +ATOM 32 CA GLY A 32 250.286 252.794 232.546 1.00 0.00 C +ATOM 33 CA GLY A 33 250.817 249.857 230.178 1.00 0.00 C +ATOM 34 CA ALA A 34 248.098 247.680 228.635 1.00 0.00 C +ATOM 35 CA LYS A 35 249.287 244.085 228.210 1.00 0.00 C +ATOM 36 CA LEU A 36 251.122 240.770 228.614 1.00 0.00 C +ATOM 37 CA TRP A 37 251.838 240.389 232.336 1.00 0.00 C +ATOM 38 CA ALA A 38 250.207 237.381 234.011 1.00 0.00 C +ATOM 39 CA MET A 39 249.155 234.689 236.493 1.00 0.00 C +ATOM 40 CA ALA A 40 250.107 231.865 238.867 1.00 0.00 C +ATOM 41 CA ALA A 41 247.371 230.087 240.834 1.00 0.00 C +ATOM 42 CA GLN A 42 243.698 230.633 241.687 1.00 0.00 C +ATOM 43 CA SER A 43 241.168 232.558 243.787 1.00 0.00 C +ATOM 44 CA HIS A 44 242.328 236.185 243.652 1.00 0.00 C +ATOM 45 CA GLY A 45 242.952 238.616 240.786 1.00 0.00 C +ATOM 46 CA ASN A 46 244.597 241.864 239.664 1.00 0.00 C +ATOM 47 CA GLY A 47 244.051 245.433 240.882 1.00 0.00 C +ATOM 48 CA GLY A 48 241.063 245.737 243.226 1.00 0.00 C +ATOM 49 CA GLY A 49 242.046 246.170 246.882 1.00 0.00 C +ATOM 50 CA GLY A 50 243.488 248.690 249.349 1.00 0.00 C +ATOM 51 CA VAL A 51 247.010 249.493 248.140 1.00 0.00 C +ATOM 52 CA ARG A 52 248.097 248.915 244.534 1.00 0.00 C +ATOM 53 CA VAL A 53 251.493 247.205 244.779 1.00 0.00 C +ATOM 54 CA ARG A 54 252.264 244.756 241.964 1.00 0.00 C +ATOM 55 CA HIS A 55 252.641 241.186 243.240 1.00 0.00 C +ATOM 56 CA ALA A 56 252.318 240.868 247.023 1.00 0.00 C +ATOM 57 CA ARG A 57 255.032 239.934 249.528 1.00 0.00 C +ATOM 58 CA PRO A 58 255.108 237.344 252.322 1.00 0.00 C +ATOM 59 CA GLN A 59 254.498 234.666 254.962 1.00 0.00 C +ATOM 60 CA GLU A 60 251.233 235.067 256.883 1.00 0.00 C +ATOM 61 CA GLU A 61 248.323 233.762 254.798 1.00 0.00 C +ATOM 62 CA GLU A 62 249.448 232.930 251.254 1.00 0.00 C +ATOM 63 CA ALA A 63 252.830 231.839 249.881 1.00 0.00 C +ATOM 64 CA ALA A 64 256.505 231.161 249.140 1.00 0.00 C +ATOM 65 CA SER A 65 259.709 230.742 251.158 1.00 0.00 C +ATOM 66 CA ALA A 66 260.269 227.260 252.600 1.00 0.00 C +ATOM 67 CA MET A 67 262.942 224.563 252.287 1.00 0.00 C +ATOM 68 CA GLY A 68 266.121 223.869 250.305 1.00 0.00 C +ATOM 69 CA ARG A 69 268.682 226.001 248.457 1.00 0.00 C +ATOM 70 CA PHE A 70 267.948 229.703 248.979 1.00 0.00 C +ATOM 71 CA GLY A 71 266.883 233.068 247.545 1.00 0.00 C +ATOM 72 CA PRO A 72 268.988 235.661 249.378 1.00 0.00 C +ATOM 73 CA ALA A 73 271.432 238.093 251.000 1.00 0.00 C +ATOM 74 CA ARG A 74 274.036 239.783 248.791 1.00 0.00 C +ATOM 75 CA LEU A 75 272.445 242.799 247.091 1.00 0.00 C +ATOM 76 CA SER A 76 270.454 246.042 246.910 1.00 0.00 C +ATOM 77 CA GLY A 77 270.681 248.304 249.967 1.00 0.00 C +ATOM 78 CA ALA A 78 272.765 251.179 251.349 1.00 0.00 C +ATOM 79 CA GLY A 79 271.531 253.625 253.996 1.00 0.00 C +ATOM 80 CA SER A 80 268.517 252.669 256.122 1.00 0.00 C +ATOM 81 CA PRO A 81 267.892 255.457 258.643 1.00 0.00 C +ATOM 82 CA LYS A 82 265.077 258.014 258.405 1.00 0.00 C +ATOM 83 CA GLY A 83 262.147 260.278 259.300 1.00 0.00 C +ATOM 84 CA ARG A 84 258.343 260.069 259.282 1.00 0.00 C +ATOM 85 CA ARG A 85 256.292 262.055 256.759 1.00 0.00 C +ATOM 86 CA LYS A 86 252.736 262.755 257.934 1.00 0.00 C +ATOM 87 CA GLU A 87 249.339 262.773 259.660 1.00 0.00 C +ATOM 88 CA ARG A 88 247.602 262.961 263.045 1.00 0.00 C +ATOM 89 CA ARG A 89 246.259 260.936 265.981 1.00 0.00 C +ATOM 90 CA ASN A 90 243.206 261.369 268.219 1.00 0.00 C +ATOM 91 CA GLY A 91 239.668 262.380 267.232 1.00 0.00 C +ATOM 92 CA PRO A 92 236.073 261.835 266.093 1.00 0.00 C +ATOM 93 CA ASN A 93 232.856 262.520 268.017 1.00 0.00 C +ATOM 94 CA GLU A 94 231.970 266.224 268.103 1.00 0.00 C +ATOM 95 CA GLY A 95 229.201 267.330 265.731 1.00 0.00 C +ATOM 96 CA PHE A 96 226.441 268.663 263.469 1.00 0.00 C +ATOM 97 CA PHE A 97 223.214 267.199 264.868 1.00 0.00 C +ATOM 98 CA ALA A 98 223.846 264.096 266.986 1.00 0.00 C +ATOM 99 CA GLN A 99 224.597 260.362 267.080 1.00 0.00 C +ATOM 100 CA ASN A 100 224.962 256.972 265.380 1.00 0.00 C +ATOM 101 CA GLU A 101 224.832 257.526 261.612 1.00 0.00 C +TER 102 GLU A 101 +END diff --git a/Plants/Q8LI54/Q8LI54.dcd b/Plants/Q8LI54/Q8LI54.dcd new file mode 100644 index 0000000000000000000000000000000000000000..cee88674e967b01d30e67a850c7e7772862e61ca --- /dev/null +++ b/Plants/Q8LI54/Q8LI54.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:ec997c1787e679e10d8bb82baaf08f6f0c8abcf38b846b4fd431b44d2481045b +size 8480276 diff --git a/Plants/Q8LI54/top.pdb b/Plants/Q8LI54/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..8b3d9fb8bbf198a3c1a3010abe3dcb1508c92d8a --- /dev/null +++ b/Plants/Q8LI54/top.pdb @@ -0,0 +1,68 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 218.003 243.259 268.967 1.00 0.00 C +ATOM 2 CA LYS A 2 216.740 239.753 268.174 1.00 0.00 C +ATOM 3 CA GLY A 3 217.939 236.882 265.974 1.00 0.00 C +ATOM 4 CA GLU A 4 221.602 237.117 264.954 1.00 0.00 C +ATOM 5 CA GLU A 5 223.937 235.976 267.741 1.00 0.00 C +ATOM 6 CA GLU A 6 223.438 232.379 268.892 1.00 0.00 C +ATOM 7 CA GLY A 7 226.311 229.905 268.516 1.00 0.00 C +ATOM 8 CA GLU A 8 229.367 228.442 266.774 1.00 0.00 C +ATOM 9 CA ASN A 9 232.982 228.706 267.948 1.00 0.00 C +ATOM 10 CA LYS A 10 235.379 231.383 269.215 1.00 0.00 C +ATOM 11 CA GLU A 11 238.115 232.663 266.893 1.00 0.00 C +ATOM 12 CA ASN A 12 240.441 235.655 266.498 1.00 0.00 C +ATOM 13 CA GLU A 13 241.179 236.109 262.788 1.00 0.00 C +ATOM 14 CA GLY A 14 241.450 236.121 258.987 1.00 0.00 C +ATOM 15 CA LEU A 15 241.515 238.134 255.754 1.00 0.00 C +ATOM 16 CA LYS A 16 243.988 241.006 255.362 1.00 0.00 C +ATOM 17 CA LYS A 17 247.116 239.393 253.902 1.00 0.00 C +ATOM 18 CA GLY A 18 246.019 236.593 251.563 1.00 0.00 C +ATOM 19 CA GLU A 19 248.246 235.840 248.565 1.00 0.00 C +ATOM 20 CA GLY A 20 249.922 238.867 246.969 1.00 0.00 C +ATOM 21 CA ASP A 21 252.120 241.801 248.007 1.00 0.00 C +ATOM 22 CA GLU A 22 252.040 245.400 246.758 1.00 0.00 C +ATOM 23 CA SER A 23 251.402 248.643 248.653 1.00 0.00 C +ATOM 24 CA PRO A 24 248.495 249.188 251.054 1.00 0.00 C +ATOM 25 CA LEU A 25 248.365 247.415 254.424 1.00 0.00 C +ATOM 26 CA GLN A 26 245.640 247.126 257.071 1.00 0.00 C +ATOM 27 CA SER A 27 246.160 249.718 259.815 1.00 0.00 C +ATOM 28 CA GLY A 28 248.997 252.193 260.397 1.00 0.00 C +ATOM 29 CA SER A 29 249.336 255.020 257.865 1.00 0.00 C +ATOM 30 CA GLY A 30 247.358 253.876 254.816 1.00 0.00 C +ATOM 31 CA SER A 31 244.827 255.237 252.314 1.00 0.00 C +ATOM 32 CA ALA A 32 245.521 258.391 250.292 1.00 0.00 C +ATOM 33 CA PRO A 33 247.558 257.521 247.192 1.00 0.00 C +ATOM 34 CA VAL A 34 250.894 257.144 245.390 1.00 0.00 C +ATOM 35 CA TYR A 35 250.774 254.002 243.239 1.00 0.00 C +ATOM 36 CA GLU A 36 250.406 252.092 239.963 1.00 0.00 C +ATOM 37 CA GLY A 37 252.549 250.729 237.123 1.00 0.00 C +ATOM 38 CA GLY A 38 252.247 251.201 233.354 1.00 0.00 C +ATOM 39 CA GLY A 39 255.133 252.098 231.033 1.00 0.00 C +ATOM 40 CA GLY A 40 257.312 255.039 232.090 1.00 0.00 C +ATOM 41 CA GLU A 41 260.474 256.930 231.122 1.00 0.00 C +ATOM 42 CA SER A 42 263.793 255.306 230.193 1.00 0.00 C +ATOM 43 CA SER A 43 267.270 256.853 230.387 1.00 0.00 C +ATOM 44 CA HIS A 44 267.489 260.284 232.030 1.00 0.00 C +ATOM 45 CA PRO A 45 266.113 263.285 233.931 1.00 0.00 C +ATOM 46 CA ARG A 46 266.763 265.301 237.098 1.00 0.00 C +ATOM 47 CA VAL A 47 267.617 268.421 239.111 1.00 0.00 C +ATOM 48 CA SER A 48 266.877 271.096 241.721 1.00 0.00 C +ATOM 49 CA GLY A 49 263.138 271.804 241.895 1.00 0.00 C +ATOM 50 CA ASP A 50 260.461 269.513 243.345 1.00 0.00 C +ATOM 51 CA ARG A 51 260.493 265.747 243.921 1.00 0.00 C +ATOM 52 CA ALA A 52 262.064 263.820 241.034 1.00 0.00 C +ATOM 53 CA PRO A 53 263.458 260.284 240.762 1.00 0.00 C +ATOM 54 CA GLN A 54 264.152 257.797 237.960 1.00 0.00 C +ATOM 55 CA ASN A 55 261.578 255.219 236.843 1.00 0.00 C +ATOM 56 CA SER A 56 258.368 255.656 238.848 1.00 0.00 C +ATOM 57 CA ARG A 57 256.734 253.166 241.224 1.00 0.00 C +ATOM 58 CA ASP A 58 256.788 253.414 245.026 1.00 0.00 C +ATOM 59 CA GLY A 59 259.902 253.476 247.220 1.00 0.00 C +ATOM 60 CA GLY A 60 262.042 254.122 250.306 1.00 0.00 C +ATOM 61 CA GLY A 61 263.987 256.289 252.763 1.00 0.00 C +ATOM 62 CA ASP A 62 263.853 259.647 254.558 1.00 0.00 C +ATOM 63 CA ARG A 63 266.784 262.002 255.173 1.00 0.00 C +ATOM 64 CA ASN A 64 268.974 262.550 258.243 1.00 0.00 C +TER 65 ASN A 64 +END diff --git a/Plants/Q8LIJ3/Q8LIJ3.dcd b/Plants/Q8LIJ3/Q8LIJ3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..38a61f808b5fc386892bdd0bcd92e1385d0153b3 --- /dev/null +++ b/Plants/Q8LIJ3/Q8LIJ3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5fb4c2ada53f2682f0489657cf8d5395701333c41d37a21c95d424cd2357e15a +size 15560276 diff --git a/Plants/Q8LIJ3/top.pdb b/Plants/Q8LIJ3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..c2404a16fff3de73e46fb6bbdaa66aa33556d308 --- /dev/null +++ b/Plants/Q8LIJ3/top.pdb @@ -0,0 +1,127 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 221.133 260.946 228.140 1.00 0.00 C +ATOM 2 CA ARG A 2 218.165 262.602 226.419 1.00 0.00 C +ATOM 3 CA CYS A 3 215.595 264.486 224.331 1.00 0.00 C +ATOM 4 CA GLY A 4 211.959 264.690 225.451 1.00 0.00 C +ATOM 5 CA CYS A 5 209.569 266.937 223.513 1.00 0.00 C +ATOM 6 CA LEU A 6 208.829 270.132 225.453 1.00 0.00 C +ATOM 7 CA SER A 7 210.612 273.125 226.996 1.00 0.00 C +ATOM 8 CA ARG A 8 208.228 276.089 227.214 1.00 0.00 C +ATOM 9 CA PRO A 9 208.189 278.027 230.494 1.00 0.00 C +ATOM 10 CA LYS A 10 209.292 276.243 233.675 1.00 0.00 C +ATOM 11 CA ILE A 11 210.982 275.527 237.014 1.00 0.00 C +ATOM 12 CA LYS A 12 210.293 273.699 240.285 1.00 0.00 C +ATOM 13 CA ARG A 13 207.490 272.368 242.494 1.00 0.00 C +ATOM 14 CA LYS A 14 204.407 272.474 240.257 1.00 0.00 C +ATOM 15 CA VAL A 15 205.368 271.437 236.719 1.00 0.00 C +ATOM 16 CA SER A 16 207.523 270.182 233.839 1.00 0.00 C +ATOM 17 CA LYS A 17 206.963 266.427 233.515 1.00 0.00 C +ATOM 18 CA LYS A 18 209.392 264.744 235.921 1.00 0.00 C +ATOM 19 CA ILE A 19 212.604 265.018 237.951 1.00 0.00 C +ATOM 20 CA PRO A 20 216.274 263.996 237.974 1.00 0.00 C +ATOM 21 CA LYS A 21 219.866 263.222 238.982 1.00 0.00 C +ATOM 22 CA LYS A 22 222.066 265.177 241.402 1.00 0.00 C +ATOM 23 CA SER A 23 221.547 268.951 241.468 1.00 0.00 C +ATOM 24 CA GLU A 24 221.547 272.167 239.426 1.00 0.00 C +ATOM 25 CA THR A 25 224.407 274.454 238.372 1.00 0.00 C +ATOM 26 CA LEU A 26 227.831 273.135 237.347 1.00 0.00 C +ATOM 27 CA ALA A 27 230.402 270.793 235.791 1.00 0.00 C +ATOM 28 CA GLY A 28 230.586 267.017 235.317 1.00 0.00 C +ATOM 29 CA PRO A 29 229.559 265.103 238.447 1.00 0.00 C +ATOM 30 CA ALA A 30 229.763 261.299 238.433 1.00 0.00 C +ATOM 31 CA SER A 31 229.598 257.508 238.777 1.00 0.00 C +ATOM 32 CA SER A 32 227.619 255.222 241.097 1.00 0.00 C +ATOM 33 CA GLY A 33 228.488 252.674 243.792 1.00 0.00 C +ATOM 34 CA ARG A 34 231.742 250.902 244.681 1.00 0.00 C +ATOM 35 CA HIS A 35 234.691 252.597 246.397 1.00 0.00 C +ATOM 36 CA HIS A 36 235.469 253.601 249.989 1.00 0.00 C +ATOM 37 CA HIS A 37 237.911 252.766 252.791 1.00 0.00 C +ATOM 38 CA SER A 38 238.101 248.988 253.252 1.00 0.00 C +ATOM 39 CA CYS A 39 240.796 246.771 251.722 1.00 0.00 C +ATOM 40 CA ALA A 40 244.062 244.826 251.465 1.00 0.00 C +ATOM 41 CA ARG A 41 244.667 241.083 251.839 1.00 0.00 C +ATOM 42 CA ALA A 42 241.460 239.070 252.258 1.00 0.00 C +ATOM 43 CA SER A 43 240.312 239.825 255.812 1.00 0.00 C +ATOM 44 CA SER A 44 237.443 239.504 258.299 1.00 0.00 C +ATOM 45 CA SER A 45 234.857 238.895 261.029 1.00 0.00 C +ATOM 46 CA PRO A 46 236.307 236.773 263.842 1.00 0.00 C +ATOM 47 CA SER A 47 238.402 234.238 265.766 1.00 0.00 C +ATOM 48 CA PRO A 48 241.713 236.025 266.363 1.00 0.00 C +ATOM 49 CA LYS A 49 243.654 239.017 265.022 1.00 0.00 C +ATOM 50 CA HIS A 50 244.869 242.540 264.230 1.00 0.00 C +ATOM 51 CA SER A 51 243.938 245.721 262.350 1.00 0.00 C +ATOM 52 CA LEU A 52 246.363 246.767 259.604 1.00 0.00 C +ATOM 53 CA LEU A 53 248.543 249.601 260.921 1.00 0.00 C +ATOM 54 CA SER A 54 251.830 248.210 262.253 1.00 0.00 C +ATOM 55 CA GLU A 55 254.853 250.002 260.781 1.00 0.00 C +ATOM 56 CA SER A 56 256.588 248.576 257.704 1.00 0.00 C +ATOM 57 CA SER A 57 260.192 247.420 258.144 1.00 0.00 C +ATOM 58 CA VAL A 58 263.267 248.299 260.214 1.00 0.00 C +ATOM 59 CA VAL A 59 266.798 249.676 259.824 1.00 0.00 C +ATOM 60 CA SER A 60 270.371 250.999 259.855 1.00 0.00 C +ATOM 61 CA MET A 61 272.736 253.516 258.248 1.00 0.00 C +ATOM 62 CA ARG A 62 275.409 256.165 257.651 1.00 0.00 C +ATOM 63 CA VAL A 63 274.756 259.518 259.338 1.00 0.00 C +ATOM 64 CA GLY A 64 276.450 260.655 262.556 1.00 0.00 C +ATOM 65 CA SER A 65 278.240 259.446 265.694 1.00 0.00 C +ATOM 66 CA ARG A 66 277.134 256.038 266.989 1.00 0.00 C +ATOM 67 CA GLY A 67 275.571 252.717 268.011 1.00 0.00 C +ATOM 68 CA GLY A 68 273.912 249.295 268.238 1.00 0.00 C +ATOM 69 CA GLY A 69 270.650 247.664 267.133 1.00 0.00 C +ATOM 70 CA ILE A 70 269.886 246.223 263.690 1.00 0.00 C +ATOM 71 CA ARG A 71 271.730 244.786 260.682 1.00 0.00 C +ATOM 72 CA VAL A 72 274.940 244.346 258.676 1.00 0.00 C +ATOM 73 CA GLY A 73 275.899 240.886 257.403 1.00 0.00 C +ATOM 74 CA GLU A 74 275.574 237.097 257.646 1.00 0.00 C +ATOM 75 CA GLY A 75 278.457 234.759 256.787 1.00 0.00 C +ATOM 76 CA GLN A 76 279.228 232.475 253.837 1.00 0.00 C +ATOM 77 CA PRO A 77 280.928 229.296 252.603 1.00 0.00 C +ATOM 78 CA ALA A 78 283.720 226.729 252.239 1.00 0.00 C +ATOM 79 CA GLY A 79 283.371 222.964 251.772 1.00 0.00 C +ATOM 80 CA SER A 80 279.727 222.208 250.957 1.00 0.00 C +ATOM 81 CA THR A 81 276.138 221.240 251.792 1.00 0.00 C +ATOM 82 CA VAL A 82 272.353 221.505 252.133 1.00 0.00 C +ATOM 83 CA ALA A 83 271.094 217.962 251.516 1.00 0.00 C +ATOM 84 CA GLU A 84 268.606 215.986 253.618 1.00 0.00 C +ATOM 85 CA LEU A 85 267.850 213.253 256.163 1.00 0.00 C +ATOM 86 CA THR A 86 266.143 211.914 259.295 1.00 0.00 C +ATOM 87 CA ALA A 87 266.000 214.514 262.077 1.00 0.00 C +ATOM 88 CA GLU A 88 269.276 216.439 261.800 1.00 0.00 C +ATOM 89 CA SER A 89 269.580 220.169 261.083 1.00 0.00 C +ATOM 90 CA THR A 90 272.521 222.583 260.879 1.00 0.00 C +ATOM 91 CA VAL A 91 271.890 226.099 259.554 1.00 0.00 C +ATOM 92 CA ALA A 92 272.590 229.658 258.388 1.00 0.00 C +ATOM 93 CA SER A 93 273.098 232.184 261.196 1.00 0.00 C +ATOM 94 CA SER A 94 270.048 234.463 261.063 1.00 0.00 C +ATOM 95 CA THR A 95 268.874 238.036 260.458 1.00 0.00 C +ATOM 96 CA PRO A 96 266.670 240.232 258.259 1.00 0.00 C +ATOM 97 CA LEU A 97 266.354 243.250 255.955 1.00 0.00 C +ATOM 98 CA ASP A 98 267.687 244.760 252.720 1.00 0.00 C +ATOM 99 CA PRO A 99 269.982 247.546 251.503 1.00 0.00 C +ATOM 100 CA PRO A 100 272.011 250.391 249.984 1.00 0.00 C +ATOM 101 CA PRO A 101 272.811 253.583 251.905 1.00 0.00 C +ATOM 102 CA SER A 102 269.892 256.015 252.183 1.00 0.00 C +ATOM 103 CA SER A 103 267.256 258.765 252.275 1.00 0.00 C +ATOM 104 CA LEU A 104 263.797 258.069 253.713 1.00 0.00 C +ATOM 105 CA PRO A 105 261.059 257.266 256.237 1.00 0.00 C +ATOM 106 CA SER A 106 259.548 260.585 257.341 1.00 0.00 C +ATOM 107 CA THR A 107 256.566 262.905 256.854 1.00 0.00 C +ATOM 108 CA ASP A 108 253.007 263.686 255.740 1.00 0.00 C +ATOM 109 CA LEU A 109 251.115 260.458 255.020 1.00 0.00 C +ATOM 110 CA PRO A 110 250.011 259.015 251.671 1.00 0.00 C +ATOM 111 CA THR A 111 250.884 255.626 250.165 1.00 0.00 C +ATOM 112 CA THR A 112 251.258 251.852 250.528 1.00 0.00 C +ATOM 113 CA ARG A 113 252.388 248.633 248.830 1.00 0.00 C +ATOM 114 CA SER A 114 255.515 249.430 246.805 1.00 0.00 C +ATOM 115 CA SER A 115 257.841 246.432 246.463 1.00 0.00 C +ATOM 116 CA ALA A 116 261.074 247.773 244.957 1.00 0.00 C +ATOM 117 CA ALA A 117 264.611 248.164 243.598 1.00 0.00 C +ATOM 118 CA ALA A 118 265.968 247.132 240.190 1.00 0.00 C +ATOM 119 CA LEU A 119 269.020 248.612 238.454 1.00 0.00 C +ATOM 120 CA PRO A 120 271.693 251.279 238.963 1.00 0.00 C +ATOM 121 CA THR A 121 274.361 253.993 239.133 1.00 0.00 C +ATOM 122 CA VAL A 122 277.488 255.588 237.651 1.00 0.00 C +ATOM 123 CA ARG A 123 280.411 257.608 239.026 1.00 0.00 C +TER 124 ARG A 123 +END diff --git a/Plants/Q8LIZ5/Q8LIZ5.dcd b/Plants/Q8LIZ5/Q8LIZ5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..00f8db23932a9a337ac4705cb72dde6ed9a2dcf5 --- /dev/null +++ b/Plants/Q8LIZ5/Q8LIZ5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:4b7e00b85e2424cb75407394249b1f19f09b9055d9b73e86613bfb303332d8a5 +size 17600276 diff --git a/Plants/Q8LIZ5/top.pdb b/Plants/Q8LIZ5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..70d756358b683d0aee5a71fbed608f1ee9ab50f1 --- /dev/null +++ b/Plants/Q8LIZ5/top.pdb @@ -0,0 +1,144 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 255.614 196.810 292.679 1.00 0.00 C +ATOM 2 CA ARG A 2 255.869 195.300 289.190 1.00 0.00 C +ATOM 3 CA ARG A 3 256.300 195.737 285.430 1.00 0.00 C +ATOM 4 CA ALA A 4 256.392 192.719 283.107 1.00 0.00 C +ATOM 5 CA HIS A 5 257.290 191.952 279.484 1.00 0.00 C +ATOM 6 CA ALA A 6 258.426 195.070 277.612 1.00 0.00 C +ATOM 7 CA GLN A 7 255.558 196.119 275.334 1.00 0.00 C +ATOM 8 CA PRO A 8 256.686 197.105 271.831 1.00 0.00 C +ATOM 9 CA HIS A 9 254.456 197.068 268.742 1.00 0.00 C +ATOM 10 CA GLY A 10 253.913 193.962 266.603 1.00 0.00 C +ATOM 11 CA SER A 11 255.850 191.626 264.300 1.00 0.00 C +ATOM 12 CA ARG A 12 258.303 189.488 262.318 1.00 0.00 C +ATOM 13 CA TRP A 13 258.370 191.055 258.845 1.00 0.00 C +ATOM 14 CA ASN A 14 258.191 194.791 258.116 1.00 0.00 C +ATOM 15 CA ALA A 15 256.399 197.387 255.981 1.00 0.00 C +ATOM 16 CA ARG A 16 257.226 199.755 253.113 1.00 0.00 C +ATOM 17 CA THR A 17 255.298 202.570 251.418 1.00 0.00 C +ATOM 18 CA GLY A 18 254.932 205.323 248.810 1.00 0.00 C +ATOM 19 CA GLY A 19 257.459 207.680 247.205 1.00 0.00 C +ATOM 20 CA ALA A 20 259.692 210.700 247.844 1.00 0.00 C +ATOM 21 CA ASP A 21 258.908 213.273 250.542 1.00 0.00 C +ATOM 22 CA ARG A 22 255.772 215.396 250.955 1.00 0.00 C +ATOM 23 CA GLY A 23 252.472 215.607 252.847 1.00 0.00 C +ATOM 24 CA ARG A 24 250.938 217.447 255.809 1.00 0.00 C +ATOM 25 CA PRO A 25 249.160 217.866 259.153 1.00 0.00 C +ATOM 26 CA ASP A 26 246.884 218.938 262.014 1.00 0.00 C +ATOM 27 CA PRO A 27 243.864 216.762 262.828 1.00 0.00 C +ATOM 28 CA ILE A 28 243.423 213.347 261.198 1.00 0.00 C +ATOM 29 CA SER A 29 241.068 211.689 258.703 1.00 0.00 C +ATOM 30 CA ALA A 30 239.241 208.672 260.142 1.00 0.00 C +ATOM 31 CA GLU A 31 235.463 209.057 260.459 1.00 0.00 C +ATOM 32 CA LEU A 32 232.714 209.231 257.826 1.00 0.00 C +ATOM 33 CA ALA A 33 229.498 211.269 257.963 1.00 0.00 C +ATOM 34 CA PRO A 34 225.931 210.514 256.859 1.00 0.00 C +ATOM 35 CA THR A 35 223.697 212.100 259.506 1.00 0.00 C +ATOM 36 CA TRP A 36 222.462 215.470 260.787 1.00 0.00 C +ATOM 37 CA ARG A 37 222.077 218.173 263.444 1.00 0.00 C +ATOM 38 CA LEU A 38 221.170 219.049 267.039 1.00 0.00 C +ATOM 39 CA ARG A 39 222.495 219.469 270.586 1.00 0.00 C +ATOM 40 CA GLY A 40 223.525 223.079 271.239 1.00 0.00 C +ATOM 41 CA ALA A 41 223.895 223.502 275.007 1.00 0.00 C +ATOM 42 CA ARG A 42 221.637 225.346 277.460 1.00 0.00 C +ATOM 43 CA LEU A 43 220.383 228.581 275.887 1.00 0.00 C +ATOM 44 CA LEU A 44 221.498 232.073 274.847 1.00 0.00 C +ATOM 45 CA PRO A 45 221.750 235.295 272.828 1.00 0.00 C +ATOM 46 CA ARG A 46 222.429 235.539 269.088 1.00 0.00 C +ATOM 47 CA GLY A 47 219.591 236.820 266.892 1.00 0.00 C +ATOM 48 CA LEU A 48 217.948 238.314 263.796 1.00 0.00 C +ATOM 49 CA ALA A 49 217.060 236.579 260.523 1.00 0.00 C +ATOM 50 CA GLY A 50 219.315 238.103 257.857 1.00 0.00 C +ATOM 51 CA GLY A 51 218.295 237.466 254.242 1.00 0.00 C +ATOM 52 CA ARG A 52 220.646 238.205 251.336 1.00 0.00 C +ATOM 53 CA ARG A 53 223.276 240.538 252.804 1.00 0.00 C +ATOM 54 CA ARG A 54 224.146 243.268 255.316 1.00 0.00 C +ATOM 55 CA ARG A 55 225.026 246.778 254.126 1.00 0.00 C +ATOM 56 CA ARG A 56 226.173 249.777 256.177 1.00 0.00 C +ATOM 57 CA PRO A 57 229.053 251.711 257.752 1.00 0.00 C +ATOM 58 CA GLU A 58 228.543 255.444 258.320 1.00 0.00 C +ATOM 59 CA ARG A 59 225.038 255.744 259.784 1.00 0.00 C +ATOM 60 CA THR A 60 221.579 256.610 258.443 1.00 0.00 C +ATOM 61 CA ALA A 61 221.022 260.291 257.630 1.00 0.00 C +ATOM 62 CA ASP A 62 221.226 264.083 257.934 1.00 0.00 C +ATOM 63 CA ASP A 63 220.839 265.374 254.370 1.00 0.00 C +ATOM 64 CA SER A 64 219.196 265.472 250.934 1.00 0.00 C +ATOM 65 CA ASP A 65 220.674 267.438 248.024 1.00 0.00 C +ATOM 66 CA GLU A 66 224.077 266.067 246.996 1.00 0.00 C +ATOM 67 CA ARG A 67 226.324 264.168 244.575 1.00 0.00 C +ATOM 68 CA ARG A 68 227.075 264.137 240.840 1.00 0.00 C +ATOM 69 CA SER A 69 226.778 262.004 237.696 1.00 0.00 C +ATOM 70 CA GLU A 70 227.204 258.340 238.650 1.00 0.00 C +ATOM 71 CA PRO A 71 230.745 257.614 239.856 1.00 0.00 C +ATOM 72 CA ARG A 72 234.265 256.669 240.966 1.00 0.00 C +ATOM 73 CA ARG A 73 234.587 253.378 242.859 1.00 0.00 C +ATOM 74 CA TYR A 74 231.640 251.224 241.767 1.00 0.00 C +ATOM 75 CA ARG A 75 229.849 247.987 242.677 1.00 0.00 C +ATOM 76 CA ARG A 76 228.173 245.066 240.895 1.00 0.00 C +ATOM 77 CA GLU A 77 224.850 246.199 239.416 1.00 0.00 C +ATOM 78 CA ARG A 78 223.441 246.173 235.877 1.00 0.00 C +ATOM 79 CA ALA A 79 223.228 247.752 232.415 1.00 0.00 C +ATOM 80 CA TYR A 80 226.622 247.725 230.685 1.00 0.00 C +ATOM 81 CA ARG A 81 226.627 248.891 227.058 1.00 0.00 C +ATOM 82 CA VAL A 82 224.604 249.261 223.851 1.00 0.00 C +ATOM 83 CA VAL A 83 222.544 251.174 221.280 1.00 0.00 C +ATOM 84 CA ALA A 84 221.809 254.901 221.572 1.00 0.00 C +ATOM 85 CA GLN A 85 221.130 256.153 225.106 1.00 0.00 C +ATOM 86 CA ASP A 86 222.091 259.676 226.193 1.00 0.00 C +ATOM 87 CA GLU A 87 223.200 260.967 229.602 1.00 0.00 C +ATOM 88 CA GLY A 88 226.907 261.043 230.481 1.00 0.00 C +ATOM 89 CA ARG A 89 229.118 264.145 230.530 1.00 0.00 C +ATOM 90 CA ARG A 90 232.347 263.854 232.533 1.00 0.00 C +ATOM 91 CA ALA A 91 234.203 263.854 235.859 1.00 0.00 C +ATOM 92 CA ASN A 92 236.914 265.793 237.706 1.00 0.00 C +ATOM 93 CA GLY A 93 238.725 269.045 238.519 1.00 0.00 C +ATOM 94 CA SER A 94 238.868 272.328 240.447 1.00 0.00 C +ATOM 95 CA ASP A 95 240.306 275.227 238.436 1.00 0.00 C +ATOM 96 CA SER A 96 241.423 277.154 235.345 1.00 0.00 C +ATOM 97 CA PRO A 97 241.197 280.780 234.199 1.00 0.00 C +ATOM 98 CA GLU A 98 242.072 283.888 232.177 1.00 0.00 C +ATOM 99 CA GLY A 99 245.145 284.460 229.997 1.00 0.00 C +ATOM 100 CA VAL A 100 248.758 284.861 228.857 1.00 0.00 C +ATOM 101 CA ARG A 101 249.772 288.439 229.688 1.00 0.00 C +ATOM 102 CA ARG A 102 251.451 290.238 226.780 1.00 0.00 C +ATOM 103 CA ARG A 103 254.993 291.640 226.800 1.00 0.00 C +ATOM 104 CA TRP A 104 256.764 290.479 229.967 1.00 0.00 C +ATOM 105 CA ILE A 105 256.463 288.618 233.278 1.00 0.00 C +ATOM 106 CA ALA A 106 258.796 288.565 236.290 1.00 0.00 C +ATOM 107 CA ALA A 107 261.419 289.483 238.897 1.00 0.00 C +ATOM 108 CA ALA A 108 263.920 288.886 241.708 1.00 0.00 C +ATOM 109 CA ALA A 109 267.660 289.211 242.360 1.00 0.00 C +ATOM 110 CA THR A 110 269.165 285.997 243.746 1.00 0.00 C +ATOM 111 CA GLY A 111 271.431 285.772 246.801 1.00 0.00 C +ATOM 112 CA GLY A 112 274.450 283.530 246.190 1.00 0.00 C +ATOM 113 CA GLU A 113 277.226 281.046 245.387 1.00 0.00 C +ATOM 114 CA LYS A 114 279.089 278.848 242.895 1.00 0.00 C +ATOM 115 CA ARG A 115 281.049 275.605 243.293 1.00 0.00 C +ATOM 116 CA GLY A 116 284.830 275.150 243.196 1.00 0.00 C +ATOM 117 CA LYS A 117 286.337 277.581 240.678 1.00 0.00 C +ATOM 118 CA ARG A 118 287.177 281.262 241.182 1.00 0.00 C +ATOM 119 CA ARG A 119 286.294 284.719 242.519 1.00 0.00 C +ATOM 120 CA ARG A 120 288.190 288.006 242.171 1.00 0.00 C +ATOM 121 CA GLY A 121 291.949 287.448 242.446 1.00 0.00 C +ATOM 122 CA HIS A 122 293.900 289.837 240.210 1.00 0.00 C +ATOM 123 CA GLU A 123 296.696 291.718 241.989 1.00 0.00 C +ATOM 124 CA GLY A 124 300.344 292.328 241.077 1.00 0.00 C +ATOM 125 CA PRO A 125 303.342 290.287 239.909 1.00 0.00 C +ATOM 126 CA ILE A 126 305.998 292.888 239.074 1.00 0.00 C +ATOM 127 CA PRO A 127 308.782 291.533 236.854 1.00 0.00 C +ATOM 128 CA GLY A 128 312.349 292.398 237.876 1.00 0.00 C +ATOM 129 CA GLY A 129 314.641 293.527 240.702 1.00 0.00 C +ATOM 130 CA GLU A 130 312.918 292.957 244.052 1.00 0.00 C +ATOM 131 CA SER A 131 309.355 291.731 244.612 1.00 0.00 C +ATOM 132 CA ILE A 132 306.168 289.779 245.355 1.00 0.00 C +ATOM 133 CA TYR A 133 305.288 286.318 246.685 1.00 0.00 C +ATOM 134 CA ALA A 134 306.209 285.565 250.304 1.00 0.00 C +ATOM 135 CA ALA A 135 306.908 285.581 254.049 1.00 0.00 C +ATOM 136 CA THR A 136 308.196 286.311 257.560 1.00 0.00 C +ATOM 137 CA GLY A 137 307.104 286.535 261.204 1.00 0.00 C +ATOM 138 CA ILE A 138 303.303 286.290 261.113 1.00 0.00 C +ATOM 139 CA ARG A 139 300.028 287.779 259.859 1.00 0.00 C +ATOM 140 CA CYS A 140 299.967 287.183 256.096 1.00 0.00 C +TER 141 CYS A 140 +END diff --git a/Plants/Q8LJH0/Q8LJH0.dcd b/Plants/Q8LJH0/Q8LJH0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..71f1981e7f7073b7ede9255e09e5da77ed081e63 --- /dev/null +++ b/Plants/Q8LJH0/Q8LJH0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c942f8db77a2afb838830c201bd59219a9c3e49fc46bc9391a2f4d9228047746 +size 18800276 diff --git a/Plants/Q8LJH0/top.pdb b/Plants/Q8LJH0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..de715516a341708d8b3794a0ed8e3a72a18c4a3f --- /dev/null +++ b/Plants/Q8LJH0/top.pdb @@ -0,0 +1,154 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 301.493 253.785 272.734 1.00 0.00 C +ATOM 2 CA SER A 2 300.904 254.070 276.487 1.00 0.00 C +ATOM 3 CA LEU A 3 297.393 254.789 277.781 1.00 0.00 C +ATOM 4 CA LEU A 4 297.572 256.052 281.371 1.00 0.00 C +ATOM 5 CA THR A 5 294.012 256.475 282.661 1.00 0.00 C +ATOM 6 CA PRO A 6 293.533 256.571 286.439 1.00 0.00 C +ATOM 7 CA SER A 7 290.274 256.129 288.363 1.00 0.00 C +ATOM 8 CA VAL A 8 291.004 254.954 291.913 1.00 0.00 C +ATOM 9 CA LEU A 9 289.489 257.333 294.474 1.00 0.00 C +ATOM 10 CA VAL A 10 287.037 260.107 295.373 1.00 0.00 C +ATOM 11 CA VAL A 11 286.042 263.760 294.942 1.00 0.00 C +ATOM 12 CA LYS A 12 287.031 266.492 292.478 1.00 0.00 C +ATOM 13 CA PRO A 13 289.216 265.892 289.414 1.00 0.00 C +ATOM 14 CA SER A 14 287.278 265.740 286.137 1.00 0.00 C +ATOM 15 CA PRO A 15 283.885 264.013 286.290 1.00 0.00 C +ATOM 16 CA SER A 16 281.392 261.339 287.363 1.00 0.00 C +ATOM 17 CA ARG A 17 279.332 258.750 285.473 1.00 0.00 C +ATOM 18 CA GLY A 18 277.324 255.731 286.644 1.00 0.00 C +ATOM 19 CA PRO A 19 273.932 254.001 286.780 1.00 0.00 C +ATOM 20 CA ARG A 20 271.837 255.915 289.323 1.00 0.00 C +ATOM 21 CA PRO A 21 271.996 257.733 292.668 1.00 0.00 C +ATOM 22 CA GLN A 22 270.954 261.395 292.519 1.00 0.00 C +ATOM 23 CA TYR A 23 272.061 264.750 293.944 1.00 0.00 C +ATOM 24 CA ARG A 24 271.450 268.388 294.895 1.00 0.00 C +ATOM 25 CA GLY A 25 267.980 269.574 293.862 1.00 0.00 C +ATOM 26 CA ARG A 26 265.036 271.950 293.408 1.00 0.00 C +ATOM 27 CA GLY A 27 261.568 272.756 292.052 1.00 0.00 C +ATOM 28 CA SER A 28 259.650 269.811 290.581 1.00 0.00 C +ATOM 29 CA MET A 29 256.941 271.208 288.294 1.00 0.00 C +ATOM 30 CA SER A 30 253.922 269.886 286.383 1.00 0.00 C +ATOM 31 CA SER A 31 253.383 266.454 284.820 1.00 0.00 C +ATOM 32 CA SER A 32 252.210 262.933 283.956 1.00 0.00 C +ATOM 33 CA VAL A 33 248.668 262.215 285.164 1.00 0.00 C +ATOM 34 CA GLY A 34 245.874 259.631 285.332 1.00 0.00 C +ATOM 35 CA GLY A 35 242.465 258.503 284.058 1.00 0.00 C +ATOM 36 CA PRO A 36 242.272 255.635 281.559 1.00 0.00 C +ATOM 37 CA GLY A 37 240.537 253.323 279.076 1.00 0.00 C +ATOM 38 CA GLU A 38 238.212 250.548 277.890 1.00 0.00 C +ATOM 39 CA GLU A 39 234.575 251.529 278.461 1.00 0.00 C +ATOM 40 CA SER A 40 232.393 253.524 276.059 1.00 0.00 C +ATOM 41 CA HIS A 41 234.209 256.828 275.512 1.00 0.00 C +ATOM 42 CA TRP A 42 234.399 259.056 272.427 1.00 0.00 C +ATOM 43 CA VAL A 43 232.963 258.624 268.924 1.00 0.00 C +ATOM 44 CA GLY A 44 229.250 257.783 268.763 1.00 0.00 C +ATOM 45 CA PRO A 45 227.498 258.504 272.068 1.00 0.00 C +ATOM 46 CA ALA A 46 223.837 259.267 271.339 1.00 0.00 C +ATOM 47 CA GLU A 47 221.492 261.502 273.345 1.00 0.00 C +ATOM 48 CA GLU A 48 220.359 259.696 276.503 1.00 0.00 C +ATOM 49 CA ARG A 49 222.916 257.174 277.775 1.00 0.00 C +ATOM 50 CA GLU A 50 226.073 255.227 276.902 1.00 0.00 C +ATOM 51 CA ARG A 51 226.003 251.671 275.535 1.00 0.00 C +ATOM 52 CA ASP A 52 227.479 248.532 273.960 1.00 0.00 C +ATOM 53 CA ARG A 53 226.760 247.263 270.440 1.00 0.00 C +ATOM 54 CA GLU A 54 225.919 243.781 269.142 1.00 0.00 C +ATOM 55 CA TYR A 55 223.158 241.853 270.925 1.00 0.00 C +ATOM 56 CA ARG A 56 219.904 243.553 269.908 1.00 0.00 C +ATOM 57 CA ARG A 57 220.542 244.822 266.372 1.00 0.00 C +ATOM 58 CA ARG A 58 218.360 243.730 263.446 1.00 0.00 C +ATOM 59 CA ARG A 59 216.424 246.872 262.499 1.00 0.00 C +ATOM 60 CA ARG A 60 213.882 249.072 260.705 1.00 0.00 C +ATOM 61 CA GLY A 61 210.229 249.066 261.789 1.00 0.00 C +ATOM 62 CA GLY A 62 206.453 249.281 261.335 1.00 0.00 C +ATOM 63 CA ARG A 63 205.022 252.604 260.142 1.00 0.00 C +ATOM 64 CA ARG A 64 205.194 256.375 260.656 1.00 0.00 C +ATOM 65 CA ARG A 65 204.845 258.873 257.800 1.00 0.00 C +ATOM 66 CA VAL A 66 203.332 262.264 258.651 1.00 0.00 C +ATOM 67 CA THR A 67 202.764 265.991 259.203 1.00 0.00 C +ATOM 68 CA VAL A 68 204.841 268.927 260.462 1.00 0.00 C +ATOM 69 CA LEU A 69 207.821 269.282 262.808 1.00 0.00 C +ATOM 70 CA PRO A 70 210.748 269.680 265.215 1.00 0.00 C +ATOM 71 CA GLY A 71 213.740 267.584 264.134 1.00 0.00 C +ATOM 72 CA ASN A 72 215.416 264.690 265.959 1.00 0.00 C +ATOM 73 CA ASN A 73 217.182 262.475 263.411 1.00 0.00 C +ATOM 74 CA ILE A 74 216.832 258.778 262.561 1.00 0.00 C +ATOM 75 CA GLY A 75 219.349 257.406 260.051 1.00 0.00 C +ATOM 76 CA ALA A 76 219.662 253.636 259.601 1.00 0.00 C +ATOM 77 CA CYS A 77 222.183 253.163 256.783 1.00 0.00 C +ATOM 78 CA PRO A 78 220.312 251.148 254.146 1.00 0.00 C +ATOM 79 CA PRO A 79 220.011 248.259 251.680 1.00 0.00 C +ATOM 80 CA LEU A 80 221.946 249.454 248.624 1.00 0.00 C +ATOM 81 CA SER A 81 224.258 246.561 247.726 1.00 0.00 C +ATOM 82 CA PRO A 82 226.776 244.198 249.335 1.00 0.00 C +ATOM 83 CA ARG A 83 230.586 244.228 249.314 1.00 0.00 C +ATOM 84 CA CYS A 84 234.125 242.885 248.885 1.00 0.00 C +ATOM 85 CA GLY A 85 234.589 239.282 247.738 1.00 0.00 C +ATOM 86 CA ALA A 86 236.602 239.243 244.504 1.00 0.00 C +ATOM 87 CA ASP A 87 239.464 238.238 242.198 1.00 0.00 C +ATOM 88 CA GLY A 88 239.638 239.695 238.682 1.00 0.00 C +ATOM 89 CA THR A 89 241.827 239.645 235.564 1.00 0.00 C +ATOM 90 CA ALA A 90 241.573 239.303 231.778 1.00 0.00 C +ATOM 91 CA PRO A 91 244.051 238.589 228.974 1.00 0.00 C +ATOM 92 CA THR A 92 246.636 241.338 228.445 1.00 0.00 C +ATOM 93 CA ARG A 93 247.913 244.737 227.291 1.00 0.00 C +ATOM 94 CA SER A 94 248.575 246.783 230.436 1.00 0.00 C +ATOM 95 CA SER A 95 246.816 249.258 232.738 1.00 0.00 C +ATOM 96 CA ARG A 96 246.722 251.005 236.123 1.00 0.00 C +ATOM 97 CA GLY A 97 243.664 253.273 235.975 1.00 0.00 C +ATOM 98 CA GLY A 98 243.135 254.117 232.298 1.00 0.00 C +ATOM 99 CA PRO A 99 240.821 253.041 229.468 1.00 0.00 C +ATOM 100 CA ASP A 100 242.474 251.845 226.250 1.00 0.00 C +ATOM 101 CA ALA A 101 242.326 251.751 222.444 1.00 0.00 C +ATOM 102 CA PRO A 102 242.039 251.015 218.717 1.00 0.00 C +ATOM 103 CA THR A 103 244.543 250.626 215.872 1.00 0.00 C +ATOM 104 CA THR A 104 243.375 248.793 212.743 1.00 0.00 C +ATOM 105 CA ALA A 105 241.816 246.346 210.274 1.00 0.00 C +ATOM 106 CA PRO A 106 243.897 243.559 208.719 1.00 0.00 C +ATOM 107 CA ASP A 107 244.454 239.791 208.638 1.00 0.00 C +ATOM 108 CA LEU A 108 246.487 238.178 205.848 1.00 0.00 C +ATOM 109 CA PRO A 109 248.472 237.198 202.747 1.00 0.00 C +ATOM 110 CA LEU A 110 251.724 235.219 202.892 1.00 0.00 C +ATOM 111 CA ARG A 111 255.383 234.156 202.889 1.00 0.00 C +ATOM 112 CA PRO A 112 257.628 231.917 200.776 1.00 0.00 C +ATOM 113 CA VAL A 113 258.262 228.642 202.616 1.00 0.00 C +ATOM 114 CA THR A 114 259.005 224.974 201.904 1.00 0.00 C +ATOM 115 CA VAL A 115 261.625 223.981 204.486 1.00 0.00 C +ATOM 116 CA ARG A 116 262.458 222.278 207.791 1.00 0.00 C +ATOM 117 CA ASP A 117 259.081 221.182 209.172 1.00 0.00 C +ATOM 118 CA GLY A 118 258.486 219.881 212.703 1.00 0.00 C +ATOM 119 CA GLU A 119 259.250 219.039 216.339 1.00 0.00 C +ATOM 120 CA VAL A 120 257.449 220.474 219.375 1.00 0.00 C +ATOM 121 CA SER A 121 255.186 223.459 218.681 1.00 0.00 C +ATOM 122 CA ASP A 122 253.502 226.856 219.052 1.00 0.00 C +ATOM 123 CA GLY A 123 255.703 229.255 221.031 1.00 0.00 C +ATOM 124 CA ALA A 124 257.376 232.336 219.539 1.00 0.00 C +ATOM 125 CA ARG A 125 258.684 235.877 220.053 1.00 0.00 C +ATOM 126 CA GLN A 126 261.545 235.612 222.556 1.00 0.00 C +ATOM 127 CA GLY A 127 264.929 236.690 221.177 1.00 0.00 C +ATOM 128 CA ARG A 128 265.569 235.728 217.547 1.00 0.00 C +ATOM 129 CA TRP A 129 266.901 234.230 214.307 1.00 0.00 C +ATOM 130 CA GLN A 130 268.758 231.687 212.162 1.00 0.00 C +ATOM 131 CA TRP A 131 272.180 232.970 211.085 1.00 0.00 C +ATOM 132 CA ARG A 132 274.597 230.120 210.340 1.00 0.00 C +ATOM 133 CA ASP A 133 278.117 231.399 211.036 1.00 0.00 C +ATOM 134 CA GLY A 134 279.646 233.286 213.973 1.00 0.00 C +ATOM 135 CA GLN A 135 280.578 236.700 215.384 1.00 0.00 C +ATOM 136 CA ARG A 136 282.089 238.639 218.295 1.00 0.00 C +ATOM 137 CA ARG A 137 279.233 239.002 220.790 1.00 0.00 C +ATOM 138 CA GLY A 138 276.328 241.467 220.820 1.00 0.00 C +ATOM 139 CA LYS A 139 276.140 242.921 217.303 1.00 0.00 C +ATOM 140 CA GLU A 140 276.508 244.004 213.669 1.00 0.00 C +ATOM 141 CA ARG A 141 273.941 246.579 212.531 1.00 0.00 C +ATOM 142 CA GLU A 142 273.525 249.325 209.923 1.00 0.00 C +ATOM 143 CA ARG A 143 273.862 252.613 211.818 1.00 0.00 C +ATOM 144 CA GLU A 144 273.413 255.965 213.572 1.00 0.00 C +ATOM 145 CA ALA A 145 271.401 259.200 213.607 1.00 0.00 C +ATOM 146 CA ALA A 146 270.184 262.777 213.117 1.00 0.00 C +ATOM 147 CA THR A 147 267.826 264.763 215.355 1.00 0.00 C +ATOM 148 CA ALA A 148 265.715 262.737 217.796 1.00 0.00 C +ATOM 149 CA ASP A 149 263.404 264.726 220.080 1.00 0.00 C +ATOM 150 CA LYS A 150 263.719 265.419 223.814 1.00 0.00 C +TER 151 LYS A 150 +END diff --git a/Plants/Q8LK06/Q8LK06.dcd b/Plants/Q8LK06/Q8LK06.dcd new file mode 100644 index 0000000000000000000000000000000000000000..f810339bf2d9cbfd20a59d759dd00c15643a8d8b --- /dev/null +++ b/Plants/Q8LK06/Q8LK06.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:179a7dfd2acd0e9fc86b8457d99cac3db9cfc2cb8123aadbd9b21adeef275f83 +size 97600276 diff --git a/Plants/Q8LK06/top.pdb b/Plants/Q8LK06/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..b60f99bcd300dfff5e5a30068b364229a30d0c15 --- /dev/null +++ b/Plants/Q8LK06/top.pdb @@ -0,0 +1,404 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 1000.000 1000.000 1000.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 487.105 624.682 324.344 1.00 0.00 C +ATOM 2 CA ALA A 2 490.061 626.845 323.295 1.00 0.00 C +ATOM 3 CA THR A 3 491.644 629.139 325.893 1.00 0.00 C +ATOM 4 CA GLY A 4 493.124 627.127 328.770 1.00 0.00 C +ATOM 5 CA GLU A 5 492.689 625.535 332.204 1.00 0.00 C +ATOM 6 CA GLU A 6 495.287 623.111 333.577 1.00 0.00 C +ATOM 7 CA HIS A 7 496.481 619.938 335.316 1.00 0.00 C +ATOM 8 CA VAL A 8 496.773 616.362 334.034 1.00 0.00 C +ATOM 9 CA ALA A 9 497.112 613.295 331.800 1.00 0.00 C +ATOM 10 CA ALA A 10 500.712 613.355 330.555 1.00 0.00 C +ATOM 11 CA PRO A 11 503.698 613.244 332.919 1.00 0.00 C +ATOM 12 CA ALA A 12 504.320 615.176 336.144 1.00 0.00 C +ATOM 13 CA PRO A 13 504.677 614.914 339.928 1.00 0.00 C +ATOM 14 CA ALA A 14 507.037 614.819 342.918 1.00 0.00 C +ATOM 15 CA VAL A 15 509.959 616.468 344.722 1.00 0.00 C +ATOM 16 CA GLU A 16 510.528 617.469 348.354 1.00 0.00 C +ATOM 17 CA GLU A 17 513.640 619.039 349.892 1.00 0.00 C +ATOM 18 CA THR A 18 513.670 619.519 353.672 1.00 0.00 C +ATOM 19 CA PRO A 19 511.937 617.396 356.319 1.00 0.00 C +ATOM 20 CA GLU A 20 512.925 615.367 359.389 1.00 0.00 C +ATOM 21 CA LYS A 21 515.583 613.604 361.471 1.00 0.00 C +ATOM 22 CA LYS A 22 518.965 612.208 362.537 1.00 0.00 C +ATOM 23 CA GLN A 23 521.604 612.149 365.284 1.00 0.00 C +ATOM 24 CA ALA A 24 520.681 613.463 368.739 1.00 0.00 C +ATOM 25 CA SER A 25 517.495 614.231 370.683 1.00 0.00 C +ATOM 26 CA THR A 26 515.226 613.150 373.546 1.00 0.00 C +ATOM 27 CA THR A 27 515.836 615.264 376.657 1.00 0.00 C +ATOM 28 CA GLU A 28 514.869 614.512 380.265 1.00 0.00 C +ATOM 29 CA LEU A 29 513.720 611.380 382.104 1.00 0.00 C +ATOM 30 CA PRO A 30 515.720 610.414 385.200 1.00 0.00 C +ATOM 31 CA ALA A 31 518.056 607.847 386.771 1.00 0.00 C +ATOM 32 CA PRO A 32 519.390 604.862 384.815 1.00 0.00 C +ATOM 33 CA SER A 33 519.760 601.381 383.311 1.00 0.00 C +ATOM 34 CA GLY A 34 520.125 597.876 381.861 1.00 0.00 C +ATOM 35 CA TRP A 35 519.000 594.441 383.064 1.00 0.00 C +ATOM 36 CA THR A 36 520.208 591.034 384.269 1.00 0.00 C +ATOM 37 CA LYS A 37 523.344 588.959 384.881 1.00 0.00 C +ATOM 38 CA LYS A 38 522.239 586.151 387.207 1.00 0.00 C +ATOM 39 CA LEU A 39 524.350 583.119 386.277 1.00 0.00 C +ATOM 40 CA ALA A 40 527.021 581.087 388.081 1.00 0.00 C +ATOM 41 CA PRO A 41 530.172 582.398 389.775 1.00 0.00 C +ATOM 42 CA THR A 42 533.103 580.143 388.858 1.00 0.00 C +ATOM 43 CA ARG A 43 535.965 577.664 389.283 1.00 0.00 C +ATOM 44 CA GLY A 44 535.044 574.808 391.630 1.00 0.00 C +ATOM 45 CA GLY A 45 534.223 571.139 391.011 1.00 0.00 C +ATOM 46 CA ARG A 46 530.864 569.351 391.204 1.00 0.00 C +ATOM 47 CA GLY A 47 528.690 566.619 392.729 1.00 0.00 C +ATOM 48 CA GLY A 48 528.149 565.595 396.359 1.00 0.00 C +ATOM 49 CA ARG A 49 526.384 562.232 396.647 1.00 0.00 C +ATOM 50 CA PHE A 50 523.723 559.603 397.375 1.00 0.00 C +ATOM 51 CA GLU A 51 524.252 557.196 400.280 1.00 0.00 C +ATOM 52 CA VAL A 52 523.146 553.584 399.778 1.00 0.00 C +ATOM 53 CA ILE A 53 520.628 551.051 401.103 1.00 0.00 C +ATOM 54 CA PHE A 54 517.744 548.968 402.468 1.00 0.00 C +ATOM 55 CA VAL A 55 517.771 545.784 400.376 1.00 0.00 C +ATOM 56 CA SER A 56 516.434 542.370 399.340 1.00 0.00 C +ATOM 57 CA PRO A 57 516.278 539.433 401.762 1.00 0.00 C +ATOM 58 CA THR A 58 514.651 536.008 402.129 1.00 0.00 C +ATOM 59 CA GLY A 59 515.348 534.035 398.945 1.00 0.00 C +ATOM 60 CA GLU A 60 514.789 531.053 396.641 1.00 0.00 C +ATOM 61 CA GLU A 61 514.581 527.761 394.734 1.00 0.00 C +ATOM 62 CA ILE A 62 515.686 526.829 391.209 1.00 0.00 C +ATOM 63 CA LYS A 63 518.837 524.926 390.227 1.00 0.00 C +ATOM 64 CA SER A 64 520.332 522.439 392.696 1.00 0.00 C +ATOM 65 CA LYS A 65 521.674 524.159 395.820 1.00 0.00 C +ATOM 66 CA ARG A 66 521.869 526.703 398.649 1.00 0.00 C +ATOM 67 CA GLN A 67 522.444 526.510 402.411 1.00 0.00 C +ATOM 68 CA LEU A 68 524.959 529.144 403.529 1.00 0.00 C +ATOM 69 CA THR A 69 526.334 532.528 404.613 1.00 0.00 C +ATOM 70 CA GLN A 70 524.965 535.640 406.333 1.00 0.00 C +ATOM 71 CA TYR A 71 522.931 538.540 407.736 1.00 0.00 C +ATOM 72 CA LEU A 72 519.220 539.349 408.030 1.00 0.00 C +ATOM 73 CA LYS A 73 516.856 536.457 408.781 1.00 0.00 C +ATOM 74 CA ALA A 74 513.433 535.752 410.297 1.00 0.00 C +ATOM 75 CA HIS A 75 513.811 533.350 413.230 1.00 0.00 C +ATOM 76 CA PRO A 76 516.059 532.874 416.269 1.00 0.00 C +ATOM 77 CA GLY A 77 515.583 533.818 419.929 1.00 0.00 C +ATOM 78 CA GLY A 78 515.287 537.102 421.839 1.00 0.00 C +ATOM 79 CA PRO A 79 512.125 537.879 423.817 1.00 0.00 C +ATOM 80 CA ALA A 80 508.802 538.610 425.531 1.00 0.00 C +ATOM 81 CA SER A 81 505.376 539.983 426.477 1.00 0.00 C +ATOM 82 CA SER A 82 504.600 540.071 430.206 1.00 0.00 C +ATOM 83 CA GLU A 83 504.410 541.545 433.715 1.00 0.00 C +ATOM 84 CA PHE A 84 504.617 543.827 436.759 1.00 0.00 C +ATOM 85 CA ASP A 85 505.851 542.518 440.117 1.00 0.00 C +ATOM 86 CA TRP A 86 504.474 543.985 443.352 1.00 0.00 C +ATOM 87 CA GLY A 87 500.887 545.018 442.588 1.00 0.00 C +ATOM 88 CA THR A 88 500.919 548.827 442.697 1.00 0.00 C +ATOM 89 CA SER A 89 497.985 551.153 443.401 1.00 0.00 C +ATOM 90 CA ASP A 90 495.466 553.956 442.838 1.00 0.00 C +ATOM 91 CA THR A 91 495.123 555.664 439.450 1.00 0.00 C +ATOM 92 CA PRO A 92 497.007 558.947 439.021 1.00 0.00 C +ATOM 93 CA ARG A 93 498.740 559.109 435.632 1.00 0.00 C +ATOM 94 CA ARG A 94 500.854 557.952 432.681 1.00 0.00 C +ATOM 95 CA SER A 95 503.887 555.659 432.916 1.00 0.00 C +ATOM 96 CA ALA A 96 504.300 554.024 436.333 1.00 0.00 C +ATOM 97 CA ARG A 97 507.021 554.916 438.846 1.00 0.00 C +ATOM 98 CA LEU A 98 505.181 555.320 442.158 1.00 0.00 C +ATOM 99 CA SER A 99 503.841 557.590 444.909 1.00 0.00 C +ATOM 100 CA GLU A 100 506.081 556.846 447.900 1.00 0.00 C +ATOM 101 CA LYS A 101 509.431 558.225 449.081 1.00 0.00 C +ATOM 102 CA VAL A 102 512.040 560.541 450.611 1.00 0.00 C +ATOM 103 CA LYS A 103 515.396 561.914 451.781 1.00 0.00 C +ATOM 104 CA ALA A 104 516.718 559.838 454.689 1.00 0.00 C +ATOM 105 CA THR A 105 519.516 560.490 457.192 1.00 0.00 C +ATOM 106 CA GLU A 106 522.507 558.330 456.241 1.00 0.00 C +ATOM 107 CA SER A 107 525.546 559.496 458.222 1.00 0.00 C +ATOM 108 CA PRO A 108 528.127 556.988 459.474 1.00 0.00 C +ATOM 109 CA GLU A 109 529.622 553.548 460.140 1.00 0.00 C +ATOM 110 CA GLY A 110 533.311 552.931 460.867 1.00 0.00 C +ATOM 111 CA GLU A 111 535.478 549.959 461.863 1.00 0.00 C +ATOM 112 CA LYS A 112 535.173 547.546 464.795 1.00 0.00 C +ATOM 113 CA THR A 113 532.992 547.860 467.903 1.00 0.00 C +ATOM 114 CA PRO A 114 532.185 548.798 471.507 1.00 0.00 C +ATOM 115 CA LYS A 115 528.383 548.788 471.753 1.00 0.00 C +ATOM 116 CA ARG A 116 527.082 549.413 475.279 1.00 0.00 C +ATOM 117 CA ALA A 117 529.488 547.879 477.804 1.00 0.00 C +ATOM 118 CA ARG A 118 528.997 546.731 481.403 1.00 0.00 C +ATOM 119 CA SER A 119 531.026 548.169 484.290 1.00 0.00 C +ATOM 120 CA SER A 120 531.912 551.874 484.221 1.00 0.00 C +ATOM 121 CA SER A 121 530.955 554.236 487.054 1.00 0.00 C +ATOM 122 CA LYS A 122 532.423 554.888 490.509 1.00 0.00 C +ATOM 123 CA ARG A 123 534.765 552.004 491.354 1.00 0.00 C +ATOM 124 CA GLY A 124 537.568 549.424 491.341 1.00 0.00 C +ATOM 125 CA LYS A 125 539.405 546.622 489.527 1.00 0.00 C +ATOM 126 CA LYS A 126 542.214 547.242 487.028 1.00 0.00 C +ATOM 127 CA GLU A 127 542.944 548.269 483.432 1.00 0.00 C +ATOM 128 CA GLU A 128 544.692 550.218 480.664 1.00 0.00 C +ATOM 129 CA LYS A 129 547.877 551.674 479.163 1.00 0.00 C +ATOM 130 CA VAL A 130 550.802 549.518 480.309 1.00 0.00 C +ATOM 131 CA ASP A 131 549.699 546.301 482.028 1.00 0.00 C +ATOM 132 CA ALA A 132 548.762 544.890 485.441 1.00 0.00 C +ATOM 133 CA GLU A 133 550.662 546.203 488.471 1.00 0.00 C +ATOM 134 CA ASP A 134 552.304 546.103 491.908 1.00 0.00 C +ATOM 135 CA ALA A 135 550.670 548.847 493.986 1.00 0.00 C +ATOM 136 CA ASN A 136 551.614 549.339 497.644 1.00 0.00 C +ATOM 137 CA GLU A 137 553.177 549.888 501.075 1.00 0.00 C +ATOM 138 CA ALA A 138 551.864 552.814 503.131 1.00 0.00 C +ATOM 139 CA GLY A 139 548.429 554.206 502.247 1.00 0.00 C +ATOM 140 CA GLU A 140 546.128 553.267 505.135 1.00 0.00 C +ATOM 141 CA ASP A 141 542.517 552.156 505.623 1.00 0.00 C +ATOM 142 CA GLY A 142 542.457 548.673 507.168 1.00 0.00 C +ATOM 143 CA ALA A 143 542.452 544.878 506.831 1.00 0.00 C +ATOM 144 CA ALA A 144 545.600 543.436 505.240 1.00 0.00 C +ATOM 145 CA ALA A 145 549.171 544.533 505.990 1.00 0.00 C +ATOM 146 CA GLU A 146 550.968 542.834 508.888 1.00 0.00 C +ATOM 147 CA GLY A 147 552.943 540.000 510.497 1.00 0.00 C +ATOM 148 CA LYS A 148 554.279 536.538 509.635 1.00 0.00 C +ATOM 149 CA GLY A 149 555.938 534.879 512.637 1.00 0.00 C +ATOM 150 CA THR A 150 558.928 533.041 514.119 1.00 0.00 C +ATOM 151 CA ASP A 151 558.363 529.362 514.932 1.00 0.00 C +ATOM 152 CA VAL A 152 558.371 525.557 514.737 1.00 0.00 C +ATOM 153 CA GLU A 153 561.444 523.504 513.812 1.00 0.00 C +ATOM 154 CA MET A 154 565.062 523.164 512.665 1.00 0.00 C +ATOM 155 CA LYS A 155 565.149 522.587 508.900 1.00 0.00 C +ATOM 156 CA ASP A 156 564.917 519.399 506.827 1.00 0.00 C +ATOM 157 CA ALA A 157 562.581 517.045 508.703 1.00 0.00 C +ATOM 158 CA GLU A 158 562.746 516.383 512.452 1.00 0.00 C +ATOM 159 CA ASN A 159 560.525 515.831 515.497 1.00 0.00 C +ATOM 160 CA ALA A 160 559.752 515.129 519.161 1.00 0.00 C +ATOM 161 CA GLU A 161 561.409 515.428 522.579 1.00 0.00 C +ATOM 162 CA ASP A 162 560.825 516.084 526.287 1.00 0.00 C +ATOM 163 CA GLU A 163 560.800 518.222 529.440 1.00 0.00 C +ATOM 164 CA LYS A 164 559.239 518.924 532.844 1.00 0.00 C +ATOM 165 CA LYS A 165 556.921 516.294 534.336 1.00 0.00 C +ATOM 166 CA ASP A 166 556.166 512.909 535.914 1.00 0.00 C +ATOM 167 CA VAL A 167 553.483 510.702 534.351 1.00 0.00 C +ATOM 168 CA PRO A 168 553.421 509.605 530.703 1.00 0.00 C +ATOM 169 CA SER A 169 550.747 508.828 528.102 1.00 0.00 C +ATOM 170 CA ALA A 170 547.518 508.350 526.137 1.00 0.00 C +ATOM 171 CA GLU A 171 546.308 504.740 526.274 1.00 0.00 C +ATOM 172 CA LYS A 172 545.614 501.756 524.010 1.00 0.00 C +ATOM 173 CA THR A 173 546.462 498.048 523.788 1.00 0.00 C +ATOM 174 CA GLU A 174 545.982 494.385 524.721 1.00 0.00 C +ATOM 175 CA GLU A 175 547.822 491.120 525.409 1.00 0.00 C +ATOM 176 CA VAL A 176 547.327 489.797 528.947 1.00 0.00 C +ATOM 177 CA ASP A 177 550.461 490.217 531.073 1.00 0.00 C +ATOM 178 CA ASP A 178 552.565 487.152 531.909 1.00 0.00 C +ATOM 179 CA LYS A 179 555.191 486.943 529.156 1.00 0.00 C +ATOM 180 CA LYS A 180 558.168 484.570 529.307 1.00 0.00 C +ATOM 181 CA ASP A 181 559.079 481.065 528.124 1.00 0.00 C +ATOM 182 CA ALA A 182 556.973 479.653 525.280 1.00 0.00 C +ATOM 183 CA GLU A 183 557.472 475.968 524.450 1.00 0.00 C +ATOM 184 CA ASN A 184 559.165 473.588 526.896 1.00 0.00 C +ATOM 185 CA VAL A 185 556.526 471.994 529.135 1.00 0.00 C +ATOM 186 CA GLU A 186 554.769 468.625 529.417 1.00 0.00 C +ATOM 187 CA MET A 187 552.245 465.780 529.192 1.00 0.00 C +ATOM 188 CA LYS A 188 548.572 466.395 528.390 1.00 0.00 C +ATOM 189 CA ASP A 189 548.493 467.923 524.901 1.00 0.00 C +ATOM 190 CA ALA A 190 547.367 471.562 524.802 1.00 0.00 C +ATOM 191 CA ALA A 191 547.072 473.066 528.290 1.00 0.00 C +ATOM 192 CA GLU A 192 543.772 472.407 530.076 1.00 0.00 C +ATOM 193 CA LYS A 193 540.668 470.209 529.841 1.00 0.00 C +ATOM 194 CA THR A 194 538.978 468.285 532.662 1.00 0.00 C +ATOM 195 CA GLU A 195 535.180 468.191 532.960 1.00 0.00 C +ATOM 196 CA GLU A 196 533.925 464.595 532.875 1.00 0.00 C +ATOM 197 CA VAL A 197 534.975 462.432 535.831 1.00 0.00 C +ATOM 198 CA GLU A 198 535.037 458.956 537.389 1.00 0.00 C +ATOM 199 CA ASP A 199 532.068 456.638 536.820 1.00 0.00 C +ATOM 200 CA LYS A 200 528.350 455.832 537.042 1.00 0.00 C +ATOM 201 CA LYS A 201 526.582 455.213 533.725 1.00 0.00 C +ATOM 202 CA GLU A 202 525.584 458.497 532.070 1.00 0.00 C +ATOM 203 CA GLU A 203 522.990 461.187 532.813 1.00 0.00 C +ATOM 204 CA ALA A 204 520.735 462.096 529.880 1.00 0.00 C +ATOM 205 CA PRO A 205 518.509 464.756 528.302 1.00 0.00 C +ATOM 206 CA THR A 206 514.780 464.003 528.496 1.00 0.00 C +ATOM 207 CA VAL A 207 511.786 466.191 527.620 1.00 0.00 C +ATOM 208 CA ASP A 208 511.464 468.272 524.445 1.00 0.00 C +ATOM 209 CA ALA A 209 513.072 468.563 521.003 1.00 0.00 C +ATOM 210 CA ALA A 210 512.355 469.172 517.311 1.00 0.00 C +ATOM 211 CA GLU A 211 512.316 467.359 513.961 1.00 0.00 C +ATOM 212 CA ASN A 212 512.385 467.622 510.160 1.00 0.00 C +ATOM 213 CA THR A 213 513.085 469.803 507.116 1.00 0.00 C +ATOM 214 CA VAL A 214 515.462 472.732 507.652 1.00 0.00 C +ATOM 215 CA GLU A 215 515.925 473.216 511.402 1.00 0.00 C +ATOM 216 CA GLY A 216 512.824 474.456 513.237 1.00 0.00 C +ATOM 217 CA ASP A 217 511.123 477.647 514.437 1.00 0.00 C +ATOM 218 CA ASP A 218 511.664 480.326 511.783 1.00 0.00 C +ATOM 219 CA LYS A 219 510.268 480.506 508.242 1.00 0.00 C +ATOM 220 CA LYS A 220 507.688 477.726 507.882 1.00 0.00 C +ATOM 221 CA GLU A 221 505.848 475.459 510.330 1.00 0.00 C +ATOM 222 CA GLU A 222 502.463 473.709 510.344 1.00 0.00 C +ATOM 223 CA PRO A 223 500.630 471.077 512.400 1.00 0.00 C +ATOM 224 CA PRO A 224 497.873 469.373 514.402 1.00 0.00 C +ATOM 225 CA ALA A 225 497.960 467.824 517.882 1.00 0.00 C +ATOM 226 CA GLU A 226 499.582 470.411 520.160 1.00 0.00 C +ATOM 227 CA LYS A 227 501.907 472.907 521.857 1.00 0.00 C +ATOM 228 CA THR A 228 505.246 471.355 522.837 1.00 0.00 C +ATOM 229 CA ASP A 229 504.649 468.861 525.655 1.00 0.00 C +ATOM 230 CA GLU A 230 505.002 465.392 527.189 1.00 0.00 C +ATOM 231 CA LYS A 231 506.805 462.062 526.764 1.00 0.00 C +ATOM 232 CA GLU A 232 508.698 461.956 523.459 1.00 0.00 C +ATOM 233 CA GLU A 233 507.386 459.312 521.049 1.00 0.00 C +ATOM 234 CA ALA A 234 504.367 457.029 521.481 1.00 0.00 C +ATOM 235 CA PRO A 235 502.199 457.051 524.613 1.00 0.00 C +ATOM 236 CA ALA A 236 499.145 454.840 524.065 1.00 0.00 C +ATOM 237 CA VAL A 237 500.265 451.616 522.372 1.00 0.00 C +ATOM 238 CA ASP A 238 499.917 448.358 520.428 1.00 0.00 C +ATOM 239 CA ALA A 239 497.256 446.546 518.392 1.00 0.00 C +ATOM 240 CA ALA A 240 496.881 443.973 515.607 1.00 0.00 C +ATOM 241 CA GLU A 241 494.644 441.048 516.587 1.00 0.00 C +ATOM 242 CA LYS A 242 492.110 438.451 515.426 1.00 0.00 C +ATOM 243 CA ASN A 243 489.036 437.202 517.299 1.00 0.00 C +ATOM 244 CA GLU A 244 488.491 436.562 521.015 1.00 0.00 C +ATOM 245 CA GLU A 245 490.375 438.972 523.287 1.00 0.00 C +ATOM 246 CA GLY A 246 490.836 442.594 522.197 1.00 0.00 C +ATOM 247 CA ASP A 247 490.127 445.075 519.394 1.00 0.00 C +ATOM 248 CA ASP A 248 490.630 448.650 520.610 1.00 0.00 C +ATOM 249 CA LYS A 249 490.726 451.602 523.017 1.00 0.00 C +ATOM 250 CA LYS A 250 490.765 454.705 525.228 1.00 0.00 C +ATOM 251 CA GLU A 251 493.972 455.587 527.087 1.00 0.00 C +ATOM 252 CA GLU A 252 494.786 459.184 528.045 1.00 0.00 C +ATOM 253 CA GLU A 253 498.346 459.060 529.395 1.00 0.00 C +ATOM 254 CA PRO A 254 499.553 461.599 531.967 1.00 0.00 C +ATOM 255 CA PRO A 255 499.781 461.041 535.729 1.00 0.00 C +ATOM 256 CA ALA A 256 497.896 457.969 536.964 1.00 0.00 C +ATOM 257 CA GLU A 257 496.233 455.445 534.644 1.00 0.00 C +ATOM 258 CA LYS A 258 497.842 452.534 532.785 1.00 0.00 C +ATOM 259 CA LYS A 259 499.155 449.089 531.823 1.00 0.00 C +ATOM 260 CA THR A 260 501.490 448.248 528.932 1.00 0.00 C +ATOM 261 CA VAL A 261 503.048 444.918 527.935 1.00 0.00 C +ATOM 262 CA GLU A 262 500.779 442.263 526.411 1.00 0.00 C +ATOM 263 CA LYS A 263 497.592 442.512 524.339 1.00 0.00 C +ATOM 264 CA GLU A 264 496.938 439.099 522.778 1.00 0.00 C +ATOM 265 CA VAL A 265 498.629 435.759 522.069 1.00 0.00 C +ATOM 266 CA VAL A 266 500.777 433.790 524.523 1.00 0.00 C +ATOM 267 CA PRO A 267 498.849 430.575 525.202 1.00 0.00 C +ATOM 268 CA ALA A 268 497.670 428.682 522.113 1.00 0.00 C +ATOM 269 CA VAL A 269 494.280 426.948 522.226 1.00 0.00 C +ATOM 270 CA ASP A 270 493.007 427.557 525.765 1.00 0.00 C +ATOM 271 CA ALA A 271 490.009 429.883 525.417 1.00 0.00 C +ATOM 272 CA ALA A 272 488.323 429.187 522.072 1.00 0.00 C +ATOM 273 CA GLU A 273 485.958 428.379 519.196 1.00 0.00 C +ATOM 274 CA ASN A 274 482.721 427.159 517.600 1.00 0.00 C +ATOM 275 CA THR A 275 483.071 425.803 514.056 1.00 0.00 C +ATOM 276 CA GLU A 276 483.614 428.567 511.492 1.00 0.00 C +ATOM 277 CA GLN A 277 480.840 431.159 511.172 1.00 0.00 C +ATOM 278 CA SER A 278 480.222 434.800 512.108 1.00 0.00 C +ATOM 279 CA THR A 279 479.525 435.582 515.771 1.00 0.00 C +ATOM 280 CA GLY A 280 481.562 436.899 518.709 1.00 0.00 C +ATOM 281 CA GLY A 281 481.269 437.053 522.505 1.00 0.00 C +ATOM 282 CA GLN A 282 479.524 439.546 524.797 1.00 0.00 C +ATOM 283 CA ALA A 283 480.388 442.986 526.188 1.00 0.00 C +ATOM 284 CA GLN A 284 480.754 446.191 528.215 1.00 0.00 C +ATOM 285 CA PRO A 285 479.226 446.052 531.703 1.00 0.00 C +ATOM 286 CA ASN A 286 480.852 448.809 533.770 1.00 0.00 C +ATOM 287 CA ASP A 287 483.263 451.300 532.190 1.00 0.00 C +ATOM 288 CA VAL A 288 483.584 452.224 528.508 1.00 0.00 C +ATOM 289 CA ALA A 289 480.160 453.057 527.058 1.00 0.00 C +ATOM 290 CA ALA A 290 477.278 453.574 529.496 1.00 0.00 C +ATOM 291 CA PRO A 291 477.407 455.896 532.514 1.00 0.00 C +ATOM 292 CA GLU A 292 476.448 455.989 536.200 1.00 0.00 C +ATOM 293 CA SER A 293 478.127 453.914 538.920 1.00 0.00 C +ATOM 294 CA GLU A 294 479.652 451.283 541.215 1.00 0.00 C +ATOM 295 CA ASN A 295 482.039 449.503 543.592 1.00 0.00 C +ATOM 296 CA LYS A 296 482.288 451.631 546.742 1.00 0.00 C +ATOM 297 CA GLY A 297 480.605 452.990 549.879 1.00 0.00 C +ATOM 298 CA ASP A 298 481.030 451.351 553.292 1.00 0.00 C +ATOM 299 CA GLY A 299 484.328 449.558 553.943 1.00 0.00 C +ATOM 300 CA LYS A 300 483.757 445.859 554.657 1.00 0.00 C +ATOM 301 CA PRO A 301 485.777 442.640 554.393 1.00 0.00 C +ATOM 302 CA ALA A 302 484.270 439.745 556.360 1.00 0.00 C +ATOM 303 CA GLU A 303 486.135 436.600 555.290 1.00 0.00 C +ATOM 304 CA SER A 304 489.935 436.599 555.022 1.00 0.00 C +ATOM 305 CA GLU A 305 492.479 433.814 554.490 1.00 0.00 C +ATOM 306 CA SER A 306 491.674 430.267 555.625 1.00 0.00 C +ATOM 307 CA ALA A 307 489.012 427.541 555.623 1.00 0.00 C +ATOM 308 CA PRO A 308 485.715 426.792 553.867 1.00 0.00 C +ATOM 309 CA LEU A 309 482.413 425.648 552.349 1.00 0.00 C +ATOM 310 CA ALA A 310 479.339 426.397 550.226 1.00 0.00 C +ATOM 311 CA PHE A 311 477.221 429.268 548.890 1.00 0.00 C +ATOM 312 CA VAL A 312 475.808 432.310 547.083 1.00 0.00 C +ATOM 313 CA ASP A 313 475.461 436.104 547.052 1.00 0.00 C +ATOM 314 CA ASP A 314 475.427 439.347 545.052 1.00 0.00 C +ATOM 315 CA ALA A 315 472.190 440.839 543.707 1.00 0.00 C +ATOM 316 CA ALA A 316 469.848 443.641 544.796 1.00 0.00 C +ATOM 317 CA PRO A 317 471.491 446.805 546.140 1.00 0.00 C +ATOM 318 CA LEU A 318 470.388 449.852 548.144 1.00 0.00 C +ATOM 319 CA VAL A 319 469.836 448.553 551.683 1.00 0.00 C +ATOM 320 CA ILE A 320 469.794 445.923 554.439 1.00 0.00 C +ATOM 321 CA VAL A 321 471.762 446.592 557.632 1.00 0.00 C +ATOM 322 CA GLY A 322 473.704 446.638 560.910 1.00 0.00 C +ATOM 323 CA GLU A 323 476.730 448.887 561.454 1.00 0.00 C +ATOM 324 CA GLU A 324 477.105 449.192 565.233 1.00 0.00 C +ATOM 325 CA LYS A 325 477.233 449.523 569.026 1.00 0.00 C +ATOM 326 CA THR A 326 474.454 449.738 571.623 1.00 0.00 C +ATOM 327 CA GLU A 327 471.022 449.340 570.017 1.00 0.00 C +ATOM 328 CA ASP A 328 467.598 450.721 570.958 1.00 0.00 C +ATOM 329 CA SER A 329 467.183 450.726 574.745 1.00 0.00 C +ATOM 330 CA GLN A 330 465.948 452.325 577.975 1.00 0.00 C +ATOM 331 CA ALA A 331 465.009 455.893 577.024 1.00 0.00 C +ATOM 332 CA ALA A 332 466.708 458.534 579.182 1.00 0.00 C +ATOM 333 CA GLU A 333 466.106 459.634 582.780 1.00 0.00 C +ATOM 334 CA SER A 334 464.056 458.330 585.715 1.00 0.00 C +ATOM 335 CA ALA A 335 461.780 459.740 588.426 1.00 0.00 C +ATOM 336 CA VAL A 336 461.921 460.048 592.221 1.00 0.00 C +ATOM 337 CA PRO A 337 458.616 458.656 593.506 1.00 0.00 C +ATOM 338 CA SER A 338 455.933 458.788 590.804 1.00 0.00 C +ATOM 339 CA LEU A 339 454.728 456.482 588.021 1.00 0.00 C +ATOM 340 CA ALA A 340 451.556 457.676 586.280 1.00 0.00 C +ATOM 341 CA SER A 341 451.284 456.506 582.665 1.00 0.00 C +ATOM 342 CA SER A 342 450.401 453.556 580.420 1.00 0.00 C +ATOM 343 CA GLU A 343 447.016 453.061 578.743 1.00 0.00 C +ATOM 344 CA GLY A 344 444.556 455.797 577.753 1.00 0.00 C +ATOM 345 CA GLU A 345 440.759 455.519 577.607 1.00 0.00 C +ATOM 346 CA LYS A 346 439.509 453.958 574.364 1.00 0.00 C +ATOM 347 CA LYS A 347 437.808 455.745 571.461 1.00 0.00 C +ATOM 348 CA GLU A 348 439.661 458.269 569.291 1.00 0.00 C +ATOM 349 CA ASN A 349 438.404 461.423 567.562 1.00 0.00 C +ATOM 350 CA GLY A 350 440.367 464.625 568.201 1.00 0.00 C +ATOM 351 CA GLY A 351 439.295 466.403 571.395 1.00 0.00 C +ATOM 352 CA ALA A 352 436.070 468.422 571.591 1.00 0.00 C +ATOM 353 CA THR A 353 434.151 470.168 574.382 1.00 0.00 C +ATOM 354 CA GLU A 354 435.160 469.412 577.977 1.00 0.00 C +ATOM 355 CA PRO A 355 436.591 466.501 579.976 1.00 0.00 C +ATOM 356 CA ALA A 356 439.873 465.628 581.702 1.00 0.00 C +ATOM 357 CA ALA A 357 443.040 465.283 583.792 1.00 0.00 C +ATOM 358 CA PRO A 358 446.687 464.923 584.834 1.00 0.00 C +ATOM 359 CA PRO A 359 447.551 468.041 586.845 1.00 0.00 C +ATOM 360 CA PRO A 360 446.462 467.660 590.476 1.00 0.00 C +ATOM 361 CA VAL A 361 444.823 465.614 593.240 1.00 0.00 C +ATOM 362 CA ASP A 362 441.091 465.569 594.009 1.00 0.00 C +ATOM 363 CA ALA A 363 437.376 464.838 593.583 1.00 0.00 C +ATOM 364 CA GLU A 364 435.610 464.858 596.959 1.00 0.00 C +ATOM 365 CA LYS A 365 431.809 464.843 597.218 1.00 0.00 C +ATOM 366 CA GLY A 366 428.874 463.411 595.256 1.00 0.00 C +ATOM 367 CA ALA A 367 425.887 465.638 594.460 1.00 0.00 C +ATOM 368 CA GLU A 368 424.925 467.392 591.218 1.00 0.00 C +ATOM 369 CA ASN A 369 421.446 467.467 589.666 1.00 0.00 C +ATOM 370 CA SER A 370 418.774 465.905 587.444 1.00 0.00 C +ATOM 371 CA GLY A 371 416.462 463.328 585.853 1.00 0.00 C +ATOM 372 CA GLN A 372 414.986 462.627 582.411 1.00 0.00 C +ATOM 373 CA VAL A 373 412.535 464.087 579.886 1.00 0.00 C +ATOM 374 CA ASN A 374 410.449 464.081 576.697 1.00 0.00 C +ATOM 375 CA THR A 375 407.096 462.323 577.124 1.00 0.00 C +ATOM 376 CA ALA A 376 406.022 459.894 579.856 1.00 0.00 C +ATOM 377 CA PRO A 377 407.626 456.669 581.096 1.00 0.00 C +ATOM 378 CA GLN A 378 405.542 453.489 581.348 1.00 0.00 C +ATOM 379 CA GLU A 379 403.121 450.819 582.581 1.00 0.00 C +ATOM 380 CA PRO A 380 399.942 448.720 582.649 1.00 0.00 C +ATOM 381 CA THR A 381 400.232 446.239 585.527 1.00 0.00 C +ATOM 382 CA ALA A 382 400.678 444.273 588.760 1.00 0.00 C +ATOM 383 CA ALA A 383 403.662 443.193 590.867 1.00 0.00 C +ATOM 384 CA ASN A 384 405.834 441.074 593.172 1.00 0.00 C +ATOM 385 CA CYS A 385 409.135 442.613 594.290 1.00 0.00 C +ATOM 386 CA ASP A 386 410.964 445.921 594.768 1.00 0.00 C +ATOM 387 CA LYS A 387 412.275 449.211 593.364 1.00 0.00 C +ATOM 388 CA GLY A 388 411.991 452.145 595.778 1.00 0.00 C +ATOM 389 CA GLN A 389 413.398 453.260 599.138 1.00 0.00 C +ATOM 390 CA ILE A 390 415.141 456.413 600.379 1.00 0.00 C +ATOM 391 CA GLN A 391 417.046 457.020 603.623 1.00 0.00 C +ATOM 392 CA PRO A 392 420.193 454.894 603.930 1.00 0.00 C +ATOM 393 CA GLY A 393 423.741 453.847 604.841 1.00 0.00 C +ATOM 394 CA ALA A 394 426.872 451.795 604.132 1.00 0.00 C +ATOM 395 CA SER A 395 430.582 452.545 604.568 1.00 0.00 C +ATOM 396 CA ALA A 396 433.129 454.993 605.993 1.00 0.00 C +ATOM 397 CA VAL A 397 432.184 456.196 609.482 1.00 0.00 C +ATOM 398 CA ARG A 398 430.730 459.136 611.420 1.00 0.00 C +ATOM 399 CA CYS A 399 429.060 462.430 612.358 1.00 0.00 C +ATOM 400 CA THR A 400 430.380 465.141 614.686 1.00 0.00 C +TER 401 THR A 400 +END diff --git a/Plants/Q8LKG1/Q8LKG1.dcd b/Plants/Q8LKG1/Q8LKG1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..65a42045bbc5c436d247f1f4a73aa07f2b40f15c --- /dev/null +++ b/Plants/Q8LKG1/Q8LKG1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:94645247a78e22d89a54ef5aaa1dea1a4af6b362bb337289d6f8fa1a0743159a +size 15680276 diff --git a/Plants/Q8LKG1/top.pdb b/Plants/Q8LKG1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..375795dd303ad09b8146dab9529cb456c7ca56ee --- /dev/null +++ b/Plants/Q8LKG1/top.pdb @@ -0,0 +1,128 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 258.981 260.414 259.219 1.00 0.00 C +ATOM 2 CA GLY A 2 257.354 256.979 258.951 1.00 0.00 C +ATOM 3 CA LEU A 3 255.779 256.977 255.481 1.00 0.00 C +ATOM 4 CA LEU A 4 257.603 258.653 252.587 1.00 0.00 C +ATOM 5 CA ASP A 5 261.154 259.571 251.555 1.00 0.00 C +ATOM 6 CA GLN A 6 263.567 257.795 253.909 1.00 0.00 C +ATOM 7 CA LEU A 7 267.305 257.524 254.591 1.00 0.00 C +ATOM 8 CA TRP A 8 270.260 258.007 256.948 1.00 0.00 C +ATOM 9 CA ASP A 9 272.819 255.477 258.202 1.00 0.00 C +ATOM 10 CA ASP A 10 275.227 253.601 255.923 1.00 0.00 C +ATOM 11 CA THR A 11 278.433 251.862 254.822 1.00 0.00 C +ATOM 12 CA VAL A 12 280.472 248.766 253.943 1.00 0.00 C +ATOM 13 CA ALA A 13 279.554 245.622 255.890 1.00 0.00 C +ATOM 14 CA GLY A 14 280.302 244.590 259.481 1.00 0.00 C +ATOM 15 CA PRO A 15 276.948 244.489 261.286 1.00 0.00 C +ATOM 16 CA ARG A 16 277.569 245.845 264.792 1.00 0.00 C +ATOM 17 CA PRO A 17 278.318 247.709 268.029 1.00 0.00 C +ATOM 18 CA GLU A 18 280.258 245.736 270.648 1.00 0.00 C +ATOM 19 CA ASN A 19 281.457 242.331 271.867 1.00 0.00 C +ATOM 20 CA GLY A 20 280.270 238.987 270.481 1.00 0.00 C +ATOM 21 CA LEU A 21 277.510 237.237 272.439 1.00 0.00 C +ATOM 22 CA GLY A 22 275.189 239.005 274.889 1.00 0.00 C +ATOM 23 CA LYS A 23 271.433 238.456 275.209 1.00 0.00 C +ATOM 24 CA LEU A 24 269.364 235.283 275.623 1.00 0.00 C +ATOM 25 CA ARG A 25 266.584 234.317 278.042 1.00 0.00 C +ATOM 26 CA LYS A 26 263.259 236.146 278.387 1.00 0.00 C +ATOM 27 CA HIS A 27 259.461 235.887 278.530 1.00 0.00 C +ATOM 28 CA ASN A 28 257.465 238.968 279.550 1.00 0.00 C +ATOM 29 CA THR A 29 258.313 241.642 276.972 1.00 0.00 C +ATOM 30 CA PHE A 30 255.345 243.013 275.015 1.00 0.00 C +ATOM 31 CA ALA A 31 254.594 246.374 273.386 1.00 0.00 C +ATOM 32 CA ALA A 32 253.199 249.165 271.199 1.00 0.00 C +ATOM 33 CA ARG A 33 253.975 252.883 271.495 1.00 0.00 C +ATOM 34 CA SER A 34 257.739 253.331 271.110 1.00 0.00 C +ATOM 35 CA SER A 35 259.570 252.942 267.791 1.00 0.00 C +ATOM 36 CA SER A 36 260.135 251.934 264.161 1.00 0.00 C +ATOM 37 CA GLY A 37 260.386 248.272 263.137 1.00 0.00 C +ATOM 38 CA LYS A 38 258.398 245.243 264.314 1.00 0.00 C +ATOM 39 CA GLU A 39 260.020 241.846 264.898 1.00 0.00 C +ATOM 40 CA LEU A 40 257.070 239.487 265.398 1.00 0.00 C +ATOM 41 CA GLU A 41 257.396 237.427 268.587 1.00 0.00 C +ATOM 42 CA ALA A 42 260.014 239.261 270.660 1.00 0.00 C +ATOM 43 CA GLY A 43 263.254 237.272 270.409 1.00 0.00 C +ATOM 44 CA SER A 44 266.869 237.392 269.211 1.00 0.00 C +ATOM 45 CA VAL A 45 267.237 234.747 266.494 1.00 0.00 C +ATOM 46 CA ARG A 46 264.703 232.065 265.546 1.00 0.00 C +ATOM 47 CA SER A 47 261.224 233.536 265.045 1.00 0.00 C +ATOM 48 CA TYR A 48 257.804 232.506 263.719 1.00 0.00 C +ATOM 49 CA GLY A 49 254.528 230.599 263.335 1.00 0.00 C +ATOM 50 CA GLU A 50 251.992 230.240 260.515 1.00 0.00 C +ATOM 51 CA GLU A 51 248.577 231.835 259.955 1.00 0.00 C +ATOM 52 CA PRO A 52 246.815 235.162 259.371 1.00 0.00 C +ATOM 53 CA SER A 53 248.255 238.444 260.662 1.00 0.00 C +ATOM 54 CA GLU A 54 245.976 240.066 263.249 1.00 0.00 C +ATOM 55 CA PRO A 55 242.917 241.814 261.799 1.00 0.00 C +ATOM 56 CA ALA A 56 239.312 243.023 262.050 1.00 0.00 C +ATOM 57 CA THR A 57 236.461 241.136 260.368 1.00 0.00 C +ATOM 58 CA ARG A 58 233.143 241.718 262.149 1.00 0.00 C +ATOM 59 CA VAL A 59 230.763 238.984 263.323 1.00 0.00 C +ATOM 60 CA THR A 60 227.485 238.679 261.406 1.00 0.00 C +ATOM 61 CA ARG A 61 223.984 240.178 261.527 1.00 0.00 C +ATOM 62 CA SER A 62 221.915 239.386 264.626 1.00 0.00 C +ATOM 63 CA ILE A 63 218.208 238.669 264.116 1.00 0.00 C +ATOM 64 CA MET A 64 217.525 238.321 260.384 1.00 0.00 C +ATOM 65 CA ILE A 65 215.671 235.237 259.134 1.00 0.00 C +ATOM 66 CA VAL A 66 215.030 233.235 255.956 1.00 0.00 C +ATOM 67 CA LYS A 67 213.873 234.347 252.501 1.00 0.00 C +ATOM 68 CA PRO A 68 214.610 234.832 248.794 1.00 0.00 C +ATOM 69 CA PRO A 69 212.866 236.196 245.693 1.00 0.00 C +ATOM 70 CA GLY A 70 211.347 239.682 245.918 1.00 0.00 C +ATOM 71 CA TYR A 71 213.820 242.580 245.873 1.00 0.00 C +ATOM 72 CA GLN A 72 217.457 242.609 244.737 1.00 0.00 C +ATOM 73 CA SER A 73 219.420 241.585 241.637 1.00 0.00 C +ATOM 74 CA GLY A 74 219.591 238.727 239.123 1.00 0.00 C +ATOM 75 CA SER A 75 220.869 236.043 236.740 1.00 0.00 C +ATOM 76 CA PRO A 76 218.075 234.535 234.634 1.00 0.00 C +ATOM 77 CA PRO A 77 218.837 235.585 231.052 1.00 0.00 C +ATOM 78 CA ALA A 78 222.054 237.620 230.872 1.00 0.00 C +ATOM 79 CA SER A 79 225.298 237.495 232.866 1.00 0.00 C +ATOM 80 CA PRO A 80 227.926 235.097 231.502 1.00 0.00 C +ATOM 81 CA ALA A 81 229.236 234.844 227.934 1.00 0.00 C +ATOM 82 CA GLY A 82 231.973 236.552 225.907 1.00 0.00 C +ATOM 83 CA SER A 83 231.697 237.881 222.347 1.00 0.00 C +ATOM 84 CA VAL A 84 233.116 238.272 218.833 1.00 0.00 C +ATOM 85 CA THR A 85 236.632 237.359 217.683 1.00 0.00 C +ATOM 86 CA PRO A 86 240.058 238.984 217.311 1.00 0.00 C +ATOM 87 CA VAL A 87 241.252 240.333 213.954 1.00 0.00 C +ATOM 88 CA SER A 88 244.543 239.883 212.087 1.00 0.00 C +ATOM 89 CA PRO A 89 248.150 239.286 213.159 1.00 0.00 C +ATOM 90 CA PHE A 90 249.274 239.666 216.779 1.00 0.00 C +ATOM 91 CA SER A 91 250.877 242.921 217.940 1.00 0.00 C +ATOM 92 CA GLY A 92 248.731 245.912 218.923 1.00 0.00 C +ATOM 93 CA THR A 93 245.000 245.222 219.265 1.00 0.00 C +ATOM 94 CA ARG A 94 243.408 248.594 220.047 1.00 0.00 C +ATOM 95 CA GLU A 95 243.914 249.409 223.734 1.00 0.00 C +ATOM 96 CA SER A 96 244.595 249.424 227.482 1.00 0.00 C +ATOM 97 CA PHE A 97 244.408 248.760 231.229 1.00 0.00 C +ATOM 98 CA ARG A 98 243.183 251.955 232.904 1.00 0.00 C +ATOM 99 CA PHE A 99 244.683 254.690 235.093 1.00 0.00 C +ATOM 100 CA ARG A 100 248.137 256.184 235.683 1.00 0.00 C +ATOM 101 CA ARG A 101 251.637 257.682 235.539 1.00 0.00 C +ATOM 102 CA ARG A 102 253.469 261.021 235.412 1.00 0.00 C +ATOM 103 CA SER A 103 254.137 264.563 234.177 1.00 0.00 C +ATOM 104 CA ALA A 104 253.887 267.793 232.172 1.00 0.00 C +ATOM 105 CA SER A 105 255.564 271.118 231.369 1.00 0.00 C +ATOM 106 CA ASP A 106 254.445 273.886 229.002 1.00 0.00 C +ATOM 107 CA ALA A 107 251.086 275.651 228.664 1.00 0.00 C +ATOM 108 CA PHE A 108 248.800 277.394 231.165 1.00 0.00 C +ATOM 109 CA GLU A 109 247.262 277.657 234.641 1.00 0.00 C +ATOM 110 CA LYS A 110 247.877 275.268 237.544 1.00 0.00 C +ATOM 111 CA LYS A 111 250.140 276.423 240.383 1.00 0.00 C +ATOM 112 CA ASN A 112 249.293 278.575 243.411 1.00 0.00 C +ATOM 113 CA GLN A 113 247.410 281.546 244.876 1.00 0.00 C +ATOM 114 CA ASP A 114 247.820 285.240 244.037 1.00 0.00 C +ATOM 115 CA ARG A 115 250.778 287.494 243.211 1.00 0.00 C +ATOM 116 CA SER A 116 254.533 287.881 243.730 1.00 0.00 C +ATOM 117 CA SER A 117 257.070 286.282 241.380 1.00 0.00 C +ATOM 118 CA SER A 118 260.652 284.981 241.372 1.00 0.00 C +ATOM 119 CA SER A 119 263.869 286.380 239.885 1.00 0.00 C +ATOM 120 CA SER A 120 264.041 289.950 241.206 1.00 0.00 C +ATOM 121 CA PRO A 121 264.671 293.555 240.146 1.00 0.00 C +ATOM 122 CA PHE A 122 264.726 297.359 240.349 1.00 0.00 C +ATOM 123 CA ASP A 123 264.460 301.128 240.835 1.00 0.00 C +ATOM 124 CA VAL A 124 263.764 304.813 241.510 1.00 0.00 C +TER 125 VAL A 124 +END diff --git a/Plants/Q8LL99/Q8LL99.dcd b/Plants/Q8LL99/Q8LL99.dcd new file mode 100644 index 0000000000000000000000000000000000000000..87740e9c7f10a83f36d11c51292a55d4ca0e34d7 --- /dev/null +++ b/Plants/Q8LL99/Q8LL99.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:42af17d634ed264c2a27ff9d4b01393ae990ced9ae26753fdfdf8dd2783f9f46 +size 13400276 diff --git a/Plants/Q8LL99/top.pdb b/Plants/Q8LL99/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..688dd4bede46a41041548764cf2cea3598a69029 --- /dev/null +++ b/Plants/Q8LL99/top.pdb @@ -0,0 +1,109 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 271.870 240.831 263.161 1.00 0.00 C +ATOM 2 CA ARG A 2 268.440 239.319 263.842 1.00 0.00 C +ATOM 3 CA ALA A 3 265.285 241.183 264.886 1.00 0.00 C +ATOM 4 CA CYS A 4 263.724 244.449 263.698 1.00 0.00 C +ATOM 5 CA ARG A 5 260.671 246.662 264.248 1.00 0.00 C +ATOM 6 CA PRO A 6 258.601 248.877 266.555 1.00 0.00 C +ATOM 7 CA PRO A 7 255.125 249.107 268.100 1.00 0.00 C +ATOM 8 CA ALA A 8 252.804 250.749 265.564 1.00 0.00 C +ATOM 9 CA MET A 9 254.473 250.770 262.139 1.00 0.00 C +ATOM 10 CA ALA A 10 255.576 248.227 259.526 1.00 0.00 C +ATOM 11 CA ARG A 11 253.709 246.352 256.784 1.00 0.00 C +ATOM 12 CA SER A 12 250.162 245.458 255.720 1.00 0.00 C +ATOM 13 CA ALA A 13 248.049 245.867 252.576 1.00 0.00 C +ATOM 14 CA GLY A 14 244.924 243.964 251.513 1.00 0.00 C +ATOM 15 CA LEU A 15 241.520 244.489 249.884 1.00 0.00 C +ATOM 16 CA GLY A 16 240.806 244.179 246.155 1.00 0.00 C +ATOM 17 CA ARG A 17 241.552 247.317 244.127 1.00 0.00 C +ATOM 18 CA ASN A 18 239.293 247.068 241.068 1.00 0.00 C +ATOM 19 CA ARG A 19 237.851 247.074 237.541 1.00 0.00 C +ATOM 20 CA SER A 20 238.457 243.695 235.889 1.00 0.00 C +ATOM 21 CA TYR A 21 240.335 240.526 236.863 1.00 0.00 C +ATOM 22 CA ASN A 22 243.412 238.776 235.455 1.00 0.00 C +ATOM 23 CA GLY A 23 244.161 235.861 237.791 1.00 0.00 C +ATOM 24 CA ALA A 24 247.566 236.505 239.376 1.00 0.00 C +ATOM 25 CA THR A 25 249.334 233.233 240.203 1.00 0.00 C +ATOM 26 CA ALA A 26 251.146 231.877 237.138 1.00 0.00 C +ATOM 27 CA ALA A 27 253.759 229.104 237.154 1.00 0.00 C +ATOM 28 CA ARG A 28 254.163 225.848 235.216 1.00 0.00 C +ATOM 29 CA ASP A 29 255.008 224.933 231.616 1.00 0.00 C +ATOM 30 CA ALA A 30 254.922 226.205 228.026 1.00 0.00 C +ATOM 31 CA ARG A 31 254.798 227.881 224.606 1.00 0.00 C +ATOM 32 CA ARG A 32 252.431 228.935 221.813 1.00 0.00 C +ATOM 33 CA ARG A 33 252.088 229.308 218.037 1.00 0.00 C +ATOM 34 CA TRP A 34 253.310 231.752 215.381 1.00 0.00 C +ATOM 35 CA ALA A 35 255.749 234.093 213.625 1.00 0.00 C +ATOM 36 CA ALA A 36 254.676 237.602 214.654 1.00 0.00 C +ATOM 37 CA THR A 37 255.708 239.378 217.862 1.00 0.00 C +ATOM 38 CA GLY A 38 254.985 243.098 217.469 1.00 0.00 C +ATOM 39 CA THR A 39 254.088 244.983 220.656 1.00 0.00 C +ATOM 40 CA GLY A 40 256.880 247.549 221.024 1.00 0.00 C +ATOM 41 CA ARG A 41 258.814 250.718 221.880 1.00 0.00 C +ATOM 42 CA GLY A 42 258.910 252.985 218.819 1.00 0.00 C +ATOM 43 CA ALA A 43 261.913 252.664 216.497 1.00 0.00 C +ATOM 44 CA ALA A 44 265.510 252.436 217.734 1.00 0.00 C +ATOM 45 CA THR A 45 265.239 253.004 221.491 1.00 0.00 C +ATOM 46 CA TYR A 46 267.385 253.324 224.623 1.00 0.00 C +ATOM 47 CA GLY A 47 269.883 256.132 223.994 1.00 0.00 C +ATOM 48 CA THR A 48 272.163 257.026 226.912 1.00 0.00 C +ATOM 49 CA VAL A 49 275.712 257.619 228.164 1.00 0.00 C +ATOM 50 CA THR A 50 275.732 258.048 231.949 1.00 0.00 C +ATOM 51 CA ARG A 51 272.249 258.850 233.271 1.00 0.00 C +ATOM 52 CA ALA A 52 271.575 261.941 235.394 1.00 0.00 C +ATOM 53 CA GLY A 53 272.226 265.572 234.442 1.00 0.00 C +ATOM 54 CA THR A 54 271.476 267.520 237.629 1.00 0.00 C +ATOM 55 CA GLY A 55 268.771 268.670 240.054 1.00 0.00 C +ATOM 56 CA ALA A 56 265.904 269.957 237.901 1.00 0.00 C +ATOM 57 CA ARG A 57 264.396 268.651 234.655 1.00 0.00 C +ATOM 58 CA ASP A 58 262.843 265.248 235.380 1.00 0.00 C +ATOM 59 CA GLY A 59 264.822 262.022 234.942 1.00 0.00 C +ATOM 60 CA GLY A 60 266.730 261.665 231.664 1.00 0.00 C +ATOM 61 CA GLY A 61 265.428 258.436 230.118 1.00 0.00 C +ATOM 62 CA ASN A 62 262.061 257.648 231.719 1.00 0.00 C +ATOM 63 CA VAL A 63 258.635 255.982 231.786 1.00 0.00 C +ATOM 64 CA ASP A 64 255.776 258.052 233.218 1.00 0.00 C +ATOM 65 CA GLY A 65 257.209 260.511 235.752 1.00 0.00 C +ATOM 66 CA ASP A 66 256.679 258.835 239.132 1.00 0.00 C +ATOM 67 CA GLY A 67 253.820 257.186 241.036 1.00 0.00 C +ATOM 68 CA ASP A 68 252.184 254.272 242.865 1.00 0.00 C +ATOM 69 CA GLY A 69 251.205 254.729 246.518 1.00 0.00 C +ATOM 70 CA ASP A 70 250.866 256.071 250.068 1.00 0.00 C +ATOM 71 CA GLY A 71 247.376 257.541 250.491 1.00 0.00 C +ATOM 72 CA ARG A 72 245.453 260.643 249.397 1.00 0.00 C +ATOM 73 CA ALA A 73 245.423 264.224 250.697 1.00 0.00 C +ATOM 74 CA SER A 74 248.203 264.676 253.264 1.00 0.00 C +ATOM 75 CA ASP A 75 248.419 266.158 256.767 1.00 0.00 C +ATOM 76 CA GLY A 76 246.174 265.294 259.721 1.00 0.00 C +ATOM 77 CA ASP A 77 245.551 261.644 260.618 1.00 0.00 C +ATOM 78 CA GLY A 78 242.436 259.451 260.690 1.00 0.00 C +ATOM 79 CA ASP A 79 240.618 259.102 264.020 1.00 0.00 C +ATOM 80 CA GLY A 80 242.260 257.892 267.238 1.00 0.00 C +ATOM 81 CA ARG A 81 244.884 255.182 267.777 1.00 0.00 C +ATOM 82 CA ALA A 82 244.583 251.466 268.559 1.00 0.00 C +ATOM 83 CA ARG A 83 241.820 251.005 271.142 1.00 0.00 C +ATOM 84 CA ARG A 84 241.151 253.680 273.772 1.00 0.00 C +ATOM 85 CA GLY A 85 238.718 252.970 276.616 1.00 0.00 C +ATOM 86 CA ARG A 86 237.884 255.317 279.499 1.00 0.00 C +ATOM 87 CA GLY A 87 235.677 258.385 279.984 1.00 0.00 C +ATOM 88 CA ARG A 88 234.167 259.137 276.567 1.00 0.00 C +ATOM 89 CA ALA A 89 230.496 259.665 275.694 1.00 0.00 C +ATOM 90 CA SER A 90 228.692 261.882 278.212 1.00 0.00 C +ATOM 91 CA THR A 91 227.978 260.812 281.798 1.00 0.00 C +ATOM 92 CA THR A 92 225.030 260.707 284.209 1.00 0.00 C +ATOM 93 CA GLY A 93 223.577 257.204 283.846 1.00 0.00 C +ATOM 94 CA THR A 94 225.516 253.927 283.703 1.00 0.00 C +ATOM 95 CA GLY A 95 228.845 253.339 281.946 1.00 0.00 C +ATOM 96 CA GLN A 96 230.097 249.742 281.839 1.00 0.00 C +ATOM 97 CA ARG A 97 227.786 247.395 279.923 1.00 0.00 C +ATOM 98 CA ASP A 98 228.715 243.765 279.234 1.00 0.00 C +ATOM 99 CA GLU A 99 228.257 241.859 282.500 1.00 0.00 C +ATOM 100 CA GLU A 100 229.275 243.370 285.847 1.00 0.00 C +ATOM 101 CA GLU A 101 228.949 240.981 288.797 1.00 0.00 C +ATOM 102 CA GLU A 102 228.025 240.522 292.465 1.00 0.00 C +ATOM 103 CA GLU A 103 229.826 239.206 295.553 1.00 0.00 C +ATOM 104 CA THR A 104 229.891 237.440 298.929 1.00 0.00 C +ATOM 105 CA ASN A 105 230.722 235.559 302.136 1.00 0.00 C +TER 106 ASN A 105 +END diff --git a/Plants/Q8LLB5/Q8LLB5.dcd b/Plants/Q8LLB5/Q8LLB5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..9c3cc52f6afeb119ff973e4373269c45884dfcb5 --- /dev/null +++ b/Plants/Q8LLB5/Q8LLB5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:504a3459b12f4b1afeb63b0e7b18961859e78238355a14382039baac0188f27d +size 16040276 diff --git a/Plants/Q8LLB5/top.pdb b/Plants/Q8LLB5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..0aec691d4ad0922cef2697289e2fdb8bf6076a8c --- /dev/null +++ b/Plants/Q8LLB5/top.pdb @@ -0,0 +1,131 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 286.383 263.838 249.570 1.00 0.00 C +ATOM 2 CA PRO A 2 283.615 263.893 246.953 1.00 0.00 C +ATOM 3 CA TYR A 3 280.722 261.714 248.138 1.00 0.00 C +ATOM 4 CA GLU A 4 277.088 261.256 247.088 1.00 0.00 C +ATOM 5 CA GLY A 5 274.460 262.974 249.246 1.00 0.00 C +ATOM 6 CA GLU A 6 270.718 262.599 248.633 1.00 0.00 C +ATOM 7 CA GLU A 7 268.879 265.881 248.034 1.00 0.00 C +ATOM 8 CA PRO A 8 265.985 266.700 250.373 1.00 0.00 C +ATOM 9 CA LEU A 9 263.412 268.879 252.148 1.00 0.00 C +ATOM 10 CA VAL A 10 259.893 267.736 253.054 1.00 0.00 C +ATOM 11 CA HIS A 11 259.944 267.312 256.840 1.00 0.00 C +ATOM 12 CA ASN A 12 259.855 269.953 259.585 1.00 0.00 C +ATOM 13 CA ILE A 13 256.771 271.492 261.208 1.00 0.00 C +ATOM 14 CA GLN A 14 253.522 272.848 259.751 1.00 0.00 C +ATOM 15 CA ALA A 15 250.835 271.532 262.109 1.00 0.00 C +ATOM 16 CA ARG A 16 247.276 271.836 263.434 1.00 0.00 C +ATOM 17 CA GLN A 17 244.177 270.402 265.124 1.00 0.00 C +ATOM 18 CA HIS A 18 242.386 267.881 267.349 1.00 0.00 C +ATOM 19 CA PRO A 19 240.490 264.850 266.032 1.00 0.00 C +ATOM 20 CA SER A 20 238.084 264.131 263.167 1.00 0.00 C +ATOM 21 CA THR A 21 237.617 266.854 260.543 1.00 0.00 C +ATOM 22 CA ALA A 22 239.381 266.715 257.169 1.00 0.00 C +ATOM 23 CA PRO A 23 241.960 266.925 254.373 1.00 0.00 C +ATOM 24 CA HIS A 24 243.214 264.220 252.000 1.00 0.00 C +ATOM 25 CA ILE A 25 240.401 262.458 250.129 1.00 0.00 C +ATOM 26 CA ALA A 26 237.062 263.826 248.905 1.00 0.00 C +ATOM 27 CA PRO A 27 234.104 265.022 246.823 1.00 0.00 C +ATOM 28 CA CYS A 28 235.220 265.336 243.194 1.00 0.00 C +ATOM 29 CA CYS A 29 237.041 264.197 240.048 1.00 0.00 C +ATOM 30 CA ARG A 30 238.469 262.684 236.855 1.00 0.00 C +ATOM 31 CA SER A 31 238.769 260.780 233.569 1.00 0.00 C +ATOM 32 CA THR A 32 241.169 261.213 230.642 1.00 0.00 C +ATOM 33 CA ASP A 33 240.086 263.016 227.465 1.00 0.00 C +ATOM 34 CA ARG A 34 238.121 265.085 224.941 1.00 0.00 C +ATOM 35 CA GLU A 35 237.529 267.066 221.741 1.00 0.00 C +ATOM 36 CA GLY A 36 239.505 266.874 218.489 1.00 0.00 C +ATOM 37 CA ARG A 37 243.051 265.498 218.716 1.00 0.00 C +ATOM 38 CA ARG A 38 246.056 263.161 218.868 1.00 0.00 C +ATOM 39 CA ARG A 39 249.391 262.387 217.196 1.00 0.00 C +ATOM 40 CA HIS A 40 251.329 265.020 215.239 1.00 0.00 C +ATOM 41 CA PRO A 41 249.640 268.416 215.600 1.00 0.00 C +ATOM 42 CA ALA A 42 250.504 271.397 217.810 1.00 0.00 C +ATOM 43 CA ASP A 43 253.235 272.845 220.037 1.00 0.00 C +ATOM 44 CA LEU A 44 256.887 273.844 220.463 1.00 0.00 C +ATOM 45 CA ASP A 45 259.245 273.124 223.368 1.00 0.00 C +ATOM 46 CA GLY A 46 261.454 271.769 226.161 1.00 0.00 C +ATOM 47 CA THR A 47 260.815 269.335 229.021 1.00 0.00 C +ATOM 48 CA GLU A 48 257.353 268.964 230.570 1.00 0.00 C +ATOM 49 CA GLU A 49 253.927 270.202 231.684 1.00 0.00 C +ATOM 50 CA GLU A 50 250.708 270.657 233.670 1.00 0.00 C +ATOM 51 CA LYS A 51 247.327 269.444 232.398 1.00 0.00 C +ATOM 52 CA GLU A 52 246.565 267.156 229.449 1.00 0.00 C +ATOM 53 CA GLY A 53 249.112 264.846 227.809 1.00 0.00 C +ATOM 54 CA GLU A 54 251.761 262.404 229.049 1.00 0.00 C +ATOM 55 CA VAL A 55 253.912 262.372 232.194 1.00 0.00 C +ATOM 56 CA GLN A 56 257.335 260.876 232.945 1.00 0.00 C +ATOM 57 CA PRO A 57 258.651 259.058 236.024 1.00 0.00 C +ATOM 58 CA HIS A 58 258.460 257.949 239.664 1.00 0.00 C +ATOM 59 CA LEU A 59 255.406 259.756 241.052 1.00 0.00 C +ATOM 60 CA GLY A 60 253.883 257.420 243.648 1.00 0.00 C +ATOM 61 CA GLU A 61 251.858 254.489 244.997 1.00 0.00 C +ATOM 62 CA GLY A 62 251.421 254.262 248.775 1.00 0.00 C +ATOM 63 CA ARG A 63 253.148 252.093 251.388 1.00 0.00 C +ATOM 64 CA ARG A 64 254.609 248.607 250.906 1.00 0.00 C +ATOM 65 CA GLU A 65 252.499 246.103 248.958 1.00 0.00 C +ATOM 66 CA THR A 66 251.654 242.442 249.588 1.00 0.00 C +ATOM 67 CA HIS A 67 249.847 240.681 252.444 1.00 0.00 C +ATOM 68 CA GLY A 68 250.914 237.424 254.108 1.00 0.00 C +ATOM 69 CA ASP A 69 254.575 236.374 254.029 1.00 0.00 C +ATOM 70 CA GLU A 70 257.502 236.593 251.599 1.00 0.00 C +ATOM 71 CA ALA A 71 258.816 233.912 249.233 1.00 0.00 C +ATOM 72 CA THR A 72 256.603 232.491 246.475 1.00 0.00 C +ATOM 73 CA THR A 73 253.953 229.985 247.575 1.00 0.00 C +ATOM 74 CA ARG A 74 253.417 227.238 244.989 1.00 0.00 C +ATOM 75 CA LYS A 75 249.869 226.775 243.680 1.00 0.00 C +ATOM 76 CA ARG A 76 246.379 225.319 244.138 1.00 0.00 C +ATOM 77 CA ASN A 77 244.488 223.849 247.101 1.00 0.00 C +ATOM 78 CA ASP A 78 244.737 220.220 248.232 1.00 0.00 C +ATOM 79 CA LEU A 79 241.491 218.226 248.294 1.00 0.00 C +ATOM 80 CA LEU A 80 239.647 215.043 249.285 1.00 0.00 C +ATOM 81 CA LEU A 81 235.906 214.760 249.945 1.00 0.00 C +ATOM 82 CA PRO A 82 232.327 215.943 250.504 1.00 0.00 C +ATOM 83 CA ASN A 83 229.887 218.857 250.773 1.00 0.00 C +ATOM 84 CA ARG A 84 230.994 222.170 252.294 1.00 0.00 C +ATOM 85 CA ILE A 85 231.055 225.964 251.959 1.00 0.00 C +ATOM 86 CA ARG A 86 229.476 228.154 254.648 1.00 0.00 C +ATOM 87 CA GLY A 87 229.958 228.843 258.364 1.00 0.00 C +ATOM 88 CA GLU A 88 227.347 228.414 261.105 1.00 0.00 C +ATOM 89 CA VAL A 89 225.182 225.930 263.018 1.00 0.00 C +ATOM 90 CA LEU A 90 227.483 224.567 265.732 1.00 0.00 C +ATOM 91 CA PRO A 91 227.435 220.987 267.036 1.00 0.00 C +ATOM 92 CA ARG A 92 229.636 218.053 266.006 1.00 0.00 C +ATOM 93 CA GLY A 93 230.421 215.785 263.047 1.00 0.00 C +ATOM 94 CA LYS A 94 227.520 215.969 260.584 1.00 0.00 C +ATOM 95 CA GLU A 95 226.216 219.204 259.050 1.00 0.00 C +ATOM 96 CA GLY A 96 228.625 222.076 259.732 1.00 0.00 C +ATOM 97 CA ARG A 97 232.283 221.241 260.393 1.00 0.00 C +ATOM 98 CA LYS A 98 235.788 221.693 258.971 1.00 0.00 C +ATOM 99 CA GLU A 99 237.082 225.183 259.782 1.00 0.00 C +ATOM 100 CA GLY A 100 240.818 225.514 260.456 1.00 0.00 C +ATOM 101 CA ASP A 101 243.909 226.971 258.772 1.00 0.00 C +ATOM 102 CA GLY A 102 246.907 224.645 259.116 1.00 0.00 C +ATOM 103 CA GLU A 103 249.842 223.007 260.910 1.00 0.00 C +ATOM 104 CA ARG A 104 252.694 225.518 261.193 1.00 0.00 C +ATOM 105 CA TRP A 105 252.417 229.305 261.494 1.00 0.00 C +ATOM 106 CA ARG A 106 254.716 232.280 260.877 1.00 0.00 C +ATOM 107 CA ARG A 107 252.690 235.497 260.625 1.00 0.00 C +ATOM 108 CA ARG A 108 250.165 238.350 260.651 1.00 0.00 C +ATOM 109 CA PRO A 109 248.642 241.500 259.144 1.00 0.00 C +ATOM 110 CA ARG A 110 248.997 244.591 256.944 1.00 0.00 C +ATOM 111 CA GLY A 111 252.223 246.613 257.081 1.00 0.00 C +ATOM 112 CA GLY A 112 252.627 247.489 260.767 1.00 0.00 C +ATOM 113 CA GLY A 113 253.393 250.322 263.196 1.00 0.00 C +ATOM 114 CA GLU A 114 254.942 253.729 263.909 1.00 0.00 C +ATOM 115 CA GLY A 115 258.141 254.765 265.701 1.00 0.00 C +ATOM 116 CA ASN A 116 261.245 255.885 267.605 1.00 0.00 C +ATOM 117 CA PRO A 117 260.504 258.440 270.333 1.00 0.00 C +ATOM 118 CA ARG A 118 260.122 262.108 271.290 1.00 0.00 C +ATOM 119 CA ARG A 119 263.088 264.500 271.230 1.00 0.00 C +ATOM 120 CA ASP A 120 266.712 263.500 270.614 1.00 0.00 C +ATOM 121 CA GLY A 121 266.975 259.809 271.522 1.00 0.00 C +ATOM 122 CA MET A 122 269.983 258.792 273.627 1.00 0.00 C +ATOM 123 CA ASP A 123 271.313 255.277 273.000 1.00 0.00 C +ATOM 124 CA ALA A 124 272.492 252.966 275.790 1.00 0.00 C +ATOM 125 CA ASN A 125 274.590 250.107 274.397 1.00 0.00 C +ATOM 126 CA THR A 126 277.637 248.558 272.714 1.00 0.00 C +ATOM 127 CA PHE A 127 280.017 246.164 270.947 1.00 0.00 C +TER 128 PHE A 127 +END diff --git a/Plants/Q8LLP1/Q8LLP1.dcd b/Plants/Q8LLP1/Q8LLP1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..176b5954af1c4c8d266b50f203bfc5b777b240c1 --- /dev/null +++ b/Plants/Q8LLP1/Q8LLP1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f8e1ae6823b9cf9f97236c042d6efac1fecb31fcaa16339c0979eddf3847feca +size 6440276 diff --git a/Plants/Q8LLP1/top.pdb b/Plants/Q8LLP1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..2cdfe69609524546cc5aff26822262fa9d15ee0d --- /dev/null +++ b/Plants/Q8LLP1/top.pdb @@ -0,0 +1,51 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 248.883 237.896 255.049 1.00 0.00 C +ATOM 2 CA GLU A 2 246.853 239.498 257.847 1.00 0.00 C +ATOM 3 CA GLU A 3 244.110 237.064 258.880 1.00 0.00 C +ATOM 4 CA LYS A 4 243.423 233.476 259.960 1.00 0.00 C +ATOM 5 CA ASP A 5 244.543 232.982 263.569 1.00 0.00 C +ATOM 6 CA ASP A 6 244.619 233.319 267.363 1.00 0.00 C +ATOM 7 CA ASN A 7 248.187 234.040 268.490 1.00 0.00 C +ATOM 8 CA ASP A 8 251.304 235.474 266.834 1.00 0.00 C +ATOM 9 CA ASN A 9 252.549 236.902 263.529 1.00 0.00 C +ATOM 10 CA GLY A 10 254.150 240.347 263.825 1.00 0.00 C +ATOM 11 CA GLY A 11 255.988 241.013 267.096 1.00 0.00 C +ATOM 12 CA ASP A 12 256.403 244.774 267.539 1.00 0.00 C +ATOM 13 CA SER A 13 254.500 246.877 270.083 1.00 0.00 C +ATOM 14 CA ASP A 14 254.030 250.485 268.954 1.00 0.00 C +ATOM 15 CA GLY A 15 251.671 253.095 267.491 1.00 0.00 C +ATOM 16 CA ARG A 16 248.002 252.094 267.256 1.00 0.00 C +ATOM 17 CA THR A 17 246.254 254.803 265.226 1.00 0.00 C +ATOM 18 CA ARG A 18 246.453 255.982 261.609 1.00 0.00 C +ATOM 19 CA ARG A 19 249.216 254.322 259.578 1.00 0.00 C +ATOM 20 CA MET A 20 252.345 252.160 259.346 1.00 0.00 C +ATOM 21 CA ALA A 21 254.665 253.029 256.452 1.00 0.00 C +ATOM 22 CA THR A 22 256.179 250.309 254.255 1.00 0.00 C +ATOM 23 CA THR A 23 254.405 249.191 251.073 1.00 0.00 C +ATOM 24 CA VAL A 24 254.552 248.105 247.425 1.00 0.00 C +ATOM 25 CA ALA A 25 254.803 250.740 244.685 1.00 0.00 C +ATOM 26 CA VAL A 26 255.965 252.380 241.448 1.00 0.00 C +ATOM 27 CA THR A 27 256.211 249.546 238.913 1.00 0.00 C +ATOM 28 CA VAL A 28 258.448 248.281 236.100 1.00 0.00 C +ATOM 29 CA GLY A 29 260.689 251.013 234.675 1.00 0.00 C +ATOM 30 CA ARG A 30 261.563 253.993 232.469 1.00 0.00 C +ATOM 31 CA MET A 31 262.697 256.375 229.720 1.00 0.00 C +ATOM 32 CA ARG A 32 260.514 256.241 226.600 1.00 0.00 C +ATOM 33 CA THR A 33 257.626 253.798 226.145 1.00 0.00 C +ATOM 34 CA ARG A 34 255.032 252.156 228.401 1.00 0.00 C +ATOM 35 CA THR A 35 251.687 253.725 227.473 1.00 0.00 C +ATOM 36 CA THR A 36 250.048 256.192 229.870 1.00 0.00 C +ATOM 37 CA THR A 37 246.689 255.891 231.642 1.00 0.00 C +ATOM 38 CA ALA A 38 243.850 255.793 234.181 1.00 0.00 C +ATOM 39 CA ALA A 39 242.370 257.814 237.052 1.00 0.00 C +ATOM 40 CA THR A 40 244.729 259.619 239.438 1.00 0.00 C +ATOM 41 CA ARG A 41 245.314 260.069 243.176 1.00 0.00 C +ATOM 42 CA GLY A 42 242.424 260.067 245.657 1.00 0.00 C +ATOM 43 CA GLN A 43 240.674 256.718 245.170 1.00 0.00 C +ATOM 44 CA GLY A 44 236.990 256.146 245.958 1.00 0.00 C +ATOM 45 CA ARG A 45 234.917 259.129 247.109 1.00 0.00 C +ATOM 46 CA ARG A 46 235.458 262.845 246.464 1.00 0.00 C +ATOM 47 CA ARG A 47 238.018 264.228 248.924 1.00 0.00 C +TER 48 ARG A 47 +END diff --git a/Plants/Q8LM55/Q8LM55.dcd b/Plants/Q8LM55/Q8LM55.dcd new file mode 100644 index 0000000000000000000000000000000000000000..02700b2df65cc00b685c43c981ae6e39121b26ce --- /dev/null +++ b/Plants/Q8LM55/Q8LM55.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:d039f7c1c534e07d06d3af28209a4fe822ea5e65518c25f93eaa2ddff7d4a1f2 +size 8840276 diff --git a/Plants/Q8LM55/top.pdb b/Plants/Q8LM55/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a07e0f6b5db05b0b623b245a07c63257dac617d5 --- /dev/null +++ b/Plants/Q8LM55/top.pdb @@ -0,0 +1,71 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 245.280 277.410 236.629 1.00 0.00 C +ATOM 2 CA ASP A 2 246.250 273.797 235.908 1.00 0.00 C +ATOM 3 CA VAL A 3 244.782 272.251 232.751 1.00 0.00 C +ATOM 4 CA THR A 4 244.041 268.626 233.660 1.00 0.00 C +ATOM 5 CA SER A 5 246.243 265.964 235.266 1.00 0.00 C +ATOM 6 CA SER A 6 249.113 263.718 234.154 1.00 0.00 C +ATOM 7 CA ALA A 7 247.469 260.579 232.753 1.00 0.00 C +ATOM 8 CA VAL A 8 244.051 259.400 233.954 1.00 0.00 C +ATOM 9 CA VAL A 9 243.024 260.991 237.261 1.00 0.00 C +ATOM 10 CA ALA A 10 240.704 263.874 238.164 1.00 0.00 C +ATOM 11 CA ALA A 11 237.698 263.423 240.462 1.00 0.00 C +ATOM 12 CA SER A 12 237.857 260.501 242.902 1.00 0.00 C +ATOM 13 CA LYS A 13 235.824 257.282 243.055 1.00 0.00 C +ATOM 14 CA SER A 14 234.627 253.806 244.053 1.00 0.00 C +ATOM 15 CA GLU A 15 236.064 250.599 242.581 1.00 0.00 C +ATOM 16 CA SER A 16 238.796 248.319 243.944 1.00 0.00 C +ATOM 17 CA ALA A 17 242.055 246.441 244.548 1.00 0.00 C +ATOM 18 CA SER A 18 241.895 243.008 246.192 1.00 0.00 C +ATOM 19 CA ALA A 19 243.532 241.208 249.125 1.00 0.00 C +ATOM 20 CA GLY A 20 242.854 238.834 252.026 1.00 0.00 C +ATOM 21 CA GLY A 21 242.338 240.818 255.238 1.00 0.00 C +ATOM 22 CA VAL A 22 244.946 240.378 257.980 1.00 0.00 C +ATOM 23 CA VAL A 23 243.162 241.432 261.178 1.00 0.00 C +ATOM 24 CA GLY A 24 240.128 242.881 262.968 1.00 0.00 C +ATOM 25 CA VAL A 25 241.186 245.416 265.608 1.00 0.00 C +ATOM 26 CA GLY A 26 241.176 248.960 264.208 1.00 0.00 C +ATOM 27 CA VAL A 27 239.695 251.680 261.989 1.00 0.00 C +ATOM 28 CA SER A 28 242.080 254.490 261.026 1.00 0.00 C +ATOM 29 CA ARG A 29 245.804 255.163 261.465 1.00 0.00 C +ATOM 30 CA GLU A 30 248.757 257.040 259.957 1.00 0.00 C +ATOM 31 CA ARG A 31 248.475 260.639 258.740 1.00 0.00 C +ATOM 32 CA ARG A 32 251.478 262.967 259.023 1.00 0.00 C +ATOM 33 CA ARG A 33 252.734 263.827 262.515 1.00 0.00 C +ATOM 34 CA TRP A 34 252.143 261.590 265.542 1.00 0.00 C +ATOM 35 CA ARG A 35 252.066 257.790 265.279 1.00 0.00 C +ATOM 36 CA GLN A 36 253.780 254.570 264.179 1.00 0.00 C +ATOM 37 CA HIS A 37 255.471 253.145 261.077 1.00 0.00 C +ATOM 38 CA ARG A 38 255.137 249.490 260.054 1.00 0.00 C +ATOM 39 CA GLN A 39 252.646 249.258 257.181 1.00 0.00 C +ATOM 40 CA ARG A 40 249.344 250.967 256.353 1.00 0.00 C +ATOM 41 CA ALA A 41 247.047 252.328 253.634 1.00 0.00 C +ATOM 42 CA ARG A 42 247.948 254.732 250.819 1.00 0.00 C +ATOM 43 CA ARG A 43 251.406 254.044 249.375 1.00 0.00 C +ATOM 44 CA ARG A 44 253.856 256.833 248.517 1.00 0.00 C +ATOM 45 CA HIS A 45 257.442 255.588 248.843 1.00 0.00 C +ATOM 46 CA GLY A 46 257.216 252.103 250.367 1.00 0.00 C +ATOM 47 CA GLY A 47 260.400 250.814 252.015 1.00 0.00 C +ATOM 48 CA GLY A 48 261.144 247.134 252.663 1.00 0.00 C +ATOM 49 CA GLY A 49 261.551 246.364 256.372 1.00 0.00 C +ATOM 50 CA GLU A 50 261.459 243.681 259.076 1.00 0.00 C +ATOM 51 CA ASP A 51 260.138 243.943 262.640 1.00 0.00 C +ATOM 52 CA ARG A 52 257.319 241.462 263.286 1.00 0.00 C +ATOM 53 CA LYS A 53 257.415 238.016 264.908 1.00 0.00 C +ATOM 54 CA THR A 54 259.283 235.502 262.738 1.00 0.00 C +ATOM 55 CA THR A 55 261.499 234.356 259.859 1.00 0.00 C +ATOM 56 CA ALA A 56 264.349 235.401 257.557 1.00 0.00 C +ATOM 57 CA ARG A 57 263.233 234.708 253.980 1.00 0.00 C +ATOM 58 CA ASP A 58 260.450 236.263 251.895 1.00 0.00 C +ATOM 59 CA ASP A 59 260.712 237.865 248.448 1.00 0.00 C +ATOM 60 CA GLY A 60 259.565 237.143 244.887 1.00 0.00 C +ATOM 61 CA GLY A 61 259.456 238.621 241.377 1.00 0.00 C +ATOM 62 CA VAL A 62 256.289 239.717 239.563 1.00 0.00 C +ATOM 63 CA GLY A 63 254.493 237.359 237.169 1.00 0.00 C +ATOM 64 CA VAL A 64 255.308 235.282 234.081 1.00 0.00 C +ATOM 65 CA GLY A 65 255.914 232.636 231.408 1.00 0.00 C +ATOM 66 CA LEU A 66 254.515 231.531 228.041 1.00 0.00 C +ATOM 67 CA PRO A 67 255.892 234.047 225.533 1.00 0.00 C +TER 68 PRO A 67 +END diff --git a/Plants/Q8LMC8/Q8LMC8.dcd b/Plants/Q8LMC8/Q8LMC8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..0557f6d491438668fed9b065b1f1f48649839f09 --- /dev/null +++ b/Plants/Q8LMC8/Q8LMC8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e6dcb759132bb0f4f3acab4d5a849f3f48c3d811ce12096c30694862655a1b83 +size 42240276 diff --git a/Plants/Q8LMC8/top.pdb b/Plants/Q8LMC8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..089b3397e0afa95eeab7423ef4fe152762c6ee42 --- /dev/null +++ b/Plants/Q8LMC8/top.pdb @@ -0,0 +1,232 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 281.363 290.381 260.368 1.00 0.00 C +ATOM 2 CA ARG A 2 284.991 289.850 261.406 1.00 0.00 C +ATOM 3 CA ALA A 3 286.223 293.309 262.421 1.00 0.00 C +ATOM 4 CA PRO A 4 289.749 293.418 263.859 1.00 0.00 C +ATOM 5 CA ARG A 5 293.267 294.874 263.712 1.00 0.00 C +ATOM 6 CA ALA A 6 295.928 294.533 266.417 1.00 0.00 C +ATOM 7 CA ALA A 7 296.112 296.659 269.574 1.00 0.00 C +ATOM 8 CA ALA A 8 298.671 298.794 271.421 1.00 0.00 C +ATOM 9 CA GLN A 9 302.086 299.244 273.048 1.00 0.00 C +ATOM 10 CA GLY A 10 304.653 296.428 273.055 1.00 0.00 C +ATOM 11 CA GLY A 11 303.779 293.458 270.833 1.00 0.00 C +ATOM 12 CA ARG A 12 305.816 290.593 269.363 1.00 0.00 C +ATOM 13 CA ASP A 13 308.459 288.110 268.198 1.00 0.00 C +ATOM 14 CA ALA A 14 307.909 284.701 269.809 1.00 0.00 C +ATOM 15 CA ALA A 15 307.251 284.641 273.561 1.00 0.00 C +ATOM 16 CA GLY A 16 305.320 284.122 276.804 1.00 0.00 C +ATOM 17 CA GLY A 17 303.451 280.935 277.736 1.00 0.00 C +ATOM 18 CA SER A 18 302.194 277.470 278.701 1.00 0.00 C +ATOM 19 CA ALA A 19 299.140 275.951 277.003 1.00 0.00 C +ATOM 20 CA GLN A 20 295.889 277.917 276.718 1.00 0.00 C +ATOM 21 CA LEU A 21 295.349 281.399 278.168 1.00 0.00 C +ATOM 22 CA LYS A 22 295.804 281.184 281.945 1.00 0.00 C +ATOM 23 CA PRO A 23 298.219 278.608 283.374 1.00 0.00 C +ATOM 24 CA ALA A 24 300.174 276.073 285.440 1.00 0.00 C +ATOM 25 CA GLY A 25 298.040 273.509 287.280 1.00 0.00 C +ATOM 26 CA HIS A 26 294.433 272.285 287.379 1.00 0.00 C +ATOM 27 CA GLY A 27 291.083 272.892 285.668 1.00 0.00 C +ATOM 28 CA ALA A 28 289.208 275.686 287.453 1.00 0.00 C +ATOM 29 CA VAL A 29 286.879 275.205 290.431 1.00 0.00 C +ATOM 30 CA ALA A 30 283.525 273.399 290.362 1.00 0.00 C +ATOM 31 CA ALA A 31 281.344 270.921 292.262 1.00 0.00 C +ATOM 32 CA ALA A 32 278.031 269.081 292.661 1.00 0.00 C +ATOM 33 CA ARG A 33 278.137 265.651 294.315 1.00 0.00 C +ATOM 34 CA GLY A 34 274.557 264.944 295.407 1.00 0.00 C +ATOM 35 CA HIS A 35 272.657 267.546 297.440 1.00 0.00 C +ATOM 36 CA GLN A 36 270.519 270.354 298.875 1.00 0.00 C +ATOM 37 CA ARG A 37 267.403 271.497 300.746 1.00 0.00 C +ATOM 38 CA ILE A 38 268.315 271.647 304.442 1.00 0.00 C +ATOM 39 CA ALA A 39 271.337 270.862 306.627 1.00 0.00 C +ATOM 40 CA ARG A 40 274.426 270.848 304.396 1.00 0.00 C +ATOM 41 CA GLN A 41 278.212 270.536 304.685 1.00 0.00 C +ATOM 42 CA ARG A 42 281.136 272.232 306.443 1.00 0.00 C +ATOM 43 CA ARG A 43 284.619 273.707 305.985 1.00 0.00 C +ATOM 44 CA SER A 44 285.623 276.152 308.729 1.00 0.00 C +ATOM 45 CA ALA A 45 283.788 276.977 311.964 1.00 0.00 C +ATOM 46 CA ARG A 46 283.359 274.053 314.368 1.00 0.00 C +ATOM 47 CA ARG A 47 280.189 274.413 316.451 1.00 0.00 C +ATOM 48 CA ARG A 48 277.482 272.128 315.047 1.00 0.00 C +ATOM 49 CA ARG A 49 275.826 272.612 311.650 1.00 0.00 C +ATOM 50 CA ARG A 50 273.346 275.282 310.538 1.00 0.00 C +ATOM 51 CA THR A 51 274.546 278.600 309.102 1.00 0.00 C +ATOM 52 CA ALA A 52 275.446 278.806 305.405 1.00 0.00 C +ATOM 53 CA GLY A 53 273.996 280.999 302.647 1.00 0.00 C +ATOM 54 CA ALA A 54 275.038 279.238 299.433 1.00 0.00 C +ATOM 55 CA ALA A 55 272.121 277.529 297.675 1.00 0.00 C +ATOM 56 CA ALA A 56 273.593 276.303 294.381 1.00 0.00 C +ATOM 57 CA ARG A 57 272.729 273.698 291.739 1.00 0.00 C +ATOM 58 CA PRO A 58 271.196 273.494 288.257 1.00 0.00 C +ATOM 59 CA THR A 59 267.736 271.929 287.942 1.00 0.00 C +ATOM 60 CA ALA A 60 266.277 269.996 290.884 1.00 0.00 C +ATOM 61 CA ALA A 61 263.522 270.483 293.470 1.00 0.00 C +ATOM 62 CA ALA A 62 262.959 274.223 293.934 1.00 0.00 C +ATOM 63 CA HIS A 63 264.415 277.571 295.023 1.00 0.00 C +ATOM 64 CA VAL A 64 266.090 280.821 293.951 1.00 0.00 C +ATOM 65 CA GLY A 65 266.918 283.478 296.553 1.00 0.00 C +ATOM 66 CA ARG A 66 265.031 283.306 299.859 1.00 0.00 C +ATOM 67 CA GLU A 67 263.680 283.615 303.408 1.00 0.00 C +ATOM 68 CA ARG A 68 260.181 284.299 304.752 1.00 0.00 C +ATOM 69 CA LYS A 69 259.397 287.462 306.727 1.00 0.00 C +ATOM 70 CA GLY A 70 258.189 290.832 305.424 1.00 0.00 C +ATOM 71 CA GLY A 71 254.600 291.262 306.630 1.00 0.00 C +ATOM 72 CA GLY A 72 253.264 292.513 309.971 1.00 0.00 C +ATOM 73 CA GLY A 73 250.170 290.432 310.750 1.00 0.00 C +ATOM 74 CA SER A 74 247.328 289.550 308.370 1.00 0.00 C +ATOM 75 CA PRO A 75 245.012 287.198 306.468 1.00 0.00 C +ATOM 76 CA HIS A 76 243.475 285.603 303.368 1.00 0.00 C +ATOM 77 CA ARG A 77 242.568 288.062 300.603 1.00 0.00 C +ATOM 78 CA ARG A 78 242.472 291.437 298.838 1.00 0.00 C +ATOM 79 CA LYS A 79 243.266 293.248 295.581 1.00 0.00 C +ATOM 80 CA ARG A 80 246.609 294.354 294.126 1.00 0.00 C +ATOM 81 CA TRP A 81 245.920 296.199 290.864 1.00 0.00 C +ATOM 82 CA ARG A 82 248.586 296.001 288.149 1.00 0.00 C +ATOM 83 CA PRO A 83 251.238 296.665 285.496 1.00 0.00 C +ATOM 84 CA ALA A 84 254.337 294.525 286.073 1.00 0.00 C +ATOM 85 CA ARG A 85 257.788 294.847 284.490 1.00 0.00 C +ATOM 86 CA GLU A 86 259.057 296.064 281.111 1.00 0.00 C +ATOM 87 CA ASN A 87 260.485 294.981 277.748 1.00 0.00 C +ATOM 88 CA GLU A 88 258.961 293.366 274.652 1.00 0.00 C +ATOM 89 CA VAL A 89 255.497 291.832 275.055 1.00 0.00 C +ATOM 90 CA GLY A 90 251.916 292.222 276.295 1.00 0.00 C +ATOM 91 CA GLY A 91 248.291 293.212 275.664 1.00 0.00 C +ATOM 92 CA ASP A 92 245.512 293.728 278.219 1.00 0.00 C +ATOM 93 CA ASP A 93 246.567 292.424 281.640 1.00 0.00 C +ATOM 94 CA ARG A 94 244.037 289.890 282.941 1.00 0.00 C +ATOM 95 CA ARG A 95 243.083 287.171 280.449 1.00 0.00 C +ATOM 96 CA CYS A 96 244.825 284.192 278.834 1.00 0.00 C +ATOM 97 CA ARG A 97 245.037 284.999 275.116 1.00 0.00 C +ATOM 98 CA GLY A 98 245.900 281.741 273.340 1.00 0.00 C +ATOM 99 CA THR A 99 244.670 278.274 274.331 1.00 0.00 C +ATOM 100 CA ASP A 100 241.369 276.392 274.045 1.00 0.00 C +ATOM 101 CA ARG A 101 239.992 277.394 270.637 1.00 0.00 C +ATOM 102 CA ARG A 102 236.478 278.808 271.044 1.00 0.00 C +ATOM 103 CA ARG A 103 232.984 277.451 270.358 1.00 0.00 C +ATOM 104 CA ARG A 104 233.033 273.815 271.495 1.00 0.00 C +ATOM 105 CA HIS A 105 233.935 270.611 269.641 1.00 0.00 C +ATOM 106 CA ALA A 106 234.433 267.784 267.136 1.00 0.00 C +ATOM 107 CA ARG A 107 237.520 265.847 266.022 1.00 0.00 C +ATOM 108 CA ARG A 108 240.096 263.049 265.808 1.00 0.00 C +ATOM 109 CA ARG A 109 243.502 264.713 266.192 1.00 0.00 C +ATOM 110 CA ARG A 110 243.655 266.399 269.605 1.00 0.00 C +ATOM 111 CA ARG A 111 243.868 265.686 273.342 1.00 0.00 C +ATOM 112 CA GLY A 112 242.312 263.172 275.744 1.00 0.00 C +ATOM 113 CA VAL A 113 242.462 259.367 275.872 1.00 0.00 C +ATOM 114 CA ARG A 114 240.289 258.054 273.031 1.00 0.00 C +ATOM 115 CA ARG A 115 241.319 254.456 272.317 1.00 0.00 C +ATOM 116 CA GLY A 116 244.024 251.783 272.077 1.00 0.00 C +ATOM 117 CA ASP A 117 244.547 248.313 270.595 1.00 0.00 C +ATOM 118 CA ASP A 118 248.094 247.924 269.260 1.00 0.00 C +ATOM 119 CA ASP A 119 248.222 246.721 265.647 1.00 0.00 C +ATOM 120 CA HIS A 120 246.015 246.734 262.541 1.00 0.00 C +ATOM 121 CA GLY A 121 242.275 247.460 262.516 1.00 0.00 C +ATOM 122 CA SER A 122 240.980 249.747 259.757 1.00 0.00 C +ATOM 123 CA LEU A 123 240.633 248.513 256.170 1.00 0.00 C +ATOM 124 CA LYS A 124 237.613 250.334 254.727 1.00 0.00 C +ATOM 125 CA ARG A 125 235.653 247.664 252.844 1.00 0.00 C +ATOM 126 CA ARG A 126 236.936 244.166 253.640 1.00 0.00 C +ATOM 127 CA PRO A 127 238.082 241.143 255.657 1.00 0.00 C +ATOM 128 CA LYS A 128 240.184 238.215 254.423 1.00 0.00 C +ATOM 129 CA MET A 129 238.848 234.757 253.544 1.00 0.00 C +ATOM 130 CA GLY A 130 237.742 232.080 256.019 1.00 0.00 C +ATOM 131 CA ARG A 131 239.598 228.757 255.847 1.00 0.00 C +ATOM 132 CA THR A 132 242.368 227.383 258.073 1.00 0.00 C +ATOM 133 CA ALA A 133 244.271 224.282 259.204 1.00 0.00 C +ATOM 134 CA ARG A 134 243.688 220.519 259.093 1.00 0.00 C +ATOM 135 CA LEU A 135 241.780 217.556 257.644 1.00 0.00 C +ATOM 136 CA THR A 136 241.092 214.108 256.176 1.00 0.00 C +ATOM 137 CA GLY A 137 243.687 211.855 254.533 1.00 0.00 C +ATOM 138 CA VAL A 138 246.685 211.298 252.248 1.00 0.00 C +ATOM 139 CA ARG A 139 248.087 213.189 249.252 1.00 0.00 C +ATOM 140 CA GLY A 140 249.685 215.281 246.498 1.00 0.00 C +ATOM 141 CA ASP A 141 250.485 216.380 242.939 1.00 0.00 C +ATOM 142 CA ARG A 142 251.613 219.728 241.513 1.00 0.00 C +ATOM 143 CA ARG A 143 253.777 219.503 238.385 1.00 0.00 C +ATOM 144 CA SER A 144 253.830 215.835 237.358 1.00 0.00 C +ATOM 145 CA GLY A 145 255.142 212.480 236.118 1.00 0.00 C +ATOM 146 CA GLY A 146 256.085 210.400 233.069 1.00 0.00 C +ATOM 147 CA MET A 147 254.889 211.617 229.662 1.00 0.00 C +ATOM 148 CA PRO A 148 258.025 212.172 227.571 1.00 0.00 C +ATOM 149 CA ALA A 149 258.075 213.954 224.204 1.00 0.00 C +ATOM 150 CA THR A 150 259.886 215.195 221.089 1.00 0.00 C +ATOM 151 CA ARG A 151 257.744 215.392 217.945 1.00 0.00 C +ATOM 152 CA GLY A 152 257.490 212.160 215.943 1.00 0.00 C +ATOM 153 CA GLY A 153 254.527 212.466 213.568 1.00 0.00 C +ATOM 154 CA SER A 154 252.064 214.229 211.257 1.00 0.00 C +ATOM 155 CA ARG A 155 250.080 211.981 208.906 1.00 0.00 C +ATOM 156 CA GLU A 156 251.505 208.448 208.985 1.00 0.00 C +ATOM 157 CA SER A 157 254.573 206.515 207.815 1.00 0.00 C +ATOM 158 CA SER A 158 256.264 207.348 204.504 1.00 0.00 C +ATOM 159 CA CYS A 159 254.499 208.644 201.387 1.00 0.00 C +ATOM 160 CA GLY A 160 251.600 209.614 199.113 1.00 0.00 C +ATOM 161 CA GLY A 161 247.848 210.141 199.515 1.00 0.00 C +ATOM 162 CA GLU A 162 247.082 212.622 202.304 1.00 0.00 C +ATOM 163 CA ALA A 163 248.532 216.031 203.192 1.00 0.00 C +ATOM 164 CA ASN A 164 250.171 218.296 205.781 1.00 0.00 C +ATOM 165 CA GLY A 165 250.335 222.097 205.592 1.00 0.00 C +ATOM 166 CA GLY A 166 248.908 225.405 206.835 1.00 0.00 C +ATOM 167 CA GLY A 167 250.961 228.226 208.365 1.00 0.00 C +ATOM 168 CA PRO A 168 253.928 230.591 208.013 1.00 0.00 C +ATOM 169 CA SER A 169 253.996 232.026 204.484 1.00 0.00 C +ATOM 170 CA SER A 170 253.960 231.520 200.708 1.00 0.00 C +ATOM 171 CA ASP A 171 257.360 231.516 198.990 1.00 0.00 C +ATOM 172 CA GLY A 172 256.786 233.308 195.677 1.00 0.00 C +ATOM 173 CA ALA A 173 253.788 232.335 193.538 1.00 0.00 C +ATOM 174 CA ARG A 174 250.122 233.101 192.836 1.00 0.00 C +ATOM 175 CA PRO A 175 248.013 236.085 191.756 1.00 0.00 C +ATOM 176 CA GLU A 176 245.174 238.582 192.227 1.00 0.00 C +ATOM 177 CA MET A 177 242.017 240.470 191.236 1.00 0.00 C +ATOM 178 CA GLY A 178 238.988 242.778 191.116 1.00 0.00 C +ATOM 179 CA GLY A 179 235.386 242.409 192.302 1.00 0.00 C +ATOM 180 CA GLY A 180 232.523 240.015 193.070 1.00 0.00 C +ATOM 181 CA GLY A 181 229.881 237.349 192.419 1.00 0.00 C +ATOM 182 CA GLY A 182 231.260 234.119 193.896 1.00 0.00 C +ATOM 183 CA ALA A 183 231.143 230.353 194.463 1.00 0.00 C +ATOM 184 CA ARG A 184 232.306 226.950 193.206 1.00 0.00 C +ATOM 185 CA ARG A 185 235.457 224.881 193.766 1.00 0.00 C +ATOM 186 CA ALA A 186 237.923 224.700 190.867 1.00 0.00 C +ATOM 187 CA ARG A 187 237.579 222.183 188.028 1.00 0.00 C +ATOM 188 CA ARG A 188 236.258 218.655 188.602 1.00 0.00 C +ATOM 189 CA GLY A 189 233.378 217.372 190.741 1.00 0.00 C +ATOM 190 CA GLY A 190 232.189 215.474 193.823 1.00 0.00 C +ATOM 191 CA GLY A 191 229.836 212.833 195.237 1.00 0.00 C +ATOM 192 CA ARG A 192 231.236 211.911 198.659 1.00 0.00 C +ATOM 193 CA GLY A 193 228.832 210.189 201.061 1.00 0.00 C +ATOM 194 CA ARG A 194 226.926 207.010 200.180 1.00 0.00 C +ATOM 195 CA GLY A 195 223.255 207.997 200.444 1.00 0.00 C +ATOM 196 CA TRP A 196 219.539 208.816 200.269 1.00 0.00 C +ATOM 197 CA LYS A 197 217.102 205.964 200.935 1.00 0.00 C +ATOM 198 CA ARG A 198 213.437 205.726 201.947 1.00 0.00 C +ATOM 199 CA ARG A 199 211.140 202.957 200.692 1.00 0.00 C +ATOM 200 CA GLY A 200 207.556 201.672 200.827 1.00 0.00 C +ATOM 201 CA ARG A 201 204.701 203.722 202.298 1.00 0.00 C +ATOM 202 CA LYS A 202 202.295 206.656 202.643 1.00 0.00 C +ATOM 203 CA THR A 203 199.848 209.177 201.169 1.00 0.00 C +ATOM 204 CA ARG A 204 200.641 212.726 200.032 1.00 0.00 C +ATOM 205 CA ARG A 205 199.840 213.175 196.334 1.00 0.00 C +ATOM 206 CA GLY A 206 201.962 214.417 193.424 1.00 0.00 C +ATOM 207 CA LEU A 207 201.246 212.920 189.994 1.00 0.00 C +ATOM 208 CA GLY A 208 201.496 211.400 186.510 1.00 0.00 C +ATOM 209 CA GLY A 209 202.303 208.990 183.671 1.00 0.00 C +ATOM 210 CA ALA A 210 201.123 205.411 184.234 1.00 0.00 C +ATOM 211 CA ILE A 211 202.786 202.284 185.639 1.00 0.00 C +ATOM 212 CA TYR A 212 205.662 200.689 183.715 1.00 0.00 C +ATOM 213 CA GLY A 213 205.785 202.020 180.147 1.00 0.00 C +ATOM 214 CA ARG A 214 205.109 202.564 176.438 1.00 0.00 C +ATOM 215 CA GLY A 215 201.457 203.199 175.557 1.00 0.00 C +ATOM 216 CA ARG A 216 199.087 203.948 172.669 1.00 0.00 C +ATOM 217 CA GLY A 217 195.377 204.373 173.424 1.00 0.00 C +ATOM 218 CA ARG A 218 192.673 203.371 175.914 1.00 0.00 C +ATOM 219 CA ASN A 219 191.546 201.878 179.233 1.00 0.00 C +ATOM 220 CA GLY A 220 188.296 202.108 181.209 1.00 0.00 C +ATOM 221 CA GLN A 221 185.070 200.163 180.636 1.00 0.00 C +ATOM 222 CA GLY A 222 183.587 196.766 181.518 1.00 0.00 C +ATOM 223 CA GLY A 223 182.813 195.527 185.036 1.00 0.00 C +ATOM 224 CA PRO A 224 184.374 194.650 188.399 1.00 0.00 C +ATOM 225 CA LEU A 225 183.745 192.466 191.457 1.00 0.00 C +ATOM 226 CA LEU A 226 186.379 192.165 194.194 1.00 0.00 C +ATOM 227 CA ARG A 227 189.387 194.256 193.147 1.00 0.00 C +ATOM 228 CA ARG A 228 190.308 197.730 191.881 1.00 0.00 C +TER 229 ARG A 228 +END diff --git a/Plants/Q8LMJ5/Q8LMJ5.dcd b/Plants/Q8LMJ5/Q8LMJ5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..a3dfb153ca9064a52f3036820d80254950b3a523 --- /dev/null +++ b/Plants/Q8LMJ5/Q8LMJ5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:79f1d4b333e725474daa63e1ad1e155012a1d0315483b76c3ca448510feb5a0b +size 10280276 diff --git a/Plants/Q8LMJ5/top.pdb b/Plants/Q8LMJ5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..ac8e81812e0e19c5cf17937d36a8318c794ab426 --- /dev/null +++ b/Plants/Q8LMJ5/top.pdb @@ -0,0 +1,83 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 270.432 259.539 270.644 1.00 0.00 C +ATOM 2 CA ASP A 2 268.407 256.642 272.065 1.00 0.00 C +ATOM 3 CA GLY A 3 265.178 254.931 273.146 1.00 0.00 C +ATOM 4 CA ASP A 4 265.658 251.273 272.197 1.00 0.00 C +ATOM 5 CA VAL A 5 264.374 250.772 268.646 1.00 0.00 C +ATOM 6 CA GLY A 6 266.701 252.709 266.334 1.00 0.00 C +ATOM 7 CA PRO A 7 264.379 254.785 264.138 1.00 0.00 C +ATOM 8 CA ARG A 8 263.135 257.658 261.967 1.00 0.00 C +ATOM 9 CA MET A 9 260.268 260.119 262.458 1.00 0.00 C +ATOM 10 CA SER A 10 256.614 259.358 261.692 1.00 0.00 C +ATOM 11 CA GLY A 11 252.991 260.515 261.909 1.00 0.00 C +ATOM 12 CA ARG A 12 250.162 261.707 259.652 1.00 0.00 C +ATOM 13 CA ARG A 13 248.618 265.098 258.858 1.00 0.00 C +ATOM 14 CA ALA A 14 247.317 268.432 257.550 1.00 0.00 C +ATOM 15 CA ALA A 15 249.713 270.504 255.433 1.00 0.00 C +ATOM 16 CA GLY A 16 249.831 272.431 252.148 1.00 0.00 C +ATOM 17 CA ILE A 17 246.798 274.366 250.895 1.00 0.00 C +ATOM 18 CA PRO A 18 243.920 271.875 251.059 1.00 0.00 C +ATOM 19 CA ALA A 19 242.958 268.671 249.235 1.00 0.00 C +ATOM 20 CA THR A 20 240.155 266.091 249.203 1.00 0.00 C +ATOM 21 CA PRO A 21 237.743 263.976 247.148 1.00 0.00 C +ATOM 22 CA LEU A 22 236.414 261.785 244.328 1.00 0.00 C +ATOM 23 CA PRO A 23 233.020 262.888 242.995 1.00 0.00 C +ATOM 24 CA ASP A 24 230.849 264.130 245.868 1.00 0.00 C +ATOM 25 CA SER A 25 231.545 265.055 249.498 1.00 0.00 C +ATOM 26 CA ARG A 26 233.587 264.003 252.538 1.00 0.00 C +ATOM 27 CA ALA A 27 231.399 262.108 255.015 1.00 0.00 C +ATOM 28 CA SER A 28 229.810 259.115 253.274 1.00 0.00 C +ATOM 29 CA ARG A 29 226.176 258.595 252.255 1.00 0.00 C +ATOM 30 CA ALA A 30 223.580 256.481 250.436 1.00 0.00 C +ATOM 31 CA SER A 31 222.402 253.393 248.541 1.00 0.00 C +ATOM 32 CA PRO A 32 224.089 252.086 245.384 1.00 0.00 C +ATOM 33 CA ALA A 33 224.177 248.280 245.249 1.00 0.00 C +ATOM 34 CA GLY A 34 220.899 246.528 244.410 1.00 0.00 C +ATOM 35 CA ASP A 35 217.119 246.076 244.267 1.00 0.00 C +ATOM 36 CA VAL A 36 215.897 245.546 247.836 1.00 0.00 C +ATOM 37 CA HIS A 37 217.268 245.455 251.390 1.00 0.00 C +ATOM 38 CA ALA A 38 217.608 244.173 254.961 1.00 0.00 C +ATOM 39 CA LEU A 39 215.098 244.295 257.825 1.00 0.00 C +ATOM 40 CA ALA A 40 215.803 241.969 260.760 1.00 0.00 C +ATOM 41 CA ALA A 41 219.007 241.691 262.803 1.00 0.00 C +ATOM 42 CA GLY A 42 222.384 241.345 261.072 1.00 0.00 C +ATOM 43 CA PRO A 43 225.672 239.431 260.881 1.00 0.00 C +ATOM 44 CA ARG A 44 228.462 241.906 260.098 1.00 0.00 C +ATOM 45 CA HIS A 45 232.084 242.610 261.048 1.00 0.00 C +ATOM 46 CA HIS A 46 235.406 244.471 261.187 1.00 0.00 C +ATOM 47 CA GLY A 47 235.302 247.041 258.376 1.00 0.00 C +ATOM 48 CA ARG A 48 235.473 247.941 254.677 1.00 0.00 C +ATOM 49 CA ALA A 49 238.411 246.184 253.005 1.00 0.00 C +ATOM 50 CA THR A 50 241.003 243.877 254.579 1.00 0.00 C +ATOM 51 CA ARG A 51 242.597 241.940 251.711 1.00 0.00 C +ATOM 52 CA ARG A 52 242.704 238.431 250.231 1.00 0.00 C +ATOM 53 CA THR A 53 243.515 237.881 246.549 1.00 0.00 C +ATOM 54 CA PRO A 54 242.238 235.852 243.588 1.00 0.00 C +ATOM 55 CA GLY A 55 244.022 234.208 240.650 1.00 0.00 C +ATOM 56 CA LYS A 56 247.040 234.607 238.360 1.00 0.00 C +ATOM 57 CA LYS A 57 248.925 237.638 237.027 1.00 0.00 C +ATOM 58 CA ARG A 58 252.620 236.975 237.680 1.00 0.00 C +ATOM 59 CA CYS A 59 253.446 239.073 240.752 1.00 0.00 C +ATOM 60 CA TYR A 60 255.516 238.471 243.893 1.00 0.00 C +ATOM 61 CA ARG A 61 258.180 241.046 244.784 1.00 0.00 C +ATOM 62 CA LYS A 62 261.038 241.141 247.301 1.00 0.00 C +ATOM 63 CA PRO A 63 264.192 240.097 249.167 1.00 0.00 C +ATOM 64 CA GLY A 64 267.058 238.405 247.314 1.00 0.00 C +ATOM 65 CA ILE A 65 269.412 240.065 244.820 1.00 0.00 C +ATOM 66 CA ARG A 66 270.970 237.148 242.927 1.00 0.00 C +ATOM 67 CA LYS A 67 273.487 235.858 240.374 1.00 0.00 C +ATOM 68 CA ILE A 68 274.849 238.514 238.007 1.00 0.00 C +ATOM 69 CA LEU A 69 278.433 238.232 236.747 1.00 0.00 C +ATOM 70 CA ARG A 70 281.333 240.690 237.002 1.00 0.00 C +ATOM 71 CA VAL A 71 283.669 243.606 236.256 1.00 0.00 C +ATOM 72 CA SER A 72 285.140 246.858 237.589 1.00 0.00 C +ATOM 73 CA GLY A 73 287.769 249.333 236.373 1.00 0.00 C +ATOM 74 CA LYS A 74 290.802 249.028 234.087 1.00 0.00 C +ATOM 75 CA LYS A 75 294.388 248.793 232.821 1.00 0.00 C +ATOM 76 CA ALA A 76 297.719 247.063 232.169 1.00 0.00 C +ATOM 77 CA LYS A 77 300.787 245.823 230.280 1.00 0.00 C +ATOM 78 CA LEU A 78 300.374 247.256 226.774 1.00 0.00 C +ATOM 79 CA SER A 79 302.481 246.058 223.836 1.00 0.00 C +TER 80 SER A 79 +END diff --git a/Plants/Q8LML4/Q8LML4.dcd b/Plants/Q8LML4/Q8LML4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..214e383e6e42c549c19eeadac1ffb1afc3fd4d35 --- /dev/null +++ b/Plants/Q8LML4/Q8LML4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:8e00efa8f557913064913a482370aabb2067fc9b8238f5812799e6edd5df0e4c +size 14600276 diff --git a/Plants/Q8LML4/top.pdb b/Plants/Q8LML4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a7263c5719bbe660b929fc2c8280e337c110131e --- /dev/null +++ b/Plants/Q8LML4/top.pdb @@ -0,0 +1,119 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 268.962 224.871 248.885 1.00 0.00 C +ATOM 2 CA THR A 2 269.561 228.134 247.011 1.00 0.00 C +ATOM 3 CA SER A 3 272.433 230.637 247.040 1.00 0.00 C +ATOM 4 CA SER A 4 274.367 233.885 246.560 1.00 0.00 C +ATOM 5 CA PRO A 5 276.286 236.756 248.169 1.00 0.00 C +ATOM 6 CA ALA A 6 274.603 240.163 247.895 1.00 0.00 C +ATOM 7 CA THR A 7 273.417 240.781 244.327 1.00 0.00 C +ATOM 8 CA ALA A 8 272.480 240.455 240.649 1.00 0.00 C +ATOM 9 CA GLN A 9 269.552 238.767 238.890 1.00 0.00 C +ATOM 10 CA GLN A 10 270.348 237.136 235.541 1.00 0.00 C +ATOM 11 CA LEU A 11 271.652 239.439 232.801 1.00 0.00 C +ATOM 12 CA THR A 12 268.745 240.158 230.446 1.00 0.00 C +ATOM 13 CA LEU A 13 265.711 240.493 232.726 1.00 0.00 C +ATOM 14 CA ALA A 14 262.205 239.774 231.419 1.00 0.00 C +ATOM 15 CA GLY A 15 262.324 239.660 227.612 1.00 0.00 C +ATOM 16 CA GLU A 16 264.647 241.700 225.386 1.00 0.00 C +ATOM 17 CA ARG A 17 265.364 245.433 225.648 1.00 0.00 C +ATOM 18 CA ARG A 18 268.952 246.177 224.605 1.00 0.00 C +ATOM 19 CA ARG A 19 271.610 244.849 222.221 1.00 0.00 C +ATOM 20 CA GLY A 20 272.500 247.083 219.266 1.00 0.00 C +ATOM 21 CA GLY A 21 271.004 250.332 217.952 1.00 0.00 C +ATOM 22 CA ALA A 22 270.747 252.755 220.881 1.00 0.00 C +ATOM 23 CA ASN A 23 271.871 254.330 224.163 1.00 0.00 C +ATOM 24 CA GLY A 24 272.019 256.703 227.140 1.00 0.00 C +ATOM 25 CA GLY A 25 268.685 258.546 227.077 1.00 0.00 C +ATOM 26 CA HIS A 26 268.566 262.224 226.091 1.00 0.00 C +ATOM 27 CA LEU A 27 268.448 265.501 228.030 1.00 0.00 C +ATOM 28 CA ARG A 28 265.059 266.077 229.674 1.00 0.00 C +ATOM 29 CA VAL A 29 265.257 264.753 233.240 1.00 0.00 C +ATOM 30 CA GLU A 30 264.831 261.486 235.153 1.00 0.00 C +ATOM 31 CA GLY A 31 262.252 258.726 235.656 1.00 0.00 C +ATOM 32 CA ASP A 32 261.517 255.778 233.358 1.00 0.00 C +ATOM 33 CA ALA A 33 258.926 253.462 231.796 1.00 0.00 C +ATOM 34 CA ALA A 34 259.050 249.815 230.699 1.00 0.00 C +ATOM 35 CA ASN A 35 261.767 247.618 232.219 1.00 0.00 C +ATOM 36 CA SER A 36 263.284 246.544 235.544 1.00 0.00 C +ATOM 37 CA PRO A 37 260.838 244.499 237.630 1.00 0.00 C +ATOM 38 CA ARG A 38 257.976 242.557 239.229 1.00 0.00 C +ATOM 39 CA ALA A 39 255.745 240.670 241.674 1.00 0.00 C +ATOM 40 CA GLN A 40 257.233 240.946 245.170 1.00 0.00 C +ATOM 41 CA THR A 41 258.195 240.961 248.857 1.00 0.00 C +ATOM 42 CA THR A 42 259.418 244.420 249.883 1.00 0.00 C +ATOM 43 CA MET A 43 256.409 246.627 250.651 1.00 0.00 C +ATOM 44 CA ASP A 44 253.289 246.215 248.502 1.00 0.00 C +ATOM 45 CA GLY A 45 252.473 249.442 246.648 1.00 0.00 C +ATOM 46 CA ASN A 46 250.193 250.838 243.934 1.00 0.00 C +ATOM 47 CA GLY A 47 252.011 251.575 240.669 1.00 0.00 C +ATOM 48 CA ARG A 48 251.254 248.866 238.099 1.00 0.00 C +ATOM 49 CA ARG A 49 252.675 245.599 239.452 1.00 0.00 C +ATOM 50 CA ARG A 50 250.699 242.761 237.853 1.00 0.00 C +ATOM 51 CA ARG A 51 248.894 243.223 234.529 1.00 0.00 C +ATOM 52 CA ARG A 52 249.224 241.345 231.231 1.00 0.00 C +ATOM 53 CA GLY A 53 248.239 238.759 228.612 1.00 0.00 C +ATOM 54 CA ARG A 54 248.183 235.584 226.506 1.00 0.00 C +ATOM 55 CA SER A 55 246.938 232.603 224.486 1.00 0.00 C +ATOM 56 CA GLY A 56 245.889 229.613 226.601 1.00 0.00 C +ATOM 57 CA GLY A 57 248.404 228.929 229.380 1.00 0.00 C +ATOM 58 CA GLY A 58 249.456 228.805 233.039 1.00 0.00 C +ATOM 59 CA ALA A 59 249.042 228.143 236.768 1.00 0.00 C +ATOM 60 CA ARG A 60 247.170 226.334 239.550 1.00 0.00 C +ATOM 61 CA VAL A 61 248.299 227.536 242.984 1.00 0.00 C +ATOM 62 CA ASP A 62 249.972 229.690 245.645 1.00 0.00 C +ATOM 63 CA ASP A 63 253.276 228.043 246.584 1.00 0.00 C +ATOM 64 CA ASP A 64 254.866 229.659 249.646 1.00 0.00 C +ATOM 65 CA SER A 65 253.354 230.428 253.058 1.00 0.00 C +ATOM 66 CA ASP A 66 249.745 230.292 254.273 1.00 0.00 C +ATOM 67 CA ALA A 67 246.733 228.969 256.195 1.00 0.00 C +ATOM 68 CA PRO A 68 245.016 229.266 259.583 1.00 0.00 C +ATOM 69 CA ALA A 69 247.623 230.245 262.183 1.00 0.00 C +ATOM 70 CA VAL A 70 248.370 230.895 265.862 1.00 0.00 C +ATOM 71 CA PHE A 71 246.666 231.501 269.216 1.00 0.00 C +ATOM 72 CA GLY A 72 246.576 232.620 272.856 1.00 0.00 C +ATOM 73 CA GLU A 73 245.442 236.068 274.016 1.00 0.00 C +ATOM 74 CA ASN A 74 243.283 239.204 274.153 1.00 0.00 C +ATOM 75 CA GLY A 75 243.190 240.437 277.757 1.00 0.00 C +ATOM 76 CA GLY A 76 245.564 241.402 280.576 1.00 0.00 C +ATOM 77 CA TRP A 77 244.362 242.170 284.109 1.00 0.00 C +ATOM 78 CA ASP A 78 244.495 245.666 285.618 1.00 0.00 C +ATOM 79 CA LYS A 79 242.858 249.075 285.162 1.00 0.00 C +ATOM 80 CA ASN A 80 242.868 252.195 287.348 1.00 0.00 C +ATOM 81 CA GLY A 81 242.107 252.172 291.081 1.00 0.00 C +ATOM 82 CA ASP A 82 240.692 254.520 293.727 1.00 0.00 C +ATOM 83 CA ASP A 83 237.450 256.078 292.471 1.00 0.00 C +ATOM 84 CA LEU A 84 234.547 258.523 292.805 1.00 0.00 C +ATOM 85 CA ALA A 85 231.494 256.415 293.676 1.00 0.00 C +ATOM 86 CA ASN A 86 228.090 258.061 293.211 1.00 0.00 C +ATOM 87 CA PRO A 87 226.732 258.798 289.728 1.00 0.00 C +ATOM 88 CA THR A 88 224.174 261.401 288.635 1.00 0.00 C +ATOM 89 CA ALA A 89 225.596 264.596 287.123 1.00 0.00 C +ATOM 90 CA ALA A 90 228.734 264.627 284.961 1.00 0.00 C +ATOM 91 CA PHE A 91 231.028 265.067 281.951 1.00 0.00 C +ATOM 92 CA PRO A 92 234.659 264.606 280.893 1.00 0.00 C +ATOM 93 CA SER A 93 236.140 265.718 277.564 1.00 0.00 C +ATOM 94 CA ASP A 94 239.260 267.480 276.268 1.00 0.00 C +ATOM 95 CA ASP A 95 239.399 270.831 274.460 1.00 0.00 C +ATOM 96 CA ASP A 96 240.598 274.447 274.426 1.00 0.00 C +ATOM 97 CA ASP A 97 242.319 276.610 271.804 1.00 0.00 C +ATOM 98 CA ARG A 98 239.955 276.869 268.827 1.00 0.00 C +ATOM 99 CA SER A 99 237.487 274.242 267.590 1.00 0.00 C +ATOM 100 CA GLY A 100 237.064 270.912 265.789 1.00 0.00 C +ATOM 101 CA GLY A 101 236.817 270.668 261.995 1.00 0.00 C +ATOM 102 CA GLY A 102 236.552 267.324 260.188 1.00 0.00 C +ATOM 103 CA ALA A 103 234.360 266.796 257.117 1.00 0.00 C +ATOM 104 CA ARG A 104 231.567 266.141 254.610 1.00 0.00 C +ATOM 105 CA LEU A 105 229.731 268.182 251.968 1.00 0.00 C +ATOM 106 CA ASP A 106 227.858 270.853 250.000 1.00 0.00 C +ATOM 107 CA LEU A 107 229.454 273.321 247.575 1.00 0.00 C +ATOM 108 CA ARG A 108 229.085 274.839 244.100 1.00 0.00 C +ATOM 109 CA ARG A 109 225.951 274.675 241.938 1.00 0.00 C +ATOM 110 CA ARG A 110 224.784 274.757 238.312 1.00 0.00 C +ATOM 111 CA ARG A 111 223.970 277.397 235.689 1.00 0.00 C +ATOM 112 CA GLN A 112 224.729 279.911 232.928 1.00 0.00 C +ATOM 113 CA ARG A 113 221.482 280.770 231.130 1.00 0.00 C +ATOM 114 CA LYS A 114 218.675 279.118 233.109 1.00 0.00 C +ATOM 115 CA GLY A 115 216.054 277.598 230.800 1.00 0.00 C +TER 116 GLY A 115 +END diff --git a/Plants/Q8LML6/Q8LML6.dcd b/Plants/Q8LML6/Q8LML6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..9a1058baa25c52d09e222ac9c0d764e7ce489966 --- /dev/null +++ b/Plants/Q8LML6/Q8LML6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:38d005c9716be68a7bb378ae6f255ad816eb00804e9d12431250fdbef10239e2 +size 11960276 diff --git a/Plants/Q8LML6/top.pdb b/Plants/Q8LML6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..82799bd6dbadd000b156a52f24d472a12137a99a --- /dev/null +++ b/Plants/Q8LML6/top.pdb @@ -0,0 +1,97 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 236.029 237.712 245.495 1.00 0.00 C +ATOM 2 CA ALA A 2 239.254 236.662 247.230 1.00 0.00 C +ATOM 3 CA HIS A 3 242.571 237.312 248.988 1.00 0.00 C +ATOM 4 CA GLY A 4 242.286 238.219 252.677 1.00 0.00 C +ATOM 5 CA SER A 5 243.673 238.605 256.205 1.00 0.00 C +ATOM 6 CA SER A 6 240.850 238.449 258.759 1.00 0.00 C +ATOM 7 CA ASP A 7 237.248 238.217 257.540 1.00 0.00 C +ATOM 8 CA ILE A 8 236.523 239.465 254.014 1.00 0.00 C +ATOM 9 CA ASP A 9 233.249 239.552 252.067 1.00 0.00 C +ATOM 10 CA ASN A 10 230.391 237.188 251.196 1.00 0.00 C +ATOM 11 CA GLN A 11 227.560 236.775 248.680 1.00 0.00 C +ATOM 12 CA GLU A 12 225.706 233.651 247.531 1.00 0.00 C +ATOM 13 CA GLY A 13 226.352 232.050 244.134 1.00 0.00 C +ATOM 14 CA GLY A 14 227.202 231.580 240.450 1.00 0.00 C +ATOM 15 CA GLY A 15 230.697 232.114 239.030 1.00 0.00 C +ATOM 16 CA ALA A 16 232.887 234.535 237.067 1.00 0.00 C +ATOM 17 CA SER A 17 233.578 233.530 233.457 1.00 0.00 C +ATOM 18 CA CYS A 18 235.228 234.697 230.228 1.00 0.00 C +ATOM 19 CA THR A 19 234.996 232.085 227.464 1.00 0.00 C +ATOM 20 CA SER A 20 237.092 229.129 228.640 1.00 0.00 C +ATOM 21 CA ALA A 21 240.079 227.209 227.260 1.00 0.00 C +ATOM 22 CA ALA A 22 243.849 226.655 227.244 1.00 0.00 C +ATOM 23 CA GLY A 23 246.712 228.665 228.754 1.00 0.00 C +ATOM 24 CA CYS A 24 247.670 231.565 231.033 1.00 0.00 C +ATOM 25 CA LEU A 25 249.582 233.471 233.721 1.00 0.00 C +ATOM 26 CA GLY A 26 252.314 232.043 235.961 1.00 0.00 C +ATOM 27 CA LYS A 27 255.517 230.432 234.673 1.00 0.00 C +ATOM 28 CA LEU A 28 257.762 230.138 231.608 1.00 0.00 C +ATOM 29 CA ARG A 29 256.975 228.241 228.399 1.00 0.00 C +ATOM 30 CA LEU A 30 259.258 225.286 227.644 1.00 0.00 C +ATOM 31 CA SER A 31 263.052 225.267 227.992 1.00 0.00 C +ATOM 32 CA HIS A 32 264.547 227.298 230.848 1.00 0.00 C +ATOM 33 CA ARG A 33 264.618 230.101 233.428 1.00 0.00 C +ATOM 34 CA PRO A 34 263.259 233.536 232.493 1.00 0.00 C +ATOM 35 CA PRO A 35 261.064 236.233 230.937 1.00 0.00 C +ATOM 36 CA GLY A 36 261.330 239.668 232.564 1.00 0.00 C +ATOM 37 CA ARG A 37 263.814 241.442 234.844 1.00 0.00 C +ATOM 38 CA ALA A 38 265.871 243.801 237.017 1.00 0.00 C +ATOM 39 CA SER A 39 264.261 246.823 238.686 1.00 0.00 C +ATOM 40 CA PRO A 40 261.441 249.143 237.599 1.00 0.00 C +ATOM 41 CA THR A 41 258.346 251.105 236.556 1.00 0.00 C +ATOM 42 CA THR A 42 256.847 254.493 237.448 1.00 0.00 C +ATOM 43 CA ALA A 43 256.532 255.707 241.045 1.00 0.00 C +ATOM 44 CA ALA A 44 254.515 258.407 242.822 1.00 0.00 C +ATOM 45 CA GLY A 45 253.913 257.691 246.515 1.00 0.00 C +ATOM 46 CA CYS A 46 255.776 256.602 249.655 1.00 0.00 C +ATOM 47 CA PRO A 47 256.886 253.011 250.276 1.00 0.00 C +ATOM 48 CA SER A 48 259.265 252.879 253.249 1.00 0.00 C +ATOM 49 CA ASP A 49 262.771 254.359 253.425 1.00 0.00 C +ATOM 50 CA LEU A 50 264.824 257.569 253.387 1.00 0.00 C +ATOM 51 CA ARG A 51 265.913 260.785 251.659 1.00 0.00 C +ATOM 52 CA PRO A 52 265.093 264.482 252.076 1.00 0.00 C +ATOM 53 CA PRO A 53 262.788 266.753 254.087 1.00 0.00 C +ATOM 54 CA PRO A 54 259.985 266.677 256.667 1.00 0.00 C +ATOM 55 CA LEU A 55 256.579 265.026 256.239 1.00 0.00 C +ATOM 56 CA ALA A 56 252.818 264.820 256.817 1.00 0.00 C +ATOM 57 CA LEU A 57 251.925 264.763 260.521 1.00 0.00 C +ATOM 58 CA GLU A 58 250.385 268.099 261.529 1.00 0.00 C +ATOM 59 CA SER A 59 251.063 271.423 259.795 1.00 0.00 C +ATOM 60 CA SER A 60 251.557 275.011 260.977 1.00 0.00 C +ATOM 61 CA ARG A 61 253.930 276.134 263.739 1.00 0.00 C +ATOM 62 CA GLY A 62 255.347 273.032 265.437 1.00 0.00 C +ATOM 63 CA ASP A 63 257.109 270.293 263.460 1.00 0.00 C +ATOM 64 CA PHE A 64 259.240 271.623 260.596 1.00 0.00 C +ATOM 65 CA SER A 65 258.888 274.829 258.566 1.00 0.00 C +ATOM 66 CA SER A 66 259.198 273.916 254.880 1.00 0.00 C +ATOM 67 CA GLY A 67 258.627 272.584 251.356 1.00 0.00 C +ATOM 68 CA ASP A 68 256.227 270.072 249.792 1.00 0.00 C +ATOM 69 CA ASP A 69 255.025 266.460 249.628 1.00 0.00 C +ATOM 70 CA ASP A 70 252.088 265.546 247.380 1.00 0.00 C +ATOM 71 CA LYS A 71 249.679 262.995 245.895 1.00 0.00 C +ATOM 72 CA SER A 72 246.800 262.478 248.337 1.00 0.00 C +ATOM 73 CA SER A 73 244.946 262.825 251.647 1.00 0.00 C +ATOM 74 CA SER A 74 242.738 264.770 254.068 1.00 0.00 C +ATOM 75 CA PRO A 75 240.980 266.938 256.662 1.00 0.00 C +ATOM 76 CA THR A 76 240.594 267.257 260.438 1.00 0.00 C +ATOM 77 CA VAL A 77 243.934 267.359 262.268 1.00 0.00 C +ATOM 78 CA LYS A 78 244.977 264.344 264.352 1.00 0.00 C +ATOM 79 CA GLU A 79 243.669 264.529 267.926 1.00 0.00 C +ATOM 80 CA VAL A 80 245.058 266.991 270.480 1.00 0.00 C +ATOM 81 CA ALA A 81 247.719 265.548 272.794 1.00 0.00 C +ATOM 82 CA MET A 82 249.156 265.209 276.307 1.00 0.00 C +ATOM 83 CA THR A 83 250.794 262.457 278.371 1.00 0.00 C +ATOM 84 CA ARG A 84 251.821 259.462 276.251 1.00 0.00 C +ATOM 85 CA GLU A 85 252.411 256.677 273.719 1.00 0.00 C +ATOM 86 CA LYS A 86 252.223 253.395 271.793 1.00 0.00 C +ATOM 87 CA GLY A 87 253.647 251.391 268.882 1.00 0.00 C +ATOM 88 CA GLY A 88 256.396 248.801 268.383 1.00 0.00 C +ATOM 89 CA GLU A 89 254.778 245.438 267.615 1.00 0.00 C +ATOM 90 CA ALA A 90 251.138 245.077 268.681 1.00 0.00 C +ATOM 91 CA VAL A 91 247.580 245.725 269.878 1.00 0.00 C +ATOM 92 CA SER A 92 244.737 245.154 267.407 1.00 0.00 C +ATOM 93 CA VAL A 93 244.413 242.481 264.712 1.00 0.00 C +TER 94 VAL A 93 +END diff --git a/Plants/Q8LMN5/Q8LMN5.dcd b/Plants/Q8LMN5/Q8LMN5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..e6963b1eba59ec52e5cd9a8ef549dfbb1a8d0394 --- /dev/null +++ b/Plants/Q8LMN5/Q8LMN5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:08a36b4dd29e34b5d23d0b13820c209801118c9281810128128faa38438870a5 +size 15080276 diff --git a/Plants/Q8LMN5/top.pdb b/Plants/Q8LMN5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..628df46feee1bca1f12c3991e9adaf93869c9db0 --- /dev/null +++ b/Plants/Q8LMN5/top.pdb @@ -0,0 +1,123 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 266.314 235.893 195.398 1.00 0.00 C +ATOM 2 CA GLU A 2 264.016 238.900 194.957 1.00 0.00 C +ATOM 3 CA SER A 3 265.147 242.186 193.397 1.00 0.00 C +ATOM 4 CA SER A 4 262.882 245.156 192.644 1.00 0.00 C +ATOM 5 CA GLY A 5 264.397 247.673 190.219 1.00 0.00 C +ATOM 6 CA ALA A 6 267.587 248.878 188.519 1.00 0.00 C +ATOM 7 CA ALA A 7 268.806 252.101 186.893 1.00 0.00 C +ATOM 8 CA ASP A 8 266.322 253.142 184.198 1.00 0.00 C +ATOM 9 CA GLY A 9 262.907 253.573 185.833 1.00 0.00 C +ATOM 10 CA LYS A 10 260.019 251.091 185.701 1.00 0.00 C +ATOM 11 CA ARG A 11 257.412 248.575 184.522 1.00 0.00 C +ATOM 12 CA LYS A 12 253.852 248.384 183.179 1.00 0.00 C +ATOM 13 CA LYS A 13 250.887 246.728 184.906 1.00 0.00 C +ATOM 14 CA GLU A 14 247.824 247.637 182.830 1.00 0.00 C +ATOM 15 CA GLU A 15 247.305 251.351 183.504 1.00 0.00 C +ATOM 16 CA GLU A 16 246.631 254.478 185.575 1.00 0.00 C +ATOM 17 CA ASN A 17 243.737 254.926 188.012 1.00 0.00 C +ATOM 18 CA ALA A 18 245.009 254.600 191.589 1.00 0.00 C +ATOM 19 CA GLY A 19 248.142 252.470 191.992 1.00 0.00 C +ATOM 20 CA MET A 20 250.243 251.352 194.967 1.00 0.00 C +ATOM 21 CA VAL A 21 251.761 251.605 198.453 1.00 0.00 C +ATOM 22 CA TYR A 22 251.487 248.172 200.083 1.00 0.00 C +ATOM 23 CA MET A 23 251.428 248.185 203.892 1.00 0.00 C +ATOM 24 CA GLY A 24 248.640 250.344 205.335 1.00 0.00 C +ATOM 25 CA THR A 25 250.370 253.615 206.244 1.00 0.00 C +ATOM 26 CA GLY A 26 250.986 255.794 209.308 1.00 0.00 C +ATOM 27 CA ARG A 27 249.525 257.101 212.575 1.00 0.00 C +ATOM 28 CA VAL A 28 250.284 257.318 216.302 1.00 0.00 C +ATOM 29 CA ASP A 29 251.241 257.352 219.990 1.00 0.00 C +ATOM 30 CA GLU A 30 252.077 254.628 222.519 1.00 0.00 C +ATOM 31 CA ALA A 31 251.638 251.298 224.317 1.00 0.00 C +ATOM 32 CA GLY A 32 252.422 248.533 226.818 1.00 0.00 C +ATOM 33 CA ARG A 33 250.104 245.569 226.215 1.00 0.00 C +ATOM 34 CA ARG A 34 246.615 244.689 227.467 1.00 0.00 C +ATOM 35 CA PRO A 35 246.571 243.131 230.944 1.00 0.00 C +ATOM 36 CA ASP A 36 246.010 244.659 234.389 1.00 0.00 C +ATOM 37 CA PHE A 37 242.857 246.641 235.189 1.00 0.00 C +ATOM 38 CA SER A 38 242.180 248.178 238.609 1.00 0.00 C +ATOM 39 CA PRO A 39 241.136 251.815 239.051 1.00 0.00 C +ATOM 40 CA THR A 40 242.214 253.826 242.102 1.00 0.00 C +ATOM 41 CA TRP A 41 243.745 252.239 245.209 1.00 0.00 C +ATOM 42 CA GLY A 42 243.024 251.551 248.887 1.00 0.00 C +ATOM 43 CA SER A 43 245.187 248.624 250.017 1.00 0.00 C +ATOM 44 CA GLY A 44 246.783 245.238 250.726 1.00 0.00 C +ATOM 45 CA GLU A 45 248.448 244.020 253.929 1.00 0.00 C +ATOM 46 CA ARG A 46 249.832 241.315 256.228 1.00 0.00 C +ATOM 47 CA GLU A 47 251.649 241.425 259.574 1.00 0.00 C +ATOM 48 CA LEU A 48 254.865 242.567 261.268 1.00 0.00 C +ATOM 49 CA GLY A 49 256.606 242.582 264.658 1.00 0.00 C +ATOM 50 CA GLY A 50 256.948 242.195 268.432 1.00 0.00 C +ATOM 51 CA ILE A 51 258.089 245.086 270.635 1.00 0.00 C +ATOM 52 CA GLN A 52 259.571 244.279 274.051 1.00 0.00 C +ATOM 53 CA THR A 53 260.085 240.504 274.024 1.00 0.00 C +ATOM 54 CA GLU A 54 259.656 236.771 273.393 1.00 0.00 C +ATOM 55 CA SER A 55 258.350 235.020 276.514 1.00 0.00 C +ATOM 56 CA ARG A 56 259.973 232.961 279.279 1.00 0.00 C +ATOM 57 CA PRO A 57 260.706 231.806 282.835 1.00 0.00 C +ATOM 58 CA TYR A 58 259.759 234.454 285.405 1.00 0.00 C +ATOM 59 CA GLY A 59 257.301 236.556 287.420 1.00 0.00 C +ATOM 60 CA ALA A 60 256.532 240.185 288.289 1.00 0.00 C +ATOM 61 CA ARG A 61 252.735 240.400 288.513 1.00 0.00 C +ATOM 62 CA ALA A 62 251.041 243.549 287.195 1.00 0.00 C +ATOM 63 CA GLY A 63 247.810 244.651 285.504 1.00 0.00 C +ATOM 64 CA ARG A 64 247.836 244.630 281.694 1.00 0.00 C +ATOM 65 CA GLU A 65 244.463 245.633 280.234 1.00 0.00 C +ATOM 66 CA GLY A 66 242.347 247.320 277.552 1.00 0.00 C +ATOM 67 CA VAL A 67 239.528 248.332 275.197 1.00 0.00 C +ATOM 68 CA GLY A 68 237.315 248.284 272.096 1.00 0.00 C +ATOM 69 CA LYS A 69 239.569 248.679 269.050 1.00 0.00 C +ATOM 70 CA GLY A 70 240.192 250.682 265.869 1.00 0.00 C +ATOM 71 CA ALA A 71 238.274 253.877 265.079 1.00 0.00 C +ATOM 72 CA ALA A 72 234.937 252.744 263.630 1.00 0.00 C +ATOM 73 CA THR A 73 231.881 252.620 261.358 1.00 0.00 C +ATOM 74 CA TRP A 74 229.289 250.362 259.716 1.00 0.00 C +ATOM 75 CA ALA A 75 227.638 247.366 258.036 1.00 0.00 C +ATOM 76 CA ARG A 76 229.148 245.570 255.035 1.00 0.00 C +ATOM 77 CA ARG A 77 231.617 246.761 252.389 1.00 0.00 C +ATOM 78 CA ARG A 78 234.721 248.925 251.938 1.00 0.00 C +ATOM 79 CA GLY A 79 234.655 250.961 248.719 1.00 0.00 C +ATOM 80 CA ARG A 80 236.770 253.927 247.601 1.00 0.00 C +ATOM 81 CA GLY A 81 239.423 256.653 247.385 1.00 0.00 C +ATOM 82 CA ALA A 82 238.490 260.192 246.328 1.00 0.00 C +ATOM 83 CA ARG A 83 235.326 261.490 248.007 1.00 0.00 C +ATOM 84 CA SER A 84 236.311 263.356 251.179 1.00 0.00 C +ATOM 85 CA GLY A 85 234.242 266.429 252.069 1.00 0.00 C +ATOM 86 CA GLY A 86 231.117 268.543 251.540 1.00 0.00 C +ATOM 87 CA GLY A 87 231.722 271.884 253.268 1.00 0.00 C +ATOM 88 CA GLY A 88 233.906 271.128 256.297 1.00 0.00 C +ATOM 89 CA ALA A 89 235.249 269.897 259.643 1.00 0.00 C +ATOM 90 CA PRO A 90 235.815 266.637 261.533 1.00 0.00 C +ATOM 91 CA ALA A 91 236.062 266.320 265.322 1.00 0.00 C +ATOM 92 CA VAL A 92 238.768 264.007 266.679 1.00 0.00 C +ATOM 93 CA ALA A 93 239.731 263.266 270.290 1.00 0.00 C +ATOM 94 CA ASP A 94 243.116 264.437 271.587 1.00 0.00 C +ATOM 95 CA ARG A 95 246.026 262.772 273.398 1.00 0.00 C +ATOM 96 CA LEU A 96 245.696 259.028 274.022 1.00 0.00 C +ATOM 97 CA GLU A 97 248.454 256.604 273.009 1.00 0.00 C +ATOM 98 CA VAL A 98 251.833 254.871 272.694 1.00 0.00 C +ATOM 99 CA ARG A 99 254.633 256.867 274.334 1.00 0.00 C +ATOM 100 CA GLU A 100 255.063 258.335 277.823 1.00 0.00 C +ATOM 101 CA GLY A 101 254.107 257.460 281.406 1.00 0.00 C +ATOM 102 CA ALA A 102 256.343 257.197 284.480 1.00 0.00 C +ATOM 103 CA ASP A 103 256.311 258.387 288.099 1.00 0.00 C +ATOM 104 CA ARG A 104 259.190 260.805 288.718 1.00 0.00 C +ATOM 105 CA TRP A 105 261.992 260.348 291.259 1.00 0.00 C +ATOM 106 CA ALA A 106 264.318 257.434 290.473 1.00 0.00 C +ATOM 107 CA PRO A 107 266.186 254.567 288.798 1.00 0.00 C +ATOM 108 CA PRO A 108 264.042 251.505 289.539 1.00 0.00 C +ATOM 109 CA VAL A 109 265.409 248.546 291.511 1.00 0.00 C +ATOM 110 CA SER A 110 265.944 247.896 295.226 1.00 0.00 C +ATOM 111 CA ALA A 111 265.950 244.134 295.829 1.00 0.00 C +ATOM 112 CA ARG A 112 263.094 242.557 297.797 1.00 0.00 C +ATOM 113 CA GLY A 113 262.913 243.574 301.464 1.00 0.00 C +ATOM 114 CA SER A 114 262.244 241.430 304.541 1.00 0.00 C +ATOM 115 CA GLU A 115 259.458 239.151 305.789 1.00 0.00 C +ATOM 116 CA GLY A 116 257.807 236.085 307.336 1.00 0.00 C +ATOM 117 CA GLU A 117 260.661 233.731 308.247 1.00 0.00 C +ATOM 118 CA ALA A 118 262.411 232.153 305.254 1.00 0.00 C +ATOM 119 CA THR A 119 262.776 234.120 302.011 1.00 0.00 C +TER 120 THR A 119 +END diff --git a/Plants/Q8LN88/Q8LN88.dcd b/Plants/Q8LN88/Q8LN88.dcd new file mode 100644 index 0000000000000000000000000000000000000000..bd10002a8888213e765f2b609f3dd338c57009f6 --- /dev/null +++ b/Plants/Q8LN88/Q8LN88.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:59d5cdb969850cb9aeffc7223e31fa8828e33bb94dbe5a60302102f8aa85dbc4 +size 8600276 diff --git a/Plants/Q8LN88/top.pdb b/Plants/Q8LN88/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..080a963278a7cc2408494fa29368490d30775437 --- /dev/null +++ b/Plants/Q8LN88/top.pdb @@ -0,0 +1,69 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 262.021 199.831 218.173 1.00 0.00 C +ATOM 2 CA ALA A 2 261.138 203.155 219.812 1.00 0.00 C +ATOM 3 CA ARG A 3 264.056 205.568 219.393 1.00 0.00 C +ATOM 4 CA ILE A 4 263.003 208.994 218.102 1.00 0.00 C +ATOM 5 CA SER A 5 260.407 211.355 219.585 1.00 0.00 C +ATOM 6 CA PHE A 6 257.395 213.529 220.435 1.00 0.00 C +ATOM 7 CA GLY A 7 257.613 217.228 219.548 1.00 0.00 C +ATOM 8 CA VAL A 8 258.606 220.900 219.340 1.00 0.00 C +ATOM 9 CA ALA A 9 256.169 223.304 221.013 1.00 0.00 C +ATOM 10 CA GLY A 10 254.589 226.400 222.574 1.00 0.00 C +ATOM 11 CA GLY A 11 252.940 229.795 222.054 1.00 0.00 C +ATOM 12 CA VAL A 12 250.655 232.724 222.898 1.00 0.00 C +ATOM 13 CA ALA A 13 250.646 236.225 224.400 1.00 0.00 C +ATOM 14 CA GLY A 14 250.311 238.325 227.562 1.00 0.00 C +ATOM 15 CA GLY A 15 253.137 239.974 229.515 1.00 0.00 C +ATOM 16 CA GLU A 16 255.691 238.001 231.539 1.00 0.00 C +ATOM 17 CA GLU A 17 254.442 235.842 234.419 1.00 0.00 C +ATOM 18 CA LYS A 18 251.853 237.717 236.492 1.00 0.00 C +ATOM 19 CA TYR A 19 248.699 238.982 238.216 1.00 0.00 C +ATOM 20 CA ARG A 20 249.291 239.876 241.872 1.00 0.00 C +ATOM 21 CA GLY A 21 246.787 242.192 243.568 1.00 0.00 C +ATOM 22 CA HIS A 22 247.028 245.883 242.651 1.00 0.00 C +ATOM 23 CA GLY A 23 246.771 249.681 242.796 1.00 0.00 C +ATOM 24 CA SER A 24 246.696 253.403 241.984 1.00 0.00 C +ATOM 25 CA SER A 25 243.654 255.641 241.483 1.00 0.00 C +ATOM 26 CA ALA A 26 243.216 259.260 240.374 1.00 0.00 C +ATOM 27 CA SER A 27 239.843 260.350 238.977 1.00 0.00 C +ATOM 28 CA ALA A 28 236.275 259.707 240.147 1.00 0.00 C +ATOM 29 CA ALA A 29 233.885 260.809 242.902 1.00 0.00 C +ATOM 30 CA GLU A 30 233.167 262.786 246.079 1.00 0.00 C +ATOM 31 CA GLU A 31 234.612 266.289 246.476 1.00 0.00 C +ATOM 32 CA LYS A 32 233.655 269.902 247.216 1.00 0.00 C +ATOM 33 CA ARG A 33 235.678 273.126 247.043 1.00 0.00 C +ATOM 34 CA PRO A 34 239.093 273.315 248.721 1.00 0.00 C +ATOM 35 CA ILE A 35 242.151 275.473 249.432 1.00 0.00 C +ATOM 36 CA THR A 36 245.299 276.785 251.132 1.00 0.00 C +ATOM 37 CA ALA A 37 244.614 277.396 254.830 1.00 0.00 C +ATOM 38 CA SER A 38 245.947 277.344 258.398 1.00 0.00 C +ATOM 39 CA ASP A 39 246.030 274.832 261.261 1.00 0.00 C +ATOM 40 CA GLY A 40 246.003 271.158 262.270 1.00 0.00 C +ATOM 41 CA PHE A 41 245.059 268.480 264.811 1.00 0.00 C +ATOM 42 CA GLY A 42 247.142 266.804 267.526 1.00 0.00 C +ATOM 43 CA LYS A 43 246.501 263.089 268.073 1.00 0.00 C +ATOM 44 CA GLU A 44 247.307 259.497 269.057 1.00 0.00 C +ATOM 45 CA PHE A 45 250.207 257.553 267.532 1.00 0.00 C +ATOM 46 CA SER A 46 253.344 259.262 266.205 1.00 0.00 C +ATOM 47 CA ASP A 47 256.574 258.533 264.322 1.00 0.00 C +ATOM 48 CA PRO A 48 260.102 257.104 264.150 1.00 0.00 C +ATOM 49 CA PRO A 49 262.319 260.167 263.680 1.00 0.00 C +ATOM 50 CA PRO A 50 263.441 261.620 267.019 1.00 0.00 C +ATOM 51 CA PRO A 51 260.668 262.501 269.477 1.00 0.00 C +ATOM 52 CA PRO A 52 259.260 265.127 271.853 1.00 0.00 C +ATOM 53 CA LEU A 53 255.725 264.025 272.749 1.00 0.00 C +ATOM 54 CA GLY A 54 253.256 261.129 272.569 1.00 0.00 C +ATOM 55 CA PRO A 55 252.963 258.464 275.275 1.00 0.00 C +ATOM 56 CA ARG A 56 255.283 255.455 275.560 1.00 0.00 C +ATOM 57 CA GLN A 57 257.195 252.346 276.654 1.00 0.00 C +ATOM 58 CA PRO A 58 255.179 249.735 278.560 1.00 0.00 C +ATOM 59 CA LEU A 59 252.191 247.383 278.798 1.00 0.00 C +ATOM 60 CA ASP A 60 249.638 248.633 276.262 1.00 0.00 C +ATOM 61 CA GLY A 61 247.968 252.032 276.679 1.00 0.00 C +ATOM 62 CA GLU A 62 245.217 254.636 277.089 1.00 0.00 C +ATOM 63 CA ALA A 63 242.733 257.498 276.700 1.00 0.00 C +ATOM 64 CA CYS A 64 243.068 261.200 277.538 1.00 0.00 C +ATOM 65 CA GLY A 65 244.595 264.672 277.174 1.00 0.00 C +TER 66 GLY A 65 +END diff --git a/Plants/Q8LNQ3/Q8LNQ3.dcd b/Plants/Q8LNQ3/Q8LNQ3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..f413500465f01250f67b199cdd132d610152b2b2 --- /dev/null +++ b/Plants/Q8LNQ3/Q8LNQ3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:545b6e79ce6d585d94c12fc56d2f2a5bfa44071f2b5d573801d703f0a280f12e +size 13280276 diff --git a/Plants/Q8LNQ3/top.pdb b/Plants/Q8LNQ3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..f6b19909332a11b2d374e750d6082aa6a69402a0 --- /dev/null +++ b/Plants/Q8LNQ3/top.pdb @@ -0,0 +1,108 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 235.843 296.804 242.778 1.00 0.00 C +ATOM 2 CA HIS A 2 234.315 298.714 239.857 1.00 0.00 C +ATOM 3 CA THR A 3 234.828 299.173 236.110 1.00 0.00 C +ATOM 4 CA ALA A 4 236.915 296.663 234.145 1.00 0.00 C +ATOM 5 CA LEU A 5 239.208 294.859 236.595 1.00 0.00 C +ATOM 6 CA ARG A 6 242.647 293.796 237.846 1.00 0.00 C +ATOM 7 CA GLY A 7 245.307 292.228 240.078 1.00 0.00 C +ATOM 8 CA CYS A 8 248.645 290.596 240.919 1.00 0.00 C +ATOM 9 CA PRO A 9 251.772 288.613 241.816 1.00 0.00 C +ATOM 10 CA PRO A 10 251.864 286.581 245.037 1.00 0.00 C +ATOM 11 CA TRP A 11 252.673 288.253 248.364 1.00 0.00 C +ATOM 12 CA ARG A 12 255.791 287.341 250.355 1.00 0.00 C +ATOM 13 CA ALA A 13 259.303 288.624 249.623 1.00 0.00 C +ATOM 14 CA GLY A 14 260.939 286.449 246.957 1.00 0.00 C +ATOM 15 CA GLY A 15 262.258 288.149 243.812 1.00 0.00 C +ATOM 16 CA VAL A 16 265.514 289.102 242.078 1.00 0.00 C +ATOM 17 CA ALA A 17 268.112 286.370 241.534 1.00 0.00 C +ATOM 18 CA ARG A 18 266.623 283.661 239.308 1.00 0.00 C +ATOM 19 CA ASP A 19 269.224 282.027 237.054 1.00 0.00 C +ATOM 20 CA GLY A 20 272.558 281.493 238.821 1.00 0.00 C +ATOM 21 CA ARG A 21 275.428 283.872 238.034 1.00 0.00 C +ATOM 22 CA VAL A 22 278.339 283.035 240.345 1.00 0.00 C +ATOM 23 CA ARG A 23 278.621 283.004 244.144 1.00 0.00 C +ATOM 24 CA ARG A 24 278.249 283.410 247.914 1.00 0.00 C +ATOM 25 CA GLU A 25 277.597 280.174 249.818 1.00 0.00 C +ATOM 26 CA GLU A 26 274.963 277.520 250.551 1.00 0.00 C +ATOM 27 CA GLY A 27 275.797 274.877 253.165 1.00 0.00 C +ATOM 28 CA GLY A 28 275.660 271.235 254.277 1.00 0.00 C +ATOM 29 CA ASP A 29 276.567 268.595 256.870 1.00 0.00 C +ATOM 30 CA GLU A 30 279.405 266.057 256.735 1.00 0.00 C +ATOM 31 CA ALA A 31 281.577 263.116 257.809 1.00 0.00 C +ATOM 32 CA ASP A 32 282.813 259.545 257.321 1.00 0.00 C +ATOM 33 CA GLU A 33 286.025 258.996 255.347 1.00 0.00 C +ATOM 34 CA ALA A 34 289.338 257.388 256.324 1.00 0.00 C +ATOM 35 CA ALA A 35 290.161 254.167 254.462 1.00 0.00 C +ATOM 36 CA ALA A 36 288.326 250.888 255.092 1.00 0.00 C +ATOM 37 CA GLU A 37 288.738 250.236 258.823 1.00 0.00 C +ATOM 38 CA GLU A 38 288.636 247.174 261.088 1.00 0.00 C +ATOM 39 CA LYS A 39 285.776 244.727 260.500 1.00 0.00 C +ATOM 40 CA ARG A 40 282.533 246.375 259.368 1.00 0.00 C +ATOM 41 CA ALA A 41 280.123 247.838 256.804 1.00 0.00 C +ATOM 42 CA GLN A 42 280.336 245.488 253.812 1.00 0.00 C +ATOM 43 CA GLU A 43 279.083 245.551 250.215 1.00 0.00 C +ATOM 44 CA ARG A 44 276.370 243.157 249.022 1.00 0.00 C +ATOM 45 CA ASP A 45 273.981 240.757 247.277 1.00 0.00 C +ATOM 46 CA GLU A 46 270.576 240.606 248.980 1.00 0.00 C +ATOM 47 CA ALA A 47 269.169 241.069 252.490 1.00 0.00 C +ATOM 48 CA TYR A 48 266.932 238.480 254.167 1.00 0.00 C +ATOM 49 CA GLN A 49 264.258 236.431 252.387 1.00 0.00 C +ATOM 50 CA ARG A 50 263.838 234.562 249.094 1.00 0.00 C +ATOM 51 CA ALA A 51 265.546 231.470 247.667 1.00 0.00 C +ATOM 52 CA LEU A 52 265.184 231.183 243.885 1.00 0.00 C +ATOM 53 CA ASP A 53 261.707 230.673 242.414 1.00 0.00 C +ATOM 54 CA GLY A 54 258.940 232.056 240.190 1.00 0.00 C +ATOM 55 CA ALA A 55 259.034 234.366 237.161 1.00 0.00 C +ATOM 56 CA THR A 56 260.317 232.417 234.149 1.00 0.00 C +ATOM 57 CA PRO A 57 258.836 228.909 234.017 1.00 0.00 C +ATOM 58 CA VAL A 58 255.208 228.129 233.153 1.00 0.00 C +ATOM 59 CA SER A 59 251.986 226.854 231.569 1.00 0.00 C +ATOM 60 CA PRO A 60 249.271 224.189 231.363 1.00 0.00 C +ATOM 61 CA GLU A 61 248.496 221.615 228.662 1.00 0.00 C +ATOM 62 CA SER A 62 250.933 222.380 225.835 1.00 0.00 C +ATOM 63 CA LEU A 63 251.563 225.225 223.381 1.00 0.00 C +ATOM 64 CA ALA A 64 250.011 228.578 224.310 1.00 0.00 C +ATOM 65 CA ALA A 65 246.792 228.530 226.347 1.00 0.00 C +ATOM 66 CA MET A 66 244.602 231.270 224.860 1.00 0.00 C +ATOM 67 CA LEU A 67 242.348 231.904 221.854 1.00 0.00 C +ATOM 68 CA ASP A 68 238.644 231.296 222.506 1.00 0.00 C +ATOM 69 CA GLN A 69 236.079 232.430 225.085 1.00 0.00 C +ATOM 70 CA ALA A 70 237.140 234.248 228.261 1.00 0.00 C +ATOM 71 CA LEU A 71 236.893 237.004 230.880 1.00 0.00 C +ATOM 72 CA GLN A 72 234.131 238.867 232.726 1.00 0.00 C +ATOM 73 CA SER A 73 231.600 241.678 233.184 1.00 0.00 C +ATOM 74 CA VAL A 74 229.374 244.231 234.929 1.00 0.00 C +ATOM 75 CA ARG A 75 228.112 246.320 237.855 1.00 0.00 C +ATOM 76 CA GLN A 76 229.123 249.137 240.212 1.00 0.00 C +ATOM 77 CA PRO A 77 229.650 250.145 243.848 1.00 0.00 C +ATOM 78 CA PRO A 78 230.320 249.756 247.579 1.00 0.00 C +ATOM 79 CA PRO A 79 228.097 251.087 250.372 1.00 0.00 C +ATOM 80 CA PRO A 80 225.751 254.009 251.061 1.00 0.00 C +ATOM 81 CA PRO A 81 224.755 254.542 254.700 1.00 0.00 C +ATOM 82 CA GLN A 82 224.793 252.082 257.609 1.00 0.00 C +ATOM 83 CA GLN A 83 226.011 249.209 259.796 1.00 0.00 C +ATOM 84 CA GLN A 84 225.103 246.459 262.271 1.00 0.00 C +ATOM 85 CA GLN A 85 223.839 244.261 265.115 1.00 0.00 C +ATOM 86 CA ASN A 86 221.205 241.841 263.802 1.00 0.00 C +ATOM 87 CA CYS A 87 218.770 239.313 265.284 1.00 0.00 C +ATOM 88 CA GLN A 88 218.026 236.301 263.073 1.00 0.00 C +ATOM 89 CA ASN A 89 218.285 233.286 265.388 1.00 0.00 C +ATOM 90 CA THR A 90 216.890 230.070 266.880 1.00 0.00 C +ATOM 91 CA LEU A 91 214.855 229.764 270.086 1.00 0.00 C +ATOM 92 CA ARG A 92 212.728 226.711 270.905 1.00 0.00 C +ATOM 93 CA HIS A 93 213.805 223.919 273.263 1.00 0.00 C +ATOM 94 CA GLY A 94 215.342 221.814 276.042 1.00 0.00 C +ATOM 95 CA GLY A 95 215.077 218.903 278.486 1.00 0.00 C +ATOM 96 CA MET A 96 213.746 216.609 281.221 1.00 0.00 C +ATOM 97 CA VAL A 97 216.598 214.797 282.982 1.00 0.00 C +ATOM 98 CA ARG A 98 219.959 213.596 284.315 1.00 0.00 C +ATOM 99 CA ARG A 99 221.355 210.507 282.575 1.00 0.00 C +ATOM 100 CA MET A 100 219.632 207.865 280.437 1.00 0.00 C +ATOM 101 CA ARG A 101 217.811 205.515 282.819 1.00 0.00 C +ATOM 102 CA THR A 102 216.458 205.641 286.379 1.00 0.00 C +ATOM 103 CA GLY A 103 216.242 204.408 289.978 1.00 0.00 C +ATOM 104 CA PHE A 104 219.472 204.806 291.958 1.00 0.00 C +TER 105 PHE A 104 +END diff --git a/Plants/Q8LNW3/Q8LNW3.dcd b/Plants/Q8LNW3/Q8LNW3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..fda2a2079215c9ef91cba6d7d90dd2b8ad5bdc35 --- /dev/null +++ b/Plants/Q8LNW3/Q8LNW3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:6aece09bc7e7aead0b63b4143b3095d562a6958765a66f3a692890262693d10c +size 18080276 diff --git a/Plants/Q8LNW3/top.pdb b/Plants/Q8LNW3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..14a798acdf640d10bb0100fe725086974c6ceaab --- /dev/null +++ b/Plants/Q8LNW3/top.pdb @@ -0,0 +1,148 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 196.613 262.841 254.808 1.00 0.00 C +ATOM 2 CA SER A 2 196.272 265.667 257.341 1.00 0.00 C +ATOM 3 CA ARG A 3 197.204 268.616 259.566 1.00 0.00 C +ATOM 4 CA CYS A 4 195.672 269.541 262.930 1.00 0.00 C +ATOM 5 CA SER A 5 196.898 267.332 265.782 1.00 0.00 C +ATOM 6 CA PRO A 6 200.259 268.760 266.868 1.00 0.00 C +ATOM 7 CA PHE A 7 203.936 268.615 265.882 1.00 0.00 C +ATOM 8 CA PHE A 8 205.324 267.330 262.574 1.00 0.00 C +ATOM 9 CA SER A 9 203.346 269.076 259.826 1.00 0.00 C +ATOM 10 CA TYR A 10 204.959 271.730 257.620 1.00 0.00 C +ATOM 11 CA HIS A 11 203.277 271.263 254.233 1.00 0.00 C +ATOM 12 CA HIS A 12 202.218 274.373 252.304 1.00 0.00 C +ATOM 13 CA HIS A 13 200.460 277.230 254.109 1.00 0.00 C +ATOM 14 CA PRO A 14 201.200 280.518 255.887 1.00 0.00 C +ATOM 15 CA HIS A 15 204.586 282.081 255.109 1.00 0.00 C +ATOM 16 CA HIS A 16 207.285 279.392 255.147 1.00 0.00 C +ATOM 17 CA SER A 17 209.849 278.090 257.647 1.00 0.00 C +ATOM 18 CA ALA A 18 208.319 277.665 261.110 1.00 0.00 C +ATOM 19 CA ALA A 19 210.105 274.912 263.047 1.00 0.00 C +ATOM 20 CA GLY A 20 212.845 273.206 261.022 1.00 0.00 C +ATOM 21 CA ILE A 21 213.055 269.498 261.870 1.00 0.00 C +ATOM 22 CA GLU A 22 216.458 267.813 261.561 1.00 0.00 C +ATOM 23 CA THR A 23 219.225 265.359 260.646 1.00 0.00 C +ATOM 24 CA SER A 24 222.749 263.943 260.347 1.00 0.00 C +ATOM 25 CA ALA A 25 224.166 263.897 263.884 1.00 0.00 C +ATOM 26 CA THR A 26 227.491 262.044 264.035 1.00 0.00 C +ATOM 27 CA ALA A 27 230.824 261.435 262.293 1.00 0.00 C +ATOM 28 CA VAL A 28 232.725 264.490 261.039 1.00 0.00 C +ATOM 29 CA PRO A 29 231.567 267.563 259.107 1.00 0.00 C +ATOM 30 CA HIS A 30 229.187 270.503 258.659 1.00 0.00 C +ATOM 31 CA GLY A 31 226.694 272.176 261.005 1.00 0.00 C +ATOM 32 CA GLU A 32 227.267 272.920 264.697 1.00 0.00 C +ATOM 33 CA ALA A 33 224.535 271.059 266.592 1.00 0.00 C +ATOM 34 CA GLU A 34 224.126 268.325 269.214 1.00 0.00 C +ATOM 35 CA PRO A 35 220.657 266.786 268.872 1.00 0.00 C +ATOM 36 CA LEU A 36 217.816 268.341 270.879 1.00 0.00 C +ATOM 37 CA GLU A 37 214.957 270.749 271.611 1.00 0.00 C +ATOM 38 CA GLU A 38 213.750 272.571 268.490 1.00 0.00 C +ATOM 39 CA ARG A 39 216.883 273.106 266.391 1.00 0.00 C +ATOM 40 CA GLU A 40 219.341 274.623 263.905 1.00 0.00 C +ATOM 41 CA GLU A 41 222.559 276.443 262.987 1.00 0.00 C +ATOM 42 CA GLY A 42 225.726 278.553 263.180 1.00 0.00 C +ATOM 43 CA GLU A 43 228.401 281.028 262.070 1.00 0.00 C +ATOM 44 CA HIS A 44 231.090 282.909 264.007 1.00 0.00 C +ATOM 45 CA ALA A 45 232.945 282.047 267.221 1.00 0.00 C +ATOM 46 CA ALA A 46 234.586 281.306 270.579 1.00 0.00 C +ATOM 47 CA GLU A 47 235.838 278.929 273.280 1.00 0.00 C +ATOM 48 CA GLU A 48 235.686 275.202 272.504 1.00 0.00 C +ATOM 49 CA VAL A 49 237.688 272.914 270.207 1.00 0.00 C +ATOM 50 CA ALA A 50 236.019 269.579 269.426 1.00 0.00 C +ATOM 51 CA SER A 51 234.324 268.375 272.618 1.00 0.00 C +ATOM 52 CA ARG A 52 234.813 264.606 272.877 1.00 0.00 C +ATOM 53 CA ARG A 53 231.677 263.270 274.580 1.00 0.00 C +ATOM 54 CA HIS A 54 228.497 265.184 273.721 1.00 0.00 C +ATOM 55 CA PRO A 55 225.034 263.608 273.513 1.00 0.00 C +ATOM 56 CA SER A 56 224.870 259.835 274.019 1.00 0.00 C +ATOM 57 CA TYR A 57 227.091 256.882 274.950 1.00 0.00 C +ATOM 58 CA ALA A 58 228.944 253.586 274.487 1.00 0.00 C +ATOM 59 CA ALA A 59 229.772 252.318 270.991 1.00 0.00 C +ATOM 60 CA VAL A 60 233.114 251.815 269.233 1.00 0.00 C +ATOM 61 CA HIS A 61 233.614 253.922 266.098 1.00 0.00 C +ATOM 62 CA ARG A 62 231.449 255.531 263.407 1.00 0.00 C +ATOM 63 CA ALA A 63 233.633 256.210 260.360 1.00 0.00 C +ATOM 64 CA GLU A 64 237.029 256.508 258.659 1.00 0.00 C +ATOM 65 CA LYS A 65 240.270 258.487 258.351 1.00 0.00 C +ATOM 66 CA ARG A 66 243.398 260.500 257.523 1.00 0.00 C +ATOM 67 CA HIS A 67 245.852 261.658 254.849 1.00 0.00 C +ATOM 68 CA ASP A 68 247.173 264.527 252.718 1.00 0.00 C +ATOM 69 CA PRO A 69 247.748 267.717 250.715 1.00 0.00 C +ATOM 70 CA ILE A 70 250.607 269.279 248.741 1.00 0.00 C +ATOM 71 CA ALA A 71 253.873 267.335 249.013 1.00 0.00 C +ATOM 72 CA ALA A 72 253.714 264.664 246.301 1.00 0.00 C +ATOM 73 CA ALA A 73 254.574 261.096 245.278 1.00 0.00 C +ATOM 74 CA THR A 74 256.684 258.779 243.110 1.00 0.00 C +ATOM 75 CA ALA A 75 257.780 255.137 243.327 1.00 0.00 C +ATOM 76 CA THR A 76 257.755 251.546 244.600 1.00 0.00 C +ATOM 77 CA ALA A 77 254.937 248.993 244.361 1.00 0.00 C +ATOM 78 CA SER A 78 255.664 246.811 241.324 1.00 0.00 C +ATOM 79 CA PRO A 79 256.200 243.108 240.609 1.00 0.00 C +ATOM 80 CA ARG A 80 259.171 242.937 238.230 1.00 0.00 C +ATOM 81 CA PRO A 81 258.184 240.812 235.226 1.00 0.00 C +ATOM 82 CA PRO A 82 259.339 237.222 235.770 1.00 0.00 C +ATOM 83 CA SER A 83 259.990 235.082 238.854 1.00 0.00 C +ATOM 84 CA ALA A 84 260.929 237.172 241.898 1.00 0.00 C +ATOM 85 CA THR A 85 258.744 236.058 244.813 1.00 0.00 C +ATOM 86 CA SER A 86 256.146 233.293 245.163 1.00 0.00 C +ATOM 87 CA HIS A 87 254.250 232.003 242.121 1.00 0.00 C +ATOM 88 CA ARG A 88 254.297 232.805 238.396 1.00 0.00 C +ATOM 89 CA ARG A 89 253.663 230.845 235.192 1.00 0.00 C +ATOM 90 CA PRO A 90 249.972 230.892 234.247 1.00 0.00 C +ATOM 91 CA ARG A 91 248.976 229.654 230.784 1.00 0.00 C +ATOM 92 CA PRO A 92 249.247 227.848 227.440 1.00 0.00 C +ATOM 93 CA PRO A 93 250.843 225.482 224.917 1.00 0.00 C +ATOM 94 CA ALA A 94 251.947 227.735 222.049 1.00 0.00 C +ATOM 95 CA LEU A 95 254.481 230.248 223.383 1.00 0.00 C +ATOM 96 CA PRO A 96 258.061 231.331 224.105 1.00 0.00 C +ATOM 97 CA PRO A 97 261.539 231.782 225.594 1.00 0.00 C +ATOM 98 CA PRO A 98 262.989 235.197 224.727 1.00 0.00 C +ATOM 99 CA PRO A 99 265.869 237.670 225.046 1.00 0.00 C +ATOM 100 CA ALA A 100 265.867 241.083 223.353 1.00 0.00 C +ATOM 101 CA PRO A 101 267.510 244.520 223.416 1.00 0.00 C +ATOM 102 CA HIS A 102 268.170 247.553 225.625 1.00 0.00 C +ATOM 103 CA CYS A 103 266.193 250.717 226.398 1.00 0.00 C +ATOM 104 CA HIS A 104 262.666 251.907 227.210 1.00 0.00 C +ATOM 105 CA LYS A 105 259.356 253.676 227.866 1.00 0.00 C +ATOM 106 CA ALA A 106 259.235 255.461 231.230 1.00 0.00 C +ATOM 107 CA PRO A 107 262.543 257.337 231.453 1.00 0.00 C +ATOM 108 CA THR A 108 266.178 256.430 230.761 1.00 0.00 C +ATOM 109 CA ALA A 109 269.248 256.209 233.006 1.00 0.00 C +ATOM 110 CA ALA A 110 272.828 256.512 234.274 1.00 0.00 C +ATOM 111 CA VAL A 111 275.557 254.570 236.090 1.00 0.00 C +ATOM 112 CA GLU A 112 279.264 253.949 235.468 1.00 0.00 C +ATOM 113 CA LEU A 113 281.110 250.765 236.455 1.00 0.00 C +ATOM 114 CA SER A 114 282.075 247.588 238.324 1.00 0.00 C +ATOM 115 CA PRO A 115 283.568 245.984 241.440 1.00 0.00 C +ATOM 116 CA GLY A 116 281.740 242.735 242.230 1.00 0.00 C +ATOM 117 CA ALA A 117 283.757 239.602 243.025 1.00 0.00 C +ATOM 118 CA THR A 118 286.390 237.872 240.882 1.00 0.00 C +ATOM 119 CA ALA A 119 289.403 235.609 241.441 1.00 0.00 C +ATOM 120 CA ALA A 120 291.182 233.912 238.530 1.00 0.00 C +ATOM 121 CA PRO A 121 290.217 231.116 236.129 1.00 0.00 C +ATOM 122 CA LEU A 122 290.831 227.602 237.468 1.00 0.00 C +ATOM 123 CA PRO A 123 291.550 223.865 237.651 1.00 0.00 C +ATOM 124 CA LEU A 124 293.775 221.756 239.913 1.00 0.00 C +ATOM 125 CA ALA A 125 296.703 219.619 238.739 1.00 0.00 C +ATOM 126 CA ALA A 126 296.414 215.844 239.163 1.00 0.00 C +ATOM 127 CA VAL A 127 294.644 212.914 237.491 1.00 0.00 C +ATOM 128 CA SER A 128 295.957 209.654 238.963 1.00 0.00 C +ATOM 129 CA ALA A 129 296.036 207.193 241.870 1.00 0.00 C +ATOM 130 CA ARG A 130 298.121 205.752 244.715 1.00 0.00 C +ATOM 131 CA ARG A 131 298.555 207.401 248.122 1.00 0.00 C +ATOM 132 CA GLU A 132 299.302 210.948 249.295 1.00 0.00 C +ATOM 133 CA THR A 133 300.484 212.828 246.199 1.00 0.00 C +ATOM 134 CA GLU A 134 303.988 212.023 244.938 1.00 0.00 C +ATOM 135 CA ARG A 135 305.346 208.649 246.073 1.00 0.00 C +ATOM 136 CA GLU A 136 306.070 205.514 244.033 1.00 0.00 C +ATOM 137 CA GLY A 137 306.879 201.794 243.873 1.00 0.00 C +ATOM 138 CA ALA A 138 309.504 199.450 245.333 1.00 0.00 C +ATOM 139 CA ALA A 139 311.822 196.427 245.291 1.00 0.00 C +ATOM 140 CA ARG A 140 314.065 196.171 242.222 1.00 0.00 C +ATOM 141 CA LYS A 141 315.357 198.674 239.656 1.00 0.00 C +ATOM 142 CA GLU A 142 318.090 199.956 237.332 1.00 0.00 C +ATOM 143 CA LYS A 143 319.383 201.035 233.914 1.00 0.00 C +ATOM 144 CA ASN A 144 319.698 198.117 231.484 1.00 0.00 C +TER 145 ASN A 144 +END diff --git a/Plants/Q8LP43/Q8LP43.dcd b/Plants/Q8LP43/Q8LP43.dcd new file mode 100644 index 0000000000000000000000000000000000000000..2b8f2dabbbb5de5240a0a276393f449f7228c2a8 --- /dev/null +++ b/Plants/Q8LP43/Q8LP43.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:772a7ad7164980417dc563de0e5290a0b2d12b54073465bb38749e0d1af5144f +size 15680276 diff --git a/Plants/Q8LP43/top.pdb b/Plants/Q8LP43/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..e9ad15b8558dc4d52e3757096e192cc6414f5708 --- /dev/null +++ b/Plants/Q8LP43/top.pdb @@ -0,0 +1,128 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 234.740 224.444 268.197 1.00 0.00 C +ATOM 2 CA GLU A 2 234.750 225.662 264.587 1.00 0.00 C +ATOM 3 CA HIS A 3 237.797 226.445 262.438 1.00 0.00 C +ATOM 4 CA GLN A 4 236.646 227.176 258.880 1.00 0.00 C +ATOM 5 CA GLY A 5 237.598 230.761 258.012 1.00 0.00 C +ATOM 6 CA HIS A 6 238.456 232.260 254.616 1.00 0.00 C +ATOM 7 CA GLY A 7 239.348 234.884 252.001 1.00 0.00 C +ATOM 8 CA ALA A 8 241.832 237.535 253.151 1.00 0.00 C +ATOM 9 CA GLY A 9 245.043 237.386 251.105 1.00 0.00 C +ATOM 10 CA GLU A 10 247.726 239.697 249.701 1.00 0.00 C +ATOM 11 CA LYS A 11 251.108 238.828 251.226 1.00 0.00 C +ATOM 12 CA LYS A 12 254.646 237.721 252.104 1.00 0.00 C +ATOM 13 CA GLY A 13 257.917 235.802 251.737 1.00 0.00 C +ATOM 14 CA VAL A 14 261.285 234.021 251.729 1.00 0.00 C +ATOM 15 CA MET A 15 263.060 232.711 248.623 1.00 0.00 C +ATOM 16 CA GLU A 16 265.036 234.674 246.024 1.00 0.00 C +ATOM 17 CA SER A 17 267.233 237.753 245.560 1.00 0.00 C +ATOM 18 CA ILE A 18 267.308 240.755 243.216 1.00 0.00 C +ATOM 19 CA THR A 19 268.249 240.983 239.531 1.00 0.00 C +ATOM 20 CA GLU A 20 267.132 243.982 237.463 1.00 0.00 C +ATOM 21 CA LYS A 21 267.115 247.497 238.933 1.00 0.00 C +ATOM 22 CA LEU A 22 268.063 251.165 239.339 1.00 0.00 C +ATOM 23 CA PRO A 23 266.924 253.316 242.270 1.00 0.00 C +ATOM 24 CA ARG A 24 263.570 254.156 243.870 1.00 0.00 C +ATOM 25 CA GLY A 25 261.487 256.559 241.773 1.00 0.00 C +ATOM 26 CA HIS A 26 260.268 255.030 238.503 1.00 0.00 C +ATOM 27 CA GLY A 27 257.191 253.694 236.695 1.00 0.00 C +ATOM 28 CA ASP A 28 255.753 250.235 236.003 1.00 0.00 C +ATOM 29 CA HIS A 29 252.441 249.826 234.163 1.00 0.00 C +ATOM 30 CA GLN A 30 249.441 251.244 236.036 1.00 0.00 C +ATOM 31 CA GLN A 31 249.111 255.029 235.754 1.00 0.00 C +ATOM 32 CA ALA A 32 249.017 256.304 232.165 1.00 0.00 C +ATOM 33 CA THR A 33 248.532 260.076 232.385 1.00 0.00 C +ATOM 34 CA GLY A 34 245.466 261.236 230.443 1.00 0.00 C +ATOM 35 CA GLY A 35 242.208 260.236 232.147 1.00 0.00 C +ATOM 36 CA THR A 36 241.731 256.605 233.200 1.00 0.00 C +ATOM 37 CA TYR A 37 241.884 253.749 230.684 1.00 0.00 C +ATOM 38 CA GLY A 38 245.161 251.806 230.773 1.00 0.00 C +ATOM 39 CA GLN A 39 246.590 248.710 229.074 1.00 0.00 C +ATOM 40 CA GLN A 40 245.202 245.943 226.853 1.00 0.00 C +ATOM 41 CA GLY A 41 243.590 247.223 223.646 1.00 0.00 C +ATOM 42 CA HIS A 42 245.097 250.110 221.668 1.00 0.00 C +ATOM 43 CA THR A 43 247.303 253.167 221.119 1.00 0.00 C +ATOM 44 CA GLY A 44 250.665 251.788 219.973 1.00 0.00 C +ATOM 45 CA VAL A 45 253.400 250.643 222.365 1.00 0.00 C +ATOM 46 CA THR A 46 253.833 250.196 226.124 1.00 0.00 C +ATOM 47 CA GLY A 47 257.412 251.177 226.985 1.00 0.00 C +ATOM 48 CA THR A 48 260.913 250.282 225.779 1.00 0.00 C +ATOM 49 CA GLY A 49 262.284 251.642 222.494 1.00 0.00 C +ATOM 50 CA THR A 50 260.122 252.893 219.617 1.00 0.00 C +ATOM 51 CA GLY A 51 259.290 256.503 218.728 1.00 0.00 C +ATOM 52 CA THR A 52 261.467 258.385 216.232 1.00 0.00 C +ATOM 53 CA GLY A 53 259.251 260.661 214.128 1.00 0.00 C +ATOM 54 CA GLU A 54 258.381 264.342 214.581 1.00 0.00 C +ATOM 55 CA LYS A 55 255.037 265.248 216.167 1.00 0.00 C +ATOM 56 CA LYS A 56 255.513 268.807 217.440 1.00 0.00 C +ATOM 57 CA GLY A 57 257.322 271.608 219.285 1.00 0.00 C +ATOM 58 CA VAL A 58 254.854 274.338 220.272 1.00 0.00 C +ATOM 59 CA VAL A 59 255.003 275.681 223.834 1.00 0.00 C +ATOM 60 CA GLU A 60 253.258 275.894 227.215 1.00 0.00 C +ATOM 61 CA ASN A 61 252.350 276.451 230.873 1.00 0.00 C +ATOM 62 CA ILE A 62 251.741 279.967 232.207 1.00 0.00 C +ATOM 63 CA LYS A 63 249.496 280.009 235.286 1.00 0.00 C +ATOM 64 CA GLU A 64 247.074 277.089 234.940 1.00 0.00 C +ATOM 65 CA LYS A 65 246.308 273.539 233.788 1.00 0.00 C +ATOM 66 CA LEU A 66 244.620 271.128 236.208 1.00 0.00 C +ATOM 67 CA PRO A 67 240.859 270.560 235.978 1.00 0.00 C +ATOM 68 CA GLY A 68 238.967 268.161 238.253 1.00 0.00 C +ATOM 69 CA GLY A 69 241.501 265.516 239.303 1.00 0.00 C +ATOM 70 CA HIS A 70 241.937 262.153 241.039 1.00 0.00 C +ATOM 71 CA GLY A 71 241.540 261.614 244.790 1.00 0.00 C +ATOM 72 CA ASP A 72 241.903 258.450 246.881 1.00 0.00 C +ATOM 73 CA HIS A 73 238.600 257.666 248.610 1.00 0.00 C +ATOM 74 CA GLN A 74 236.449 255.303 250.686 1.00 0.00 C +ATOM 75 CA HIS A 75 238.175 253.236 253.382 1.00 0.00 C +ATOM 76 CA THR A 76 239.268 252.663 256.987 1.00 0.00 C +ATOM 77 CA THR A 77 238.284 255.118 259.729 1.00 0.00 C +ATOM 78 CA GLY A 78 238.019 258.918 259.719 1.00 0.00 C +ATOM 79 CA MET A 79 238.682 261.933 257.487 1.00 0.00 C +ATOM 80 CA SER A 80 238.337 263.412 253.992 1.00 0.00 C +ATOM 81 CA GLY A 81 241.686 264.215 252.363 1.00 0.00 C +ATOM 82 CA SER A 82 244.022 264.718 249.396 1.00 0.00 C +ATOM 83 CA LYS A 83 244.984 268.354 248.787 1.00 0.00 C +ATOM 84 CA THR A 84 246.654 269.630 251.965 1.00 0.00 C +ATOM 85 CA HIS A 85 246.901 270.576 255.647 1.00 0.00 C +ATOM 86 CA ALA A 86 247.785 269.908 259.292 1.00 0.00 C +ATOM 87 CA THR A 87 248.051 268.108 262.640 1.00 0.00 C +ATOM 88 CA THR A 88 248.936 266.072 265.736 1.00 0.00 C +ATOM 89 CA ALA A 89 250.140 262.713 264.399 1.00 0.00 C +ATOM 90 CA THR A 90 251.996 260.982 261.558 1.00 0.00 C +ATOM 91 CA THR A 91 252.621 257.225 261.649 1.00 0.00 C +ATOM 92 CA ASP A 92 254.218 255.414 264.596 1.00 0.00 C +ATOM 93 CA GLY A 93 253.346 254.598 268.215 1.00 0.00 C +ATOM 94 CA ASN A 94 253.874 255.139 271.949 1.00 0.00 C +ATOM 95 CA TYR A 95 256.149 258.186 272.171 1.00 0.00 C +ATOM 96 CA GLY A 96 258.949 259.450 274.425 1.00 0.00 C +ATOM 97 CA LYS A 97 261.611 257.987 276.726 1.00 0.00 C +ATOM 98 CA SER A 98 263.010 254.561 277.632 1.00 0.00 C +ATOM 99 CA GLY A 99 264.869 251.288 278.219 1.00 0.00 C +ATOM 100 CA HIS A 100 267.096 249.436 280.694 1.00 0.00 C +ATOM 101 CA THR A 101 265.124 246.525 282.159 1.00 0.00 C +ATOM 102 CA GLY A 102 262.718 243.594 281.787 1.00 0.00 C +ATOM 103 CA THR A 103 259.823 243.998 284.230 1.00 0.00 C +ATOM 104 CA ASP A 104 257.079 241.487 283.402 1.00 0.00 C +ATOM 105 CA SER A 105 254.743 239.578 281.075 1.00 0.00 C +ATOM 106 CA THR A 106 251.123 239.285 279.925 1.00 0.00 C +ATOM 107 CA GLY A 107 249.418 237.631 276.946 1.00 0.00 C +ATOM 108 CA GLU A 108 252.042 235.961 274.746 1.00 0.00 C +ATOM 109 CA ASN A 109 251.323 232.471 273.398 1.00 0.00 C +ATOM 110 CA LYS A 110 249.335 229.288 272.739 1.00 0.00 C +ATOM 111 CA SER A 111 247.451 226.964 270.379 1.00 0.00 C +ATOM 112 CA MET A 112 245.151 225.363 267.798 1.00 0.00 C +ATOM 113 CA MET A 113 241.563 224.086 267.690 1.00 0.00 C +ATOM 114 CA ASP A 114 240.787 223.153 271.302 1.00 0.00 C +ATOM 115 CA LYS A 115 243.054 220.196 272.099 1.00 0.00 C +ATOM 116 CA ILE A 116 241.889 216.957 273.733 1.00 0.00 C +ATOM 117 CA LYS A 117 238.406 216.937 275.278 1.00 0.00 C +ATOM 118 CA ASP A 118 238.468 218.337 278.821 1.00 0.00 C +ATOM 119 CA LYS A 119 240.855 220.350 281.003 1.00 0.00 C +ATOM 120 CA LEU A 120 239.498 223.883 281.442 1.00 0.00 C +ATOM 121 CA PRO A 121 239.146 227.287 283.116 1.00 0.00 C +ATOM 122 CA GLY A 122 238.902 231.060 282.643 1.00 0.00 C +ATOM 123 CA GLN A 123 236.837 233.518 280.590 1.00 0.00 C +ATOM 124 CA HIS A 124 236.200 234.164 276.890 1.00 0.00 C +TER 125 HIS A 124 +END diff --git a/Plants/Q8LQ44/Q8LQ44.dcd b/Plants/Q8LQ44/Q8LQ44.dcd new file mode 100644 index 0000000000000000000000000000000000000000..748059cf1df91bc61ea6c48604d7011d99d50784 --- /dev/null +++ b/Plants/Q8LQ44/Q8LQ44.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:9c40f16214ef1d4b58c5ba2893bfa8c864b9a7cd1cbc27f31e9127968a436704 +size 8720276 diff --git a/Plants/Q8LQ44/top.pdb b/Plants/Q8LQ44/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..f95328e44dabd903510e0ce74a38c05cb301f487 --- /dev/null +++ b/Plants/Q8LQ44/top.pdb @@ -0,0 +1,70 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 245.497 290.625 230.697 1.00 0.00 C +ATOM 2 CA ALA A 2 247.898 287.668 230.639 1.00 0.00 C +ATOM 3 CA ALA A 3 250.430 288.267 227.856 1.00 0.00 C +ATOM 4 CA PHE A 4 252.920 285.654 226.635 1.00 0.00 C +ATOM 5 CA ALA A 5 251.846 282.066 227.337 1.00 0.00 C +ATOM 6 CA GLY A 6 249.177 279.852 225.760 1.00 0.00 C +ATOM 7 CA LYS A 7 250.603 276.549 224.503 1.00 0.00 C +ATOM 8 CA GLU A 8 250.945 273.691 226.998 1.00 0.00 C +ATOM 9 CA ASP A 9 251.755 271.859 230.239 1.00 0.00 C +ATOM 10 CA GLU A 10 252.958 268.254 230.511 1.00 0.00 C +ATOM 11 CA GLN A 11 256.093 268.292 232.676 1.00 0.00 C +ATOM 12 CA ARG A 12 259.742 268.106 231.594 1.00 0.00 C +ATOM 13 CA GLN A 13 260.356 269.852 228.263 1.00 0.00 C +ATOM 14 CA ARG A 14 261.021 270.087 224.519 1.00 0.00 C +ATOM 15 CA LEU A 15 259.490 270.050 221.031 1.00 0.00 C +ATOM 16 CA ALA A 16 259.547 267.257 218.440 1.00 0.00 C +ATOM 17 CA SER A 17 261.388 263.986 217.785 1.00 0.00 C +ATOM 18 CA ARG A 18 261.053 260.271 217.012 1.00 0.00 C +ATOM 19 CA LYS A 19 260.997 258.520 220.395 1.00 0.00 C +ATOM 20 CA LYS A 20 258.842 257.228 223.260 1.00 0.00 C +ATOM 21 CA ALA A 21 256.258 257.842 225.992 1.00 0.00 C +ATOM 22 CA SER A 22 255.424 258.502 229.650 1.00 0.00 C +ATOM 23 CA GLU A 23 253.628 258.739 233.002 1.00 0.00 C +ATOM 24 CA ALA A 24 252.571 257.540 236.461 1.00 0.00 C +ATOM 25 CA ALA A 25 249.881 255.248 237.884 1.00 0.00 C +ATOM 26 CA VAL A 26 246.930 253.423 239.458 1.00 0.00 C +ATOM 27 CA ALA A 27 244.129 250.855 239.189 1.00 0.00 C +ATOM 28 CA GLN A 28 244.197 247.299 240.556 1.00 0.00 C +ATOM 29 CA ARG A 29 245.419 247.413 244.162 1.00 0.00 C +ATOM 30 CA ARG A 30 248.277 246.294 246.420 1.00 0.00 C +ATOM 31 CA ARG A 31 249.683 242.817 245.748 1.00 0.00 C +ATOM 32 CA GLY A 32 250.621 239.609 243.920 1.00 0.00 C +ATOM 33 CA ALA A 33 252.687 237.306 246.144 1.00 0.00 C +ATOM 34 CA PRO A 34 253.564 233.604 245.940 1.00 0.00 C +ATOM 35 CA GLY A 35 252.141 230.632 247.852 1.00 0.00 C +ATOM 36 CA ASP A 36 251.057 230.158 251.474 1.00 0.00 C +ATOM 37 CA GLU A 37 248.432 227.396 251.517 1.00 0.00 C +ATOM 38 CA GLY A 38 245.073 226.579 253.118 1.00 0.00 C +ATOM 39 CA GLN A 39 245.105 226.153 256.904 1.00 0.00 C +ATOM 40 CA ALA A 40 242.559 226.950 259.624 1.00 0.00 C +ATOM 41 CA ALA A 41 242.778 227.608 263.370 1.00 0.00 C +ATOM 42 CA SER A 42 241.068 230.972 263.897 1.00 0.00 C +ATOM 43 CA ARG A 43 238.528 233.568 265.048 1.00 0.00 C +ATOM 44 CA SER A 44 240.034 237.015 265.648 1.00 0.00 C +ATOM 45 CA GLY A 45 239.813 237.784 269.373 1.00 0.00 C +ATOM 46 CA HIS A 46 241.984 236.116 272.023 1.00 0.00 C +ATOM 47 CA GLN A 47 245.565 237.396 271.793 1.00 0.00 C +ATOM 48 CA ALA A 48 248.162 237.388 269.005 1.00 0.00 C +ATOM 49 CA ILE A 49 249.722 234.012 268.175 1.00 0.00 C +ATOM 50 CA HIS A 50 250.501 231.976 271.299 1.00 0.00 C +ATOM 51 CA PRO A 51 252.431 228.693 271.169 1.00 0.00 C +ATOM 52 CA SER A 52 255.842 228.391 272.840 1.00 0.00 C +ATOM 53 CA LYS A 53 258.054 229.108 275.859 1.00 0.00 C +ATOM 54 CA GLY A 54 256.996 231.478 278.647 1.00 0.00 C +ATOM 55 CA ILE A 55 254.795 234.541 279.187 1.00 0.00 C +ATOM 56 CA ARG A 56 254.557 237.822 277.266 1.00 0.00 C +ATOM 57 CA HIS A 57 252.388 240.915 276.767 1.00 0.00 C +ATOM 58 CA ARG A 58 250.747 241.524 273.383 1.00 0.00 C +ATOM 59 CA ARG A 59 249.938 245.059 272.214 1.00 0.00 C +ATOM 60 CA SER A 60 246.437 246.562 272.145 1.00 0.00 C +ATOM 61 CA GLY A 61 243.319 248.434 273.281 1.00 0.00 C +ATOM 62 CA ALA A 62 242.516 249.654 276.800 1.00 0.00 C +ATOM 63 CA SER A 63 241.393 246.899 279.180 1.00 0.00 C +ATOM 64 CA SER A 64 237.752 246.484 280.222 1.00 0.00 C +ATOM 65 CA SER A 65 237.784 245.385 283.870 1.00 0.00 C +ATOM 66 CA SER A 66 236.703 242.724 286.373 1.00 0.00 C +TER 67 SER A 66 +END diff --git a/Plants/Q8LQU8/Q8LQU8.dcd b/Plants/Q8LQU8/Q8LQU8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..9ef0c7787353d851a9f5b958feb8c3b504657880 --- /dev/null +++ b/Plants/Q8LQU8/Q8LQU8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:388e97ba11264d6ebe8641c9964c0961691e8d20fd4dc183034fd7142f9908c5 +size 41880276 diff --git a/Plants/Q8LQU8/top.pdb b/Plants/Q8LQU8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..e00f07ce1994ae1a1698576909225a98f4f0938e --- /dev/null +++ b/Plants/Q8LQU8/top.pdb @@ -0,0 +1,230 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 328.406 244.823 262.560 1.00 0.00 C +ATOM 2 CA ASP A 2 327.034 241.661 260.936 1.00 0.00 C +ATOM 3 CA ARG A 3 325.637 238.966 258.633 1.00 0.00 C +ATOM 4 CA ASP A 4 327.857 237.522 255.894 1.00 0.00 C +ATOM 5 CA VAL A 5 328.068 236.902 252.141 1.00 0.00 C +ATOM 6 CA THR A 6 328.378 238.522 248.706 1.00 0.00 C +ATOM 7 CA GLU A 7 325.215 239.954 247.139 1.00 0.00 C +ATOM 8 CA PRO A 8 323.582 239.850 243.698 1.00 0.00 C +ATOM 9 CA ALA A 9 325.144 242.182 241.121 1.00 0.00 C +ATOM 10 CA ALA A 10 324.010 241.101 237.648 1.00 0.00 C +ATOM 11 CA PRO A 11 323.425 238.298 235.135 1.00 0.00 C +ATOM 12 CA LEU A 12 321.770 234.866 235.199 1.00 0.00 C +ATOM 13 CA GLN A 13 318.556 232.870 234.753 1.00 0.00 C +ATOM 14 CA ALA A 14 318.245 229.180 235.647 1.00 0.00 C +ATOM 15 CA ASP A 15 316.836 227.258 232.673 1.00 0.00 C +ATOM 16 CA SER A 16 315.247 225.405 229.749 1.00 0.00 C +ATOM 17 CA SER A 17 311.841 226.853 228.841 1.00 0.00 C +ATOM 18 CA SER A 18 308.138 226.264 229.517 1.00 0.00 C +ATOM 19 CA SER A 19 306.589 225.940 226.051 1.00 0.00 C +ATOM 20 CA SER A 20 303.685 226.226 223.603 1.00 0.00 C +ATOM 21 CA SER A 21 301.326 229.218 223.589 1.00 0.00 C +ATOM 22 CA THR A 22 297.992 228.013 222.193 1.00 0.00 C +ATOM 23 CA SER A 23 294.706 226.104 221.920 1.00 0.00 C +ATOM 24 CA VAL A 24 291.578 228.274 222.077 1.00 0.00 C +ATOM 25 CA PRO A 25 288.528 227.719 224.292 1.00 0.00 C +ATOM 26 CA ALA A 26 287.099 226.476 227.598 1.00 0.00 C +ATOM 27 CA GLY A 27 286.902 229.528 229.870 1.00 0.00 C +ATOM 28 CA GLN A 28 286.060 228.722 233.497 1.00 0.00 C +ATOM 29 CA PRO A 29 284.644 231.089 236.126 1.00 0.00 C +ATOM 30 CA ASN A 30 282.744 228.820 238.526 1.00 0.00 C +ATOM 31 CA THR A 31 279.750 226.464 238.533 1.00 0.00 C +ATOM 32 CA SER A 32 277.365 227.211 235.657 1.00 0.00 C +ATOM 33 CA ALA A 33 274.735 224.859 234.220 1.00 0.00 C +ATOM 34 CA ASP A 34 274.548 221.055 234.329 1.00 0.00 C +ATOM 35 CA PRO A 35 273.068 220.011 230.977 1.00 0.00 C +ATOM 36 CA THR A 36 271.547 217.316 228.755 1.00 0.00 C +ATOM 37 CA PRO A 37 271.703 213.554 229.342 1.00 0.00 C +ATOM 38 CA SER A 38 269.243 210.838 228.301 1.00 0.00 C +ATOM 39 CA ARG A 39 267.173 208.171 230.066 1.00 0.00 C +ATOM 40 CA PRO A 40 263.622 208.370 228.698 1.00 0.00 C +ATOM 41 CA PRO A 41 262.675 207.741 225.061 1.00 0.00 C +ATOM 42 CA SER A 42 258.901 207.317 224.767 1.00 0.00 C +ATOM 43 CA PRO A 43 255.110 207.696 224.802 1.00 0.00 C +ATOM 44 CA PRO A 44 253.752 211.102 223.769 1.00 0.00 C +ATOM 45 CA VAL A 45 252.639 212.778 220.533 1.00 0.00 C +ATOM 46 CA PRO A 46 254.481 211.082 217.661 1.00 0.00 C +ATOM 47 CA ARG A 47 253.227 212.737 214.467 1.00 0.00 C +ATOM 48 CA LYS A 48 254.592 216.228 213.783 1.00 0.00 C +ATOM 49 CA GLY A 49 254.744 217.911 217.198 1.00 0.00 C +ATOM 50 CA SER A 50 256.999 219.723 219.676 1.00 0.00 C +ATOM 51 CA SER A 51 258.471 221.615 222.638 1.00 0.00 C +ATOM 52 CA TYR A 52 259.730 223.944 225.377 1.00 0.00 C +ATOM 53 CA THR A 53 259.427 223.255 229.112 1.00 0.00 C +ATOM 54 CA SER A 54 259.224 220.145 231.303 1.00 0.00 C +ATOM 55 CA ASP A 55 261.167 220.915 234.489 1.00 0.00 C +ATOM 56 CA GLN A 56 263.110 217.885 235.736 1.00 0.00 C +ATOM 57 CA ALA A 57 263.874 214.972 238.069 1.00 0.00 C +ATOM 58 CA VAL A 58 265.878 212.357 239.983 1.00 0.00 C +ATOM 59 CA THR A 59 263.838 209.209 240.649 1.00 0.00 C +ATOM 60 CA HIS A 60 260.545 208.697 238.802 1.00 0.00 C +ATOM 61 CA SER A 61 257.247 209.253 236.977 1.00 0.00 C +ATOM 62 CA ARG A 62 254.086 207.614 238.333 1.00 0.00 C +ATOM 63 CA LEU A 63 251.911 206.023 241.026 1.00 0.00 C +ATOM 64 CA TRP A 64 251.682 202.235 240.683 1.00 0.00 C +ATOM 65 CA LYS A 65 248.512 201.234 238.823 1.00 0.00 C +ATOM 66 CA ALA A 66 245.001 201.758 237.437 1.00 0.00 C +ATOM 67 CA ARG A 67 243.828 198.792 235.354 1.00 0.00 C +ATOM 68 CA GLY A 68 243.835 199.778 231.674 1.00 0.00 C +ATOM 69 CA GLY A 69 243.498 199.602 227.883 1.00 0.00 C +ATOM 70 CA ARG A 70 241.926 196.546 226.239 1.00 0.00 C +ATOM 71 CA ARG A 71 242.550 193.238 228.024 1.00 0.00 C +ATOM 72 CA ARG A 72 245.704 192.299 229.944 1.00 0.00 C +ATOM 73 CA GLN A 73 247.752 192.053 233.148 1.00 0.00 C +ATOM 74 CA VAL A 74 248.874 190.007 236.159 1.00 0.00 C +ATOM 75 CA GLY A 75 250.249 187.597 238.770 1.00 0.00 C +ATOM 76 CA PRO A 76 249.144 188.162 242.372 1.00 0.00 C +ATOM 77 CA MET A 77 246.035 186.764 244.073 1.00 0.00 C +ATOM 78 CA SER A 78 243.330 188.484 246.132 1.00 0.00 C +ATOM 79 CA GLN A 79 243.682 188.827 249.911 1.00 0.00 C +ATOM 80 CA ARG A 80 243.865 188.469 253.699 1.00 0.00 C +ATOM 81 CA LEU A 81 244.031 191.342 256.196 1.00 0.00 C +ATOM 82 CA GLN A 82 243.512 194.789 257.734 1.00 0.00 C +ATOM 83 CA ARG A 83 244.781 197.748 255.697 1.00 0.00 C +ATOM 84 CA GLU A 84 242.876 199.097 252.685 1.00 0.00 C +ATOM 85 CA GLY A 85 244.522 202.456 251.964 1.00 0.00 C +ATOM 86 CA GLY A 86 245.079 205.965 250.588 1.00 0.00 C +ATOM 87 CA GLY A 87 246.900 208.691 248.647 1.00 0.00 C +ATOM 88 CA ALA A 88 249.251 210.473 246.236 1.00 0.00 C +ATOM 89 CA TRP A 89 247.795 211.985 243.056 1.00 0.00 C +ATOM 90 CA GLN A 90 247.191 215.739 243.296 1.00 0.00 C +ATOM 91 CA VAL A 91 245.170 218.907 243.926 1.00 0.00 C +ATOM 92 CA GLY A 92 246.481 220.479 247.140 1.00 0.00 C +ATOM 93 CA PRO A 93 248.943 218.910 249.587 1.00 0.00 C +ATOM 94 CA THR A 94 249.339 221.008 252.742 1.00 0.00 C +ATOM 95 CA ARG A 95 249.833 223.776 255.313 1.00 0.00 C +ATOM 96 CA ARG A 96 251.450 227.215 255.589 1.00 0.00 C +ATOM 97 CA TRP A 97 253.967 227.514 252.744 1.00 0.00 C +ATOM 98 CA LEU A 98 255.340 230.880 251.604 1.00 0.00 C +ATOM 99 CA LYS A 99 257.239 232.278 248.611 1.00 0.00 C +ATOM 100 CA GLY A 100 257.342 231.760 244.838 1.00 0.00 C +ATOM 101 CA GLU A 101 259.064 234.759 243.238 1.00 0.00 C +ATOM 102 CA ALA A 102 260.690 233.595 239.995 1.00 0.00 C +ATOM 103 CA ARG A 103 263.327 230.921 239.352 1.00 0.00 C +ATOM 104 CA GLU A 104 266.631 232.734 239.916 1.00 0.00 C +ATOM 105 CA ALA A 105 267.891 234.353 243.126 1.00 0.00 C +ATOM 106 CA PRO A 106 269.595 235.774 246.224 1.00 0.00 C +ATOM 107 CA ALA A 107 272.419 238.085 245.130 1.00 0.00 C +ATOM 108 CA GLY A 108 273.982 241.021 246.989 1.00 0.00 C +ATOM 109 CA LEU A 109 277.191 243.050 246.667 1.00 0.00 C +ATOM 110 CA GLY A 110 276.248 246.274 244.868 1.00 0.00 C +ATOM 111 CA SER A 111 273.414 248.750 245.461 1.00 0.00 C +ATOM 112 CA THR A 112 270.935 250.844 247.459 1.00 0.00 C +ATOM 113 CA SER A 113 269.678 254.387 248.073 1.00 0.00 C +ATOM 114 CA ARG A 114 269.186 256.336 251.310 1.00 0.00 C +ATOM 115 CA PRO A 115 268.341 258.523 254.313 1.00 0.00 C +ATOM 116 CA THR A 116 266.228 261.371 255.708 1.00 0.00 C +ATOM 117 CA GLY A 117 265.417 263.836 252.919 1.00 0.00 C +ATOM 118 CA ARG A 118 267.098 267.143 252.048 1.00 0.00 C +ATOM 119 CA PRO A 119 269.355 268.222 249.174 1.00 0.00 C +ATOM 120 CA ARG A 120 267.881 266.676 246.019 1.00 0.00 C +ATOM 121 CA ARG A 121 264.995 267.382 243.635 1.00 0.00 C +ATOM 122 CA GLY A 122 261.276 268.170 243.376 1.00 0.00 C +ATOM 123 CA SER A 123 259.892 271.673 243.954 1.00 0.00 C +ATOM 124 CA GLY A 124 258.401 275.148 244.423 1.00 0.00 C +ATOM 125 CA GLU A 125 260.352 277.943 242.720 1.00 0.00 C +ATOM 126 CA ALA A 126 264.126 277.925 243.241 1.00 0.00 C +ATOM 127 CA ARG A 127 267.160 275.884 244.311 1.00 0.00 C +ATOM 128 CA PRO A 128 266.941 273.972 247.599 1.00 0.00 C +ATOM 129 CA PRO A 129 264.099 271.861 249.008 1.00 0.00 C +ATOM 130 CA THR A 130 261.643 271.553 251.905 1.00 0.00 C +ATOM 131 CA ALA A 131 263.090 272.105 255.386 1.00 0.00 C +ATOM 132 CA VAL A 132 265.885 271.819 257.959 1.00 0.00 C +ATOM 133 CA THR A 133 267.952 274.298 259.983 1.00 0.00 C +ATOM 134 CA GLY A 134 269.188 276.564 262.785 1.00 0.00 C +ATOM 135 CA GLY A 135 269.781 280.208 263.728 1.00 0.00 C +ATOM 136 CA ALA A 136 271.057 282.439 260.915 1.00 0.00 C +ATOM 137 CA GLY A 137 269.548 280.924 257.762 1.00 0.00 C +ATOM 138 CA SER A 138 267.518 279.519 254.859 1.00 0.00 C +ATOM 139 CA GLY A 139 267.462 279.115 251.071 1.00 0.00 C +ATOM 140 CA GLY A 140 263.926 279.154 249.654 1.00 0.00 C +ATOM 141 CA ASP A 141 260.586 280.839 250.378 1.00 0.00 C +ATOM 142 CA GLY A 142 256.899 280.137 249.720 1.00 0.00 C +ATOM 143 CA ARG A 143 253.260 280.820 250.620 1.00 0.00 C +ATOM 144 CA LYS A 144 252.526 280.603 254.352 1.00 0.00 C +ATOM 145 CA ALA A 145 255.060 278.430 256.189 1.00 0.00 C +ATOM 146 CA ALA A 146 254.697 279.110 259.920 1.00 0.00 C +ATOM 147 CA ALA A 147 257.308 277.824 262.378 1.00 0.00 C +ATOM 148 CA HIS A 148 259.393 275.204 260.560 1.00 0.00 C +ATOM 149 CA GLY A 149 260.145 272.380 263.005 1.00 0.00 C +ATOM 150 CA ARG A 150 259.295 273.372 266.584 1.00 0.00 C +ATOM 151 CA SER A 151 261.665 273.600 269.558 1.00 0.00 C +ATOM 152 CA SER A 152 260.298 276.375 271.782 1.00 0.00 C +ATOM 153 CA ASP A 153 256.720 276.237 273.084 1.00 0.00 C +ATOM 154 CA VAL A 154 253.543 274.135 273.016 1.00 0.00 C +ATOM 155 CA ALA A 155 250.636 275.225 270.807 1.00 0.00 C +ATOM 156 CA SER A 156 252.084 277.632 268.234 1.00 0.00 C +ATOM 157 CA ALA A 157 250.325 280.527 266.489 1.00 0.00 C +ATOM 158 CA ARG A 158 247.827 281.313 263.721 1.00 0.00 C +ATOM 159 CA GLY A 159 244.369 279.866 264.401 1.00 0.00 C +ATOM 160 CA LYS A 160 242.419 276.689 265.191 1.00 0.00 C +ATOM 161 CA LEU A 161 241.166 273.568 266.980 1.00 0.00 C +ATOM 162 CA ARG A 162 239.551 270.274 268.010 1.00 0.00 C +ATOM 163 CA LYS A 163 238.974 268.426 271.291 1.00 0.00 C +ATOM 164 CA GLY A 164 240.110 268.601 274.924 1.00 0.00 C +ATOM 165 CA GLY A 165 237.596 269.939 277.454 1.00 0.00 C +ATOM 166 CA GLY A 166 234.136 271.347 278.207 1.00 0.00 C +ATOM 167 CA GLU A 167 232.500 268.873 280.599 1.00 0.00 C +ATOM 168 CA GLY A 168 234.598 266.294 282.460 1.00 0.00 C +ATOM 169 CA GLY A 169 233.713 262.653 283.148 1.00 0.00 C +ATOM 170 CA LEU A 170 231.957 260.727 280.368 1.00 0.00 C +ATOM 171 CA THR A 171 228.622 261.402 278.654 1.00 0.00 C +ATOM 172 CA GLY A 172 224.823 261.331 278.930 1.00 0.00 C +ATOM 173 CA ASP A 173 223.473 263.422 276.046 1.00 0.00 C +ATOM 174 CA THR A 174 221.237 262.444 273.120 1.00 0.00 C +ATOM 175 CA ALA A 175 218.082 264.380 272.217 1.00 0.00 C +ATOM 176 CA ALA A 176 215.083 265.220 270.023 1.00 0.00 C +ATOM 177 CA GLY A 177 214.092 267.942 267.548 1.00 0.00 C +ATOM 178 CA ALA A 178 211.988 270.857 266.284 1.00 0.00 C +ATOM 179 CA GLU A 179 208.541 271.971 265.105 1.00 0.00 C +ATOM 180 CA ASP A 180 206.603 274.061 262.577 1.00 0.00 C +ATOM 181 CA GLU A 181 204.776 277.403 262.491 1.00 0.00 C +ATOM 182 CA GLY A 182 203.390 280.734 261.266 1.00 0.00 C +ATOM 183 CA GLY A 183 203.203 282.776 258.055 1.00 0.00 C +ATOM 184 CA ASP A 184 204.115 280.398 255.221 1.00 0.00 C +ATOM 185 CA ASP A 185 205.877 281.439 252.007 1.00 0.00 C +ATOM 186 CA ASP A 186 205.624 282.814 248.463 1.00 0.00 C +ATOM 187 CA PRO A 187 204.958 282.998 244.716 1.00 0.00 C +ATOM 188 CA THR A 188 204.838 283.064 240.909 1.00 0.00 C +ATOM 189 CA ARG A 189 201.900 281.859 238.803 1.00 0.00 C +ATOM 190 CA GLY A 190 199.988 283.274 235.826 1.00 0.00 C +ATOM 191 CA GLY A 191 197.262 285.615 237.092 1.00 0.00 C +ATOM 192 CA ALA A 192 194.151 287.811 237.215 1.00 0.00 C +ATOM 193 CA ASP A 193 193.674 290.726 239.621 1.00 0.00 C +ATOM 194 CA GLU A 194 194.301 290.269 243.351 1.00 0.00 C +ATOM 195 CA TRP A 195 197.792 288.945 244.111 1.00 0.00 C +ATOM 196 CA TRP A 196 199.992 289.145 247.215 1.00 0.00 C +ATOM 197 CA ARG A 197 199.122 291.018 250.417 1.00 0.00 C +ATOM 198 CA HIS A 198 195.954 291.906 252.337 1.00 0.00 C +ATOM 199 CA LEU A 199 195.193 292.892 255.938 1.00 0.00 C +ATOM 200 CA GLU A 200 192.343 294.538 257.857 1.00 0.00 C +ATOM 201 CA GLU A 201 192.309 294.735 261.662 1.00 0.00 C +ATOM 202 CA GLY A 202 193.002 295.147 265.385 1.00 0.00 C +ATOM 203 CA ARG A 203 195.717 294.928 268.049 1.00 0.00 C +ATOM 204 CA ARG A 204 199.342 295.734 268.902 1.00 0.00 C +ATOM 205 CA GLY A 205 201.241 294.474 271.955 1.00 0.00 C +ATOM 206 CA VAL A 206 200.164 292.296 274.890 1.00 0.00 C +ATOM 207 CA ARG A 207 199.558 288.825 276.339 1.00 0.00 C +ATOM 208 CA ASP A 208 201.678 285.968 274.975 1.00 0.00 C +ATOM 209 CA GLY A 209 205.467 286.129 274.610 1.00 0.00 C +ATOM 210 CA GLU A 210 207.330 289.104 276.092 1.00 0.00 C +ATOM 211 CA SER A 211 206.422 292.771 276.586 1.00 0.00 C +ATOM 212 CA ASP A 212 206.043 294.276 280.066 1.00 0.00 C +ATOM 213 CA ARG A 213 203.415 296.754 281.277 1.00 0.00 C +ATOM 214 CA ASP A 214 203.233 299.986 279.267 1.00 0.00 C +ATOM 215 CA ASP A 215 200.394 302.083 277.831 1.00 0.00 C +ATOM 216 CA GLN A 216 196.701 301.602 278.633 1.00 0.00 C +ATOM 217 CA ASN A 217 193.823 303.448 276.952 1.00 0.00 C +ATOM 218 CA GLY A 218 191.508 306.288 275.905 1.00 0.00 C +ATOM 219 CA TRP A 219 188.277 307.424 274.236 1.00 0.00 C +ATOM 220 CA PRO A 220 185.233 306.755 276.428 1.00 0.00 C +ATOM 221 CA GLU A 221 184.732 303.020 276.988 1.00 0.00 C +ATOM 222 CA THR A 222 183.593 300.299 274.578 1.00 0.00 C +ATOM 223 CA GLU A 223 181.826 301.163 271.315 1.00 0.00 C +ATOM 224 CA GLY A 224 184.422 302.206 268.728 1.00 0.00 C +ATOM 225 CA ASN A 225 187.041 304.770 267.688 1.00 0.00 C +ATOM 226 CA GLY A 226 186.177 308.320 266.611 1.00 0.00 C +TER 227 GLY A 226 +END diff --git a/Plants/Q8LR23/Q8LR23.dcd b/Plants/Q8LR23/Q8LR23.dcd new file mode 100644 index 0000000000000000000000000000000000000000..e48c3e931da35cced806f8a468f4e9ed72c889c3 --- /dev/null +++ b/Plants/Q8LR23/Q8LR23.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:618605b79db72094ad13a25593bdeb8844acc3a3ff547be0122452d48e32fd48 +size 36840276 diff --git a/Plants/Q8LR23/top.pdb b/Plants/Q8LR23/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..4e1a7131600a67c4025fd61c805641dc92d759d6 --- /dev/null +++ b/Plants/Q8LR23/top.pdb @@ -0,0 +1,202 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 211.883 305.869 267.765 1.00 0.00 C +ATOM 2 CA VAL A 2 210.624 304.771 264.341 1.00 0.00 C +ATOM 3 CA ALA A 3 207.239 303.800 262.887 1.00 0.00 C +ATOM 4 CA GLY A 4 205.612 300.610 261.585 1.00 0.00 C +ATOM 5 CA GLY A 5 203.575 297.896 259.854 1.00 0.00 C +ATOM 6 CA GLY A 6 204.509 296.268 256.538 1.00 0.00 C +ATOM 7 CA HIS A 7 203.188 298.381 253.656 1.00 0.00 C +ATOM 8 CA ARG A 8 203.900 297.333 250.062 1.00 0.00 C +ATOM 9 CA HIS A 9 204.380 297.462 246.285 1.00 0.00 C +ATOM 10 CA GLY A 10 204.343 295.542 242.994 1.00 0.00 C +ATOM 11 CA GLY A 11 200.829 295.840 241.553 1.00 0.00 C +ATOM 12 CA ALA A 12 198.737 293.202 239.770 1.00 0.00 C +ATOM 13 CA ALA A 13 195.865 291.308 241.406 1.00 0.00 C +ATOM 14 CA ALA A 14 197.065 290.636 244.959 1.00 0.00 C +ATOM 15 CA GLU A 15 196.245 291.468 248.586 1.00 0.00 C +ATOM 16 CA ARG A 16 199.608 291.888 250.326 1.00 0.00 C +ATOM 17 CA GLY A 17 203.318 291.023 250.378 1.00 0.00 C +ATOM 18 CA GLU A 18 206.876 290.555 249.099 1.00 0.00 C +ATOM 19 CA GLY A 19 209.227 292.867 247.189 1.00 0.00 C +ATOM 20 CA LYS A 20 211.073 294.446 244.254 1.00 0.00 C +ATOM 21 CA GLY A 21 212.983 292.116 241.922 1.00 0.00 C +ATOM 22 CA GLU A 22 215.965 293.716 240.172 1.00 0.00 C +ATOM 23 CA LYS A 23 216.974 291.158 237.536 1.00 0.00 C +ATOM 24 CA ARG A 24 218.452 287.720 236.819 1.00 0.00 C +ATOM 25 CA ARG A 25 217.111 284.485 238.321 1.00 0.00 C +ATOM 26 CA TRP A 26 216.961 282.322 241.454 1.00 0.00 C +ATOM 27 CA SER A 27 215.607 282.538 245.008 1.00 0.00 C +ATOM 28 CA THR A 28 216.813 283.300 248.541 1.00 0.00 C +ATOM 29 CA ALA A 29 214.311 281.505 250.785 1.00 0.00 C +ATOM 30 CA HIS A 30 211.789 279.146 249.175 1.00 0.00 C +ATOM 31 CA PRO A 31 207.980 279.154 249.088 1.00 0.00 C +ATOM 32 CA ARG A 32 205.919 279.719 245.933 1.00 0.00 C +ATOM 33 CA SER A 33 208.217 279.463 242.905 1.00 0.00 C +ATOM 34 CA THR A 34 211.685 278.013 242.287 1.00 0.00 C +ATOM 35 CA ALA A 35 212.975 276.649 238.972 1.00 0.00 C +ATOM 36 CA THR A 36 213.149 275.806 235.261 1.00 0.00 C +ATOM 37 CA THR A 37 211.173 272.565 234.934 1.00 0.00 C +ATOM 38 CA LYS A 38 211.440 269.578 237.283 1.00 0.00 C +ATOM 39 CA LYS A 39 213.755 270.543 240.151 1.00 0.00 C +ATOM 40 CA ALA A 40 217.413 270.836 239.126 1.00 0.00 C +ATOM 41 CA ALA A 41 221.151 271.064 238.425 1.00 0.00 C +ATOM 42 CA GLY A 42 224.678 271.481 237.045 1.00 0.00 C +ATOM 43 CA ALA A 43 226.109 268.121 235.958 1.00 0.00 C +ATOM 44 CA GLU A 44 225.834 264.445 236.918 1.00 0.00 C +ATOM 45 CA GLU A 45 226.194 261.009 238.526 1.00 0.00 C +ATOM 46 CA GLY A 46 229.609 260.522 240.144 1.00 0.00 C +ATOM 47 CA GLY A 47 231.396 262.835 242.588 1.00 0.00 C +ATOM 48 CA GLY A 48 234.103 263.591 245.160 1.00 0.00 C +ATOM 49 CA ALA A 49 235.819 262.116 248.225 1.00 0.00 C +ATOM 50 CA ALA A 50 234.146 260.977 251.453 1.00 0.00 C +ATOM 51 CA ARG A 51 230.668 260.846 253.004 1.00 0.00 C +ATOM 52 CA VAL A 52 228.049 263.208 254.443 1.00 0.00 C +ATOM 53 CA ASP A 53 224.464 261.942 254.188 1.00 0.00 C +ATOM 54 CA GLY A 54 222.819 259.913 256.962 1.00 0.00 C +ATOM 55 CA VAL A 55 219.784 257.987 258.226 1.00 0.00 C +ATOM 56 CA ASP A 56 217.283 255.210 258.966 1.00 0.00 C +ATOM 57 CA GLY A 57 215.827 254.249 262.353 1.00 0.00 C +ATOM 58 CA ILE A 58 215.351 251.041 264.353 1.00 0.00 C +ATOM 59 CA PRO A 59 213.468 248.254 266.143 1.00 0.00 C +ATOM 60 CA ALA A 60 211.613 246.227 263.504 1.00 0.00 C +ATOM 61 CA VAL A 61 208.546 247.637 261.738 1.00 0.00 C +ATOM 62 CA GLY A 62 207.383 251.022 263.045 1.00 0.00 C +ATOM 63 CA GLY A 63 209.089 254.377 262.451 1.00 0.00 C +ATOM 64 CA LEU A 64 209.930 257.929 261.360 1.00 0.00 C +ATOM 65 CA GLY A 65 208.768 261.459 260.519 1.00 0.00 C +ATOM 66 CA GLU A 66 211.068 263.679 258.445 1.00 0.00 C +ATOM 67 CA GLY A 67 213.836 265.571 256.637 1.00 0.00 C +ATOM 68 CA VAL A 68 216.761 267.870 257.458 1.00 0.00 C +ATOM 69 CA ASP A 69 220.492 267.129 257.666 1.00 0.00 C +ATOM 70 CA GLY A 70 223.792 265.976 259.182 1.00 0.00 C +ATOM 71 CA VAL A 71 226.907 267.745 260.479 1.00 0.00 C +ATOM 72 CA ASP A 72 226.911 267.232 264.254 1.00 0.00 C +ATOM 73 CA GLY A 73 229.455 267.741 267.044 1.00 0.00 C +ATOM 74 CA GLY A 74 233.139 268.269 267.859 1.00 0.00 C +ATOM 75 CA ALA A 75 236.374 269.762 266.508 1.00 0.00 C +ATOM 76 CA ALA A 76 238.331 271.802 263.954 1.00 0.00 C +ATOM 77 CA LYS A 77 239.592 274.866 262.074 1.00 0.00 C +ATOM 78 CA PRO A 78 238.616 278.324 260.805 1.00 0.00 C +ATOM 79 CA LYS A 79 237.797 279.509 257.278 1.00 0.00 C +ATOM 80 CA GLU A 80 237.113 277.429 254.160 1.00 0.00 C +ATOM 81 CA ALA A 81 239.674 275.306 252.303 1.00 0.00 C +ATOM 82 CA THR A 82 238.010 271.892 251.992 1.00 0.00 C +ATOM 83 CA PRO A 83 239.061 268.936 249.830 1.00 0.00 C +ATOM 84 CA TRP A 84 242.826 268.564 250.287 1.00 0.00 C +ATOM 85 CA ARG A 85 246.236 269.935 251.288 1.00 0.00 C +ATOM 86 CA GLU A 86 249.446 270.754 249.406 1.00 0.00 C +ATOM 87 CA THR A 87 252.048 272.548 251.534 1.00 0.00 C +ATOM 88 CA VAL A 88 255.753 273.280 252.038 1.00 0.00 C +ATOM 89 CA LEU A 89 256.720 276.901 251.357 1.00 0.00 C +ATOM 90 CA ALA A 90 260.459 277.265 251.995 1.00 0.00 C +ATOM 91 CA SER A 91 262.015 274.969 254.607 1.00 0.00 C +ATOM 92 CA GLY A 92 260.968 272.145 256.942 1.00 0.00 C +ATOM 93 CA GLU A 93 260.195 268.461 257.529 1.00 0.00 C +ATOM 94 CA GLY A 94 256.563 267.967 258.570 1.00 0.00 C +ATOM 95 CA ARG A 95 254.865 264.697 257.602 1.00 0.00 C +ATOM 96 CA LEU A 96 252.908 261.514 256.860 1.00 0.00 C +ATOM 97 CA GLU A 97 253.410 258.360 254.782 1.00 0.00 C +ATOM 98 CA VAL A 98 252.130 254.794 254.378 1.00 0.00 C +ATOM 99 CA VAL A 99 249.740 251.836 254.135 1.00 0.00 C +ATOM 100 CA GLY A 100 250.493 248.812 251.944 1.00 0.00 C +ATOM 101 CA ASP A 101 253.667 247.615 250.208 1.00 0.00 C +ATOM 102 CA GLY A 102 255.024 244.106 249.606 1.00 0.00 C +ATOM 103 CA GLY A 103 252.933 241.080 250.601 1.00 0.00 C +ATOM 104 CA GLU A 104 254.484 238.188 252.537 1.00 0.00 C +ATOM 105 CA ARG A 105 257.287 235.744 253.364 1.00 0.00 C +ATOM 106 CA GLU A 106 260.526 235.009 255.232 1.00 0.00 C +ATOM 107 CA GLY A 107 263.823 236.866 254.793 1.00 0.00 C +ATOM 108 CA ASP A 108 264.896 237.890 251.283 1.00 0.00 C +ATOM 109 CA GLY A 109 266.806 240.182 248.915 1.00 0.00 C +ATOM 110 CA ALA A 110 266.373 243.759 250.154 1.00 0.00 C +ATOM 111 CA SER A 111 267.365 247.436 250.030 1.00 0.00 C +ATOM 112 CA SER A 112 265.838 249.131 246.978 1.00 0.00 C +ATOM 113 CA ILE A 113 262.060 249.626 247.013 1.00 0.00 C +ATOM 114 CA PRO A 114 259.942 251.514 244.469 1.00 0.00 C +ATOM 115 CA ALA A 115 256.156 251.863 244.715 1.00 0.00 C +ATOM 116 CA GLY A 116 253.360 250.698 242.404 1.00 0.00 C +ATOM 117 CA ARG A 117 253.211 246.893 242.290 1.00 0.00 C +ATOM 118 CA ARG A 118 254.669 243.515 243.284 1.00 0.00 C +ATOM 119 CA CYS A 119 256.950 240.889 241.730 1.00 0.00 C +ATOM 120 CA GLY A 120 260.592 239.859 242.162 1.00 0.00 C +ATOM 121 CA LYS A 121 261.181 240.042 245.922 1.00 0.00 C +ATOM 122 CA GLY A 122 258.740 237.826 247.831 1.00 0.00 C +ATOM 123 CA ARG A 123 257.042 235.404 245.430 1.00 0.00 C +ATOM 124 CA LYS A 124 258.165 232.080 243.945 1.00 0.00 C +ATOM 125 CA ARG A 125 261.077 230.617 245.919 1.00 0.00 C +ATOM 126 CA ALA A 126 263.730 232.617 247.784 1.00 0.00 C +ATOM 127 CA ARG A 127 265.615 231.831 251.000 1.00 0.00 C +ATOM 128 CA GLU A 128 269.399 231.760 250.557 1.00 0.00 C +ATOM 129 CA ALA A 129 271.282 229.136 252.577 1.00 0.00 C +ATOM 130 CA ARG A 130 274.677 227.687 251.634 1.00 0.00 C +ATOM 131 CA GLY A 131 275.016 224.316 253.378 1.00 0.00 C +ATOM 132 CA GLY A 132 278.083 222.061 253.517 1.00 0.00 C +ATOM 133 CA ALA A 133 278.986 218.364 253.336 1.00 0.00 C +ATOM 134 CA ARG A 134 282.162 216.465 254.245 1.00 0.00 C +ATOM 135 CA GLY A 135 283.562 212.922 254.289 1.00 0.00 C +ATOM 136 CA ARG A 136 285.050 211.388 257.443 1.00 0.00 C +ATOM 137 CA ARG A 137 286.204 212.227 260.976 1.00 0.00 C +ATOM 138 CA ARG A 138 285.594 215.720 262.370 1.00 0.00 C +ATOM 139 CA GLU A 139 283.352 215.257 265.415 1.00 0.00 C +ATOM 140 CA ARG A 140 280.526 213.010 266.634 1.00 0.00 C +ATOM 141 CA ARG A 141 277.402 211.319 265.256 1.00 0.00 C +ATOM 142 CA GLU A 142 274.927 208.813 263.804 1.00 0.00 C +ATOM 143 CA GLU A 143 274.414 207.652 260.212 1.00 0.00 C +ATOM 144 CA GLY A 144 272.651 205.939 257.301 1.00 0.00 C +ATOM 145 CA ASP A 145 275.240 204.353 254.999 1.00 0.00 C +ATOM 146 CA ASP A 146 278.680 205.417 256.245 1.00 0.00 C +ATOM 147 CA GLY A 147 280.078 207.818 253.638 1.00 0.00 C +ATOM 148 CA TRP A 148 280.968 205.845 250.502 1.00 0.00 C +ATOM 149 CA ALA A 149 278.723 207.306 247.793 1.00 0.00 C +ATOM 150 CA PRO A 150 280.908 207.275 244.672 1.00 0.00 C +ATOM 151 CA PRO A 151 281.276 203.764 243.239 1.00 0.00 C +ATOM 152 CA VAL A 152 283.623 203.708 240.238 1.00 0.00 C +ATOM 153 CA SER A 153 285.726 202.166 237.461 1.00 0.00 C +ATOM 154 CA GLU A 154 284.067 202.170 234.031 1.00 0.00 C +ATOM 155 CA GLY A 155 284.629 204.450 231.031 1.00 0.00 C +ATOM 156 CA GLY A 156 281.766 206.925 230.591 1.00 0.00 C +ATOM 157 CA GLY A 157 278.361 207.300 232.259 1.00 0.00 C +ATOM 158 CA ARG A 158 277.306 210.874 231.466 1.00 0.00 C +ATOM 159 CA ALA A 159 274.769 213.708 231.690 1.00 0.00 C +ATOM 160 CA ARG A 160 271.280 214.957 232.575 1.00 0.00 C +ATOM 161 CA PRO A 161 271.561 218.671 233.376 1.00 0.00 C +ATOM 162 CA SER A 162 275.110 219.464 234.513 1.00 0.00 C +ATOM 163 CA ALA A 163 278.645 220.573 235.403 1.00 0.00 C +ATOM 164 CA ALA A 164 280.041 221.706 238.762 1.00 0.00 C +ATOM 165 CA ARG A 165 282.793 219.468 240.152 1.00 0.00 C +ATOM 166 CA VAL A 166 284.265 216.042 240.933 1.00 0.00 C +ATOM 167 CA ARG A 167 286.187 213.478 242.994 1.00 0.00 C +ATOM 168 CA GLY A 168 288.755 212.911 245.750 1.00 0.00 C +ATOM 169 CA GLU A 169 288.803 214.084 249.375 1.00 0.00 C +ATOM 170 CA ALA A 170 291.001 217.187 249.615 1.00 0.00 C +ATOM 171 CA GLU A 171 290.420 220.905 249.019 1.00 0.00 C +ATOM 172 CA TRP A 172 287.001 222.548 248.659 1.00 0.00 C +ATOM 173 CA ALA A 173 283.306 222.170 247.812 1.00 0.00 C +ATOM 174 CA THR A 174 281.627 225.377 246.624 1.00 0.00 C +ATOM 175 CA GLY A 175 281.385 229.177 246.741 1.00 0.00 C +ATOM 176 CA ARG A 176 282.377 232.790 246.049 1.00 0.00 C +ATOM 177 CA GLY A 177 280.524 235.821 247.426 1.00 0.00 C +ATOM 178 CA GLU A 178 282.532 238.979 248.139 1.00 0.00 C +ATOM 179 CA ARG A 179 285.677 238.943 250.290 1.00 0.00 C +ATOM 180 CA GLU A 180 287.675 237.017 252.900 1.00 0.00 C +ATOM 181 CA ARG A 181 286.921 233.436 253.959 1.00 0.00 C +ATOM 182 CA GLY A 182 284.118 231.488 255.652 1.00 0.00 C +ATOM 183 CA GLY A 183 283.032 228.431 253.655 1.00 0.00 C +ATOM 184 CA GLU A 184 283.287 224.910 255.089 1.00 0.00 C +ATOM 185 CA GLU A 185 286.832 223.676 255.739 1.00 0.00 C +ATOM 186 CA ARG A 186 287.749 219.978 255.764 1.00 0.00 C +ATOM 187 CA TRP A 187 291.244 218.810 256.732 1.00 0.00 C +ATOM 188 CA ALA A 188 293.559 221.403 258.291 1.00 0.00 C +ATOM 189 CA GLY A 189 293.845 224.968 256.977 1.00 0.00 C +ATOM 190 CA ARG A 190 294.273 227.572 254.229 1.00 0.00 C +ATOM 191 CA PRO A 191 291.386 228.678 252.002 1.00 0.00 C +ATOM 192 CA LYS A 192 289.946 229.814 248.662 1.00 0.00 C +ATOM 193 CA GLY A 193 292.252 229.835 245.630 1.00 0.00 C +ATOM 194 CA GLY A 194 295.092 231.761 243.975 1.00 0.00 C +ATOM 195 CA LYS A 195 297.633 233.173 246.438 1.00 0.00 C +ATOM 196 CA GLY A 196 301.294 232.501 245.622 1.00 0.00 C +ATOM 197 CA ASP A 197 304.357 233.108 243.439 1.00 0.00 C +ATOM 198 CA PHE A 198 306.737 233.998 240.601 1.00 0.00 C +TER 199 PHE A 198 +END diff --git a/Plants/Q8LRH0/Q8LRH0.dcd b/Plants/Q8LRH0/Q8LRH0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..c4b2c1efb27115f618aab84573e525abded8812a --- /dev/null +++ b/Plants/Q8LRH0/Q8LRH0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:19d897cf3fa7d8a385e040f6e8b3b63ecd62626cc67981ded980584a71c6987a +size 14000276 diff --git a/Plants/Q8LRH0/top.pdb b/Plants/Q8LRH0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..0a4fc833bb8fdd09ef2c154b94f8cb1f62ebb44e --- /dev/null +++ b/Plants/Q8LRH0/top.pdb @@ -0,0 +1,114 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-05 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 231.463 233.340 253.073 1.00 0.00 C +ATOM 2 CA ARG A 2 233.308 234.605 249.989 1.00 0.00 C +ATOM 3 CA THR A 3 233.474 234.776 246.187 1.00 0.00 C +ATOM 4 CA GLY A 4 232.554 232.096 243.639 1.00 0.00 C +ATOM 5 CA ALA A 5 234.344 231.977 240.278 1.00 0.00 C +ATOM 6 CA GLU A 6 233.837 228.866 238.138 1.00 0.00 C +ATOM 7 CA GLY A 7 237.308 228.043 236.799 1.00 0.00 C +ATOM 8 CA SER A 8 239.918 230.129 234.969 1.00 0.00 C +ATOM 9 CA VAL A 9 242.362 232.995 234.398 1.00 0.00 C +ATOM 10 CA GLY A 10 245.442 234.808 233.077 1.00 0.00 C +ATOM 11 CA ARG A 11 248.269 232.571 231.845 1.00 0.00 C +ATOM 12 CA GLY A 12 251.341 233.428 229.760 1.00 0.00 C +ATOM 13 CA MET A 13 254.806 234.991 229.502 1.00 0.00 C +ATOM 14 CA ALA A 14 256.469 233.356 226.489 1.00 0.00 C +ATOM 15 CA LEU A 15 259.769 231.909 227.724 1.00 0.00 C +ATOM 16 CA ALA A 16 263.072 233.534 228.706 1.00 0.00 C +ATOM 17 CA ILE A 17 265.748 233.342 231.411 1.00 0.00 C +ATOM 18 CA PRO A 18 267.231 233.396 234.920 1.00 0.00 C +ATOM 19 CA SER A 19 269.674 231.402 237.058 1.00 0.00 C +ATOM 20 CA PRO A 20 270.168 230.764 240.782 1.00 0.00 C +ATOM 21 CA PRO A 21 268.224 232.248 243.703 1.00 0.00 C +ATOM 22 CA ALA A 22 265.456 229.883 244.828 1.00 0.00 C +ATOM 23 CA TYR A 23 261.950 229.324 246.209 1.00 0.00 C +ATOM 24 CA PRO A 24 259.478 229.219 249.107 1.00 0.00 C +ATOM 25 CA ARG A 25 256.954 226.623 250.292 1.00 0.00 C +ATOM 26 CA GLU A 26 255.178 223.859 252.222 1.00 0.00 C +ATOM 27 CA PHE A 27 255.281 220.253 253.447 1.00 0.00 C +ATOM 28 CA ARG A 28 252.649 217.651 252.541 1.00 0.00 C +ATOM 29 CA ALA A 29 249.363 218.923 253.991 1.00 0.00 C +ATOM 30 CA GLY A 30 247.496 220.097 257.097 1.00 0.00 C +ATOM 31 CA GLU A 31 246.566 222.775 259.643 1.00 0.00 C +ATOM 32 CA ARG A 32 244.786 226.075 260.322 1.00 0.00 C +ATOM 33 CA ARG A 33 247.512 228.384 261.644 1.00 0.00 C +ATOM 34 CA ARG A 34 247.186 231.548 259.546 1.00 0.00 C +ATOM 35 CA CYS A 35 246.324 234.041 256.797 1.00 0.00 C +ATOM 36 CA GLY A 36 245.678 237.693 255.923 1.00 0.00 C +ATOM 37 CA ARG A 37 246.312 240.198 253.123 1.00 0.00 C +ATOM 38 CA ARG A 38 244.455 243.408 253.998 1.00 0.00 C +ATOM 39 CA PRO A 39 240.794 242.828 254.878 1.00 0.00 C +ATOM 40 CA THR A 40 238.947 239.515 254.519 1.00 0.00 C +ATOM 41 CA GLY A 41 235.760 238.738 256.457 1.00 0.00 C +ATOM 42 CA ARG A 42 234.586 235.404 257.880 1.00 0.00 C +ATOM 43 CA ALA A 43 234.598 235.146 261.681 1.00 0.00 C +ATOM 44 CA PRO A 44 236.190 232.184 263.472 1.00 0.00 C +ATOM 45 CA ALA A 45 236.469 233.107 267.158 1.00 0.00 C +ATOM 46 CA LEU A 46 233.380 231.833 268.990 1.00 0.00 C +ATOM 47 CA ARG A 47 230.838 234.351 270.298 1.00 0.00 C +ATOM 48 CA ARG A 48 229.399 232.847 273.489 1.00 0.00 C +ATOM 49 CA ARG A 49 231.520 233.997 276.438 1.00 0.00 C +ATOM 50 CA GLY A 50 235.249 233.680 277.151 1.00 0.00 C +ATOM 51 CA GLU A 51 236.750 234.978 280.404 1.00 0.00 C +ATOM 52 CA PRO A 52 233.919 236.116 282.685 1.00 0.00 C +ATOM 53 CA ALA A 53 233.906 239.805 283.637 1.00 0.00 C +ATOM 54 CA THR A 54 233.599 242.514 280.976 1.00 0.00 C +ATOM 55 CA ARG A 55 236.504 244.204 279.180 1.00 0.00 C +ATOM 56 CA GLY A 56 238.177 241.650 276.901 1.00 0.00 C +ATOM 57 CA SER A 57 241.022 243.410 275.077 1.00 0.00 C +ATOM 58 CA ALA A 58 242.619 242.174 271.846 1.00 0.00 C +ATOM 59 CA ARG A 59 245.138 242.115 268.988 1.00 0.00 C +ATOM 60 CA ARG A 60 244.759 240.769 265.444 1.00 0.00 C +ATOM 61 CA HIS A 61 244.924 238.441 262.432 1.00 0.00 C +ATOM 62 CA GLY A 62 248.653 238.054 261.754 1.00 0.00 C +ATOM 63 CA CYS A 63 251.650 235.706 261.878 1.00 0.00 C +ATOM 64 CA ALA A 64 253.647 236.144 258.662 1.00 0.00 C +ATOM 65 CA GLY A 65 256.500 236.840 256.236 1.00 0.00 C +ATOM 66 CA GLN A 66 256.557 237.600 252.503 1.00 0.00 C +ATOM 67 CA ARG A 67 255.522 240.517 250.282 1.00 0.00 C +ATOM 68 CA ARG A 68 253.217 240.357 247.253 1.00 0.00 C +ATOM 69 CA GLY A 69 251.682 239.994 243.784 1.00 0.00 C +ATOM 70 CA GLY A 70 253.738 238.627 240.883 1.00 0.00 C +ATOM 71 CA PRO A 71 254.642 241.632 238.722 1.00 0.00 C +ATOM 72 CA ALA A 72 256.175 244.582 236.861 1.00 0.00 C +ATOM 73 CA ALA A 73 259.804 243.608 236.232 1.00 0.00 C +ATOM 74 CA ARG A 74 260.907 241.692 239.334 1.00 0.00 C +ATOM 75 CA GLN A 75 261.833 243.019 242.784 1.00 0.00 C +ATOM 76 CA ALA A 76 259.346 243.341 245.652 1.00 0.00 C +ATOM 77 CA GLY A 77 260.742 245.651 248.341 1.00 0.00 C +ATOM 78 CA ASN A 78 263.663 247.946 249.188 1.00 0.00 C +ATOM 79 CA THR A 79 262.962 250.407 252.011 1.00 0.00 C +ATOM 80 CA ALA A 80 259.312 251.425 251.619 1.00 0.00 C +ATOM 81 CA ALA A 81 255.575 251.630 250.904 1.00 0.00 C +ATOM 82 CA ALA A 82 253.331 254.580 250.022 1.00 0.00 C +ATOM 83 CA GLY A 83 251.679 257.216 247.822 1.00 0.00 C +ATOM 84 CA GLY A 84 254.244 259.842 246.803 1.00 0.00 C +ATOM 85 CA LYS A 85 254.292 263.605 246.205 1.00 0.00 C +ATOM 86 CA ALA A 86 252.764 266.805 244.814 1.00 0.00 C +ATOM 87 CA GLY A 87 253.013 270.288 246.338 1.00 0.00 C +ATOM 88 CA GLY A 88 255.310 273.327 246.265 1.00 0.00 C +ATOM 89 CA ARG A 89 256.832 276.093 248.398 1.00 0.00 C +ATOM 90 CA GLN A 90 255.940 279.480 246.898 1.00 0.00 C +ATOM 91 CA HIS A 91 256.575 279.219 243.150 1.00 0.00 C +ATOM 92 CA ARG A 92 256.355 282.808 241.892 1.00 0.00 C +ATOM 93 CA SER A 93 257.621 285.889 240.042 1.00 0.00 C +ATOM 94 CA SER A 94 258.242 289.339 241.535 1.00 0.00 C +ATOM 95 CA GLN A 95 254.987 290.214 243.311 1.00 0.00 C +ATOM 96 CA GLN A 96 253.321 293.537 242.472 1.00 0.00 C +ATOM 97 CA GLU A 97 250.610 294.754 244.855 1.00 0.00 C +ATOM 98 CA GLU A 98 249.116 298.218 244.318 1.00 0.00 C +ATOM 99 CA GLY A 99 250.681 301.478 245.516 1.00 0.00 C +ATOM 100 CA LYS A 100 253.242 304.222 244.859 1.00 0.00 C +ATOM 101 CA GLN A 101 254.128 305.352 241.330 1.00 0.00 C +ATOM 102 CA SER A 102 252.654 308.783 240.576 1.00 0.00 C +ATOM 103 CA GLY A 103 254.353 311.516 238.536 1.00 0.00 C +ATOM 104 CA ARG A 104 256.239 314.775 239.116 1.00 0.00 C +ATOM 105 CA SER A 105 260.048 314.713 239.056 1.00 0.00 C +ATOM 106 CA ARG A 106 261.260 311.879 236.816 1.00 0.00 C +ATOM 107 CA GLN A 107 260.016 311.224 233.275 1.00 0.00 C +ATOM 108 CA ALA A 108 257.631 308.262 233.512 1.00 0.00 C +ATOM 109 CA ALA A 109 257.682 305.844 236.456 1.00 0.00 C +ATOM 110 CA ASN A 110 261.252 305.627 237.769 1.00 0.00 C +TER 111 ASN A 110 +END diff --git a/Plants/Q8RUC9/Q8RUC9.dcd b/Plants/Q8RUC9/Q8RUC9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..21c6fdadbf150cb28bf4c2a92a18f38b3f943260 --- /dev/null +++ b/Plants/Q8RUC9/Q8RUC9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:7c6ba26568e47f5d5f8ac607ddfaaf46d0c4b85d96645cdfa790511cc2454db2 +size 6800276 diff --git a/Plants/Q8RUC9/top.pdb b/Plants/Q8RUC9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..606766fe1a92da2154b730648ee05ab8fec7ad1b --- /dev/null +++ b/Plants/Q8RUC9/top.pdb @@ -0,0 +1,54 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 245.564 279.242 238.976 1.00 0.00 C +ATOM 2 CA GLU A 2 246.321 275.691 237.821 1.00 0.00 C +ATOM 3 CA ALA A 3 243.828 272.815 237.988 1.00 0.00 C +ATOM 4 CA SER A 4 243.593 269.162 239.045 1.00 0.00 C +ATOM 5 CA PRO A 5 240.309 267.357 239.736 1.00 0.00 C +ATOM 6 CA THR A 6 238.199 269.467 242.104 1.00 0.00 C +ATOM 7 CA GLN A 7 236.613 272.930 241.989 1.00 0.00 C +ATOM 8 CA ASP A 8 234.184 274.546 244.440 1.00 0.00 C +ATOM 9 CA PRO A 9 234.690 277.626 246.626 1.00 0.00 C +ATOM 10 CA VAL A 10 234.238 280.090 249.496 1.00 0.00 C +ATOM 11 CA GLY A 11 236.086 279.184 252.702 1.00 0.00 C +ATOM 12 CA GLY A 12 238.612 277.544 255.036 1.00 0.00 C +ATOM 13 CA GLY A 13 238.649 273.740 254.821 1.00 0.00 C +ATOM 14 CA GLY A 14 238.816 270.114 253.663 1.00 0.00 C +ATOM 15 CA LYS A 15 240.314 266.851 254.938 1.00 0.00 C +ATOM 16 CA TRP A 16 237.529 264.257 255.114 1.00 0.00 C +ATOM 17 CA ARG A 17 236.295 261.814 252.464 1.00 0.00 C +ATOM 18 CA LYS A 18 238.018 261.126 249.136 1.00 0.00 C +ATOM 19 CA ARG A 19 241.005 262.644 247.324 1.00 0.00 C +ATOM 20 CA ARG A 20 244.230 262.109 245.366 1.00 0.00 C +ATOM 21 CA ARG A 21 246.422 259.048 245.950 1.00 0.00 C +ATOM 22 CA SER A 22 246.270 255.374 244.954 1.00 0.00 C +ATOM 23 CA SER A 23 247.860 252.088 246.045 1.00 0.00 C +ATOM 24 CA THR A 24 247.809 248.453 244.902 1.00 0.00 C +ATOM 25 CA GLU A 25 245.678 245.297 244.801 1.00 0.00 C +ATOM 26 CA PRO A 26 243.698 243.246 242.273 1.00 0.00 C +ATOM 27 CA PRO A 27 245.844 240.490 240.752 1.00 0.00 C +ATOM 28 CA SER A 28 247.587 237.328 239.535 1.00 0.00 C +ATOM 29 CA GLY A 29 250.600 235.337 238.322 1.00 0.00 C +ATOM 30 CA LEU A 30 251.438 231.798 237.186 1.00 0.00 C +ATOM 31 CA GLU A 31 251.532 229.575 240.279 1.00 0.00 C +ATOM 32 CA GLY A 32 254.852 227.733 240.593 1.00 0.00 C +ATOM 33 CA VAL A 33 255.792 226.544 244.088 1.00 0.00 C +ATOM 34 CA GLY A 34 259.066 226.339 246.026 1.00 0.00 C +ATOM 35 CA ASP A 35 262.459 227.867 246.845 1.00 0.00 C +ATOM 36 CA SER A 36 263.612 227.727 250.474 1.00 0.00 C +ATOM 37 CA SER A 37 261.841 225.525 253.029 1.00 0.00 C +ATOM 38 CA LYS A 38 259.361 227.043 255.490 1.00 0.00 C +ATOM 39 CA GLY A 39 259.839 225.152 258.763 1.00 0.00 C +ATOM 40 CA SER A 40 259.328 227.096 262.000 1.00 0.00 C +ATOM 41 CA LYS A 41 261.654 229.533 263.779 1.00 0.00 C +ATOM 42 CA ALA A 42 264.865 229.451 261.730 1.00 0.00 C +ATOM 43 CA ALA A 43 267.320 232.338 262.126 1.00 0.00 C +ATOM 44 CA VAL A 44 267.976 235.087 259.572 1.00 0.00 C +ATOM 45 CA VAL A 45 266.792 238.692 259.225 1.00 0.00 C +ATOM 46 CA VAL A 46 267.966 241.293 261.749 1.00 0.00 C +ATOM 47 CA GLU A 47 267.099 241.672 265.440 1.00 0.00 C +ATOM 48 CA ASP A 48 266.408 238.531 267.482 1.00 0.00 C +ATOM 49 CA ARG A 49 262.651 238.233 268.035 1.00 0.00 C +ATOM 50 CA ARG A 50 259.286 237.802 269.770 1.00 0.00 C +TER 51 ARG A 50 +END diff --git a/Plants/Q8RV65/Q8RV65.dcd b/Plants/Q8RV65/Q8RV65.dcd new file mode 100644 index 0000000000000000000000000000000000000000..01ac6623a5d6099702d5049b2dada581ee4d0b36 --- /dev/null +++ b/Plants/Q8RV65/Q8RV65.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:76b1e21f0f18f226ac4ce220cdd1c5aa633d7455ae03d0190273562092810839 +size 7040276 diff --git a/Plants/Q8RV65/top.pdb b/Plants/Q8RV65/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..e2425b7c0d0d1542b3be110a2de7fad8ee38cc90 --- /dev/null +++ b/Plants/Q8RV65/top.pdb @@ -0,0 +1,56 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 258.034 260.494 230.235 1.00 0.00 C +ATOM 2 CA ASN A 2 260.069 262.844 232.438 1.00 0.00 C +ATOM 3 CA ASN A 3 263.713 262.388 231.422 1.00 0.00 C +ATOM 4 CA ARG A 4 266.366 260.102 232.924 1.00 0.00 C +ATOM 5 CA GLY A 5 264.641 256.843 233.882 1.00 0.00 C +ATOM 6 CA ARG A 6 261.071 255.512 233.839 1.00 0.00 C +ATOM 7 CA TYR A 7 261.377 251.722 233.602 1.00 0.00 C +ATOM 8 CA PRO A 8 262.931 250.313 230.421 1.00 0.00 C +ATOM 9 CA PRO A 9 266.658 251.011 230.794 1.00 0.00 C +ATOM 10 CA GLY A 10 270.032 252.691 230.239 1.00 0.00 C +ATOM 11 CA ILE A 11 273.088 253.819 232.215 1.00 0.00 C +ATOM 12 CA GLY A 12 274.178 256.759 234.380 1.00 0.00 C +ATOM 13 CA ALA A 13 271.772 257.652 237.196 1.00 0.00 C +ATOM 14 CA GLY A 14 269.432 255.036 238.679 1.00 0.00 C +ATOM 15 CA ARG A 15 267.889 254.562 242.130 1.00 0.00 C +ATOM 16 CA GLY A 16 266.569 251.983 244.605 1.00 0.00 C +ATOM 17 CA ALA A 17 263.550 250.997 246.710 1.00 0.00 C +ATOM 18 CA PHE A 18 260.543 253.109 247.713 1.00 0.00 C +ATOM 19 CA ASN A 19 257.167 253.150 249.478 1.00 0.00 C +ATOM 20 CA PRO A 20 255.164 250.438 251.254 1.00 0.00 C +ATOM 21 CA ASN A 21 253.237 250.808 254.520 1.00 0.00 C +ATOM 22 CA PRO A 22 254.249 252.477 257.792 1.00 0.00 C +ATOM 23 CA ASN A 23 253.629 253.051 261.507 1.00 0.00 C +ATOM 24 CA TYR A 24 250.082 252.674 262.845 1.00 0.00 C +ATOM 25 CA GLN A 25 247.545 253.958 260.310 1.00 0.00 C +ATOM 26 CA SER A 26 244.037 255.126 259.392 1.00 0.00 C +ATOM 27 CA ARG A 27 241.542 254.777 262.251 1.00 0.00 C +ATOM 28 CA SER A 28 239.832 251.703 263.715 1.00 0.00 C +ATOM 29 CA GLY A 29 240.488 248.321 265.342 1.00 0.00 C +ATOM 30 CA TYR A 30 239.890 245.061 263.462 1.00 0.00 C +ATOM 31 CA GLN A 31 237.083 242.487 263.369 1.00 0.00 C +ATOM 32 CA GLN A 32 237.439 239.789 260.702 1.00 0.00 C +ATOM 33 CA HIS A 33 239.939 237.057 261.599 1.00 0.00 C +ATOM 34 CA PRO A 34 241.782 233.885 262.627 1.00 0.00 C +ATOM 35 CA PRO A 35 245.557 234.362 262.815 1.00 0.00 C +ATOM 36 CA PRO A 36 246.742 233.833 259.233 1.00 0.00 C +ATOM 37 CA GLN A 37 247.179 236.063 256.175 1.00 0.00 C +ATOM 38 CA TYR A 38 247.667 239.818 256.596 1.00 0.00 C +ATOM 39 CA VAL A 39 245.389 242.846 256.989 1.00 0.00 C +ATOM 40 CA GLN A 40 243.452 246.123 257.146 1.00 0.00 C +ATOM 41 CA ARG A 41 241.738 246.921 253.838 1.00 0.00 C +ATOM 42 CA GLY A 42 239.526 244.075 252.604 1.00 0.00 C +ATOM 43 CA ASN A 43 236.971 245.418 250.117 1.00 0.00 C +ATOM 44 CA TYR A 44 233.619 243.743 249.430 1.00 0.00 C +ATOM 45 CA ALA A 45 230.027 244.317 250.564 1.00 0.00 C +ATOM 46 CA GLN A 46 229.272 247.974 251.323 1.00 0.00 C +ATOM 47 CA ASN A 47 229.102 251.757 251.740 1.00 0.00 C +ATOM 48 CA HIS A 48 232.576 253.295 251.451 1.00 0.00 C +ATOM 49 CA GLN A 49 234.689 252.749 254.575 1.00 0.00 C +ATOM 50 CA GLN A 50 234.493 255.569 257.130 1.00 0.00 C +ATOM 51 CA GLN A 51 234.572 254.516 260.791 1.00 0.00 C +ATOM 52 CA PHE A 52 232.413 254.020 263.890 1.00 0.00 C +TER 53 PHE A 52 +END diff --git a/Plants/Q8RVJ6/Q8RVJ6.dcd b/Plants/Q8RVJ6/Q8RVJ6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..39fc5fa408748c35e267ccc463b08866475cce69 --- /dev/null +++ b/Plants/Q8RVJ6/Q8RVJ6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2c8efc807731d6b13540e39af2adb4ab03959811a99b8e76fdbd400544d95948 +size 6920276 diff --git a/Plants/Q8RVJ6/top.pdb b/Plants/Q8RVJ6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..cbe1f0e1a7358aa408223e34e5ca4cc3a28ab0c1 --- /dev/null +++ b/Plants/Q8RVJ6/top.pdb @@ -0,0 +1,55 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA ALA A 1 269.248 229.363 250.854 1.00 0.00 C +ATOM 2 CA SER A 2 266.267 230.832 248.989 1.00 0.00 C +ATOM 3 CA THR A 3 265.212 232.973 246.020 1.00 0.00 C +ATOM 4 CA VAL A 4 262.403 235.534 245.765 1.00 0.00 C +ATOM 5 CA ASP A 5 259.642 235.318 243.149 1.00 0.00 C +ATOM 6 CA PRO A 6 261.239 236.592 239.932 1.00 0.00 C +ATOM 7 CA SER A 7 259.427 238.428 237.129 1.00 0.00 C +ATOM 8 CA LEU A 8 257.927 241.820 237.999 1.00 0.00 C +ATOM 9 CA GLY A 9 256.133 242.005 241.355 1.00 0.00 C +ATOM 10 CA LYS A 10 252.800 241.491 243.127 1.00 0.00 C +ATOM 11 CA SER A 11 251.746 244.160 245.632 1.00 0.00 C +ATOM 12 CA TRP A 12 254.075 244.288 248.645 1.00 0.00 C +ATOM 13 CA VAL A 13 255.062 244.421 252.322 1.00 0.00 C +ATOM 14 CA SER A 14 252.148 243.006 254.329 1.00 0.00 C +ATOM 15 CA PRO A 15 250.153 239.949 253.238 1.00 0.00 C +ATOM 16 CA SER A 16 246.707 239.966 251.614 1.00 0.00 C +ATOM 17 CA ASP A 17 243.538 239.888 253.729 1.00 0.00 C +ATOM 18 CA GLY A 18 240.642 241.771 255.334 1.00 0.00 C +ATOM 19 CA TYR A 19 238.234 243.568 252.991 1.00 0.00 C +ATOM 20 CA ALA A 20 235.085 243.848 250.864 1.00 0.00 C +ATOM 21 CA ILE A 21 231.937 245.705 249.789 1.00 0.00 C +ATOM 22 CA VAL A 22 229.718 248.743 249.186 1.00 0.00 C +ATOM 23 CA PRO A 23 231.011 252.277 248.588 1.00 0.00 C +ATOM 24 CA ASP A 24 229.302 254.429 251.227 1.00 0.00 C +ATOM 25 CA GLU A 25 226.791 257.065 252.351 1.00 0.00 C +ATOM 26 CA SER A 26 227.874 260.143 254.319 1.00 0.00 C +ATOM 27 CA GLY A 27 229.231 259.120 257.728 1.00 0.00 C +ATOM 28 CA GLN A 28 229.710 256.446 260.400 1.00 0.00 C +ATOM 29 CA ALA A 29 232.520 254.257 261.751 1.00 0.00 C +ATOM 30 CA VAL A 30 235.688 253.138 263.548 1.00 0.00 C +ATOM 31 CA SER A 31 239.273 252.091 264.301 1.00 0.00 C +ATOM 32 CA ASP A 32 242.426 254.228 264.409 1.00 0.00 C +ATOM 33 CA GLY A 33 245.366 251.973 263.523 1.00 0.00 C +ATOM 34 CA GLY A 34 247.948 250.139 265.641 1.00 0.00 C +ATOM 35 CA ASN A 35 251.340 248.404 265.664 1.00 0.00 C +ATOM 36 CA GLY A 36 253.853 247.421 262.974 1.00 0.00 C +ATOM 37 CA ASN A 37 256.039 249.860 261.028 1.00 0.00 C +ATOM 38 CA ASP A 38 257.492 250.895 257.661 1.00 0.00 C +ATOM 39 CA ALA A 39 258.410 253.683 255.231 1.00 0.00 C +ATOM 40 CA SER A 40 257.581 255.095 251.791 1.00 0.00 C +ATOM 41 CA VAL A 41 259.904 254.857 248.781 1.00 0.00 C +ATOM 42 CA PRO A 42 262.572 255.136 246.075 1.00 0.00 C +ATOM 43 CA GLU A 43 262.493 255.163 242.266 1.00 0.00 C +ATOM 44 CA SER A 44 262.082 258.285 240.122 1.00 0.00 C +ATOM 45 CA ASP A 45 262.740 261.971 239.414 1.00 0.00 C +ATOM 46 CA VAL A 46 259.785 263.300 237.410 1.00 0.00 C +ATOM 47 CA LYS A 47 260.737 266.760 236.130 1.00 0.00 C +ATOM 48 CA ARG A 48 259.074 269.130 233.653 1.00 0.00 C +ATOM 49 CA ILE A 49 258.529 272.668 234.957 1.00 0.00 C +ATOM 50 CA ARG A 50 255.648 272.646 237.450 1.00 0.00 C +ATOM 51 CA ILE A 51 255.235 275.754 239.615 1.00 0.00 C +TER 52 ILE A 51 +END diff --git a/Plants/Q8RW12/Q8RW12.dcd b/Plants/Q8RW12/Q8RW12.dcd new file mode 100644 index 0000000000000000000000000000000000000000..f75a49001933372855112d9e18aee0d1feb91f7a --- /dev/null +++ b/Plants/Q8RW12/Q8RW12.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:00786799de9e5761ebcbe0288305e9ccf8c8dc219492b01d56e9caafc8d672c8 +size 12320276 diff --git a/Plants/Q8RW12/top.pdb b/Plants/Q8RW12/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..53062eb5c30421ada310e8f7cd89d013899937c3 --- /dev/null +++ b/Plants/Q8RW12/top.pdb @@ -0,0 +1,100 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 255.476 251.989 238.418 1.00 0.00 C +ATOM 2 CA ALA A 2 253.956 253.413 241.608 1.00 0.00 C +ATOM 3 CA GLY A 3 252.854 255.840 244.330 1.00 0.00 C +ATOM 4 CA ILE A 4 253.264 259.544 245.124 1.00 0.00 C +ATOM 5 CA MET A 5 255.308 262.576 246.196 1.00 0.00 C +ATOM 6 CA HIS A 6 255.704 265.647 243.976 1.00 0.00 C +ATOM 7 CA LYS A 7 257.416 266.379 240.652 1.00 0.00 C +ATOM 8 CA ILE A 8 254.912 266.105 237.795 1.00 0.00 C +ATOM 9 CA GLU A 9 254.664 264.199 234.505 1.00 0.00 C +ATOM 10 CA GLU A 10 256.376 265.360 231.306 1.00 0.00 C +ATOM 11 CA THR A 11 259.819 265.274 229.676 1.00 0.00 C +ATOM 12 CA LEU A 12 263.261 263.654 229.464 1.00 0.00 C +ATOM 13 CA HIS A 13 265.763 262.663 232.162 1.00 0.00 C +ATOM 14 CA ILE A 14 268.495 260.805 234.058 1.00 0.00 C +ATOM 15 CA GLY A 15 268.189 261.736 237.740 1.00 0.00 C +ATOM 16 CA GLY A 16 270.839 263.310 239.980 1.00 0.00 C +ATOM 17 CA HIS A 17 272.727 261.081 242.426 1.00 0.00 C +ATOM 18 CA LYS A 18 274.232 261.972 245.811 1.00 0.00 C +ATOM 19 CA GLU A 19 275.387 264.530 248.388 1.00 0.00 C +ATOM 20 CA GLU A 20 277.404 265.809 251.356 1.00 0.00 C +ATOM 21 CA HIS A 21 279.111 263.428 253.792 1.00 0.00 C +ATOM 22 CA LYS A 22 279.331 259.710 252.988 1.00 0.00 C +ATOM 23 CA GLY A 23 276.762 257.603 254.853 1.00 0.00 C +ATOM 24 CA GLU A 24 274.867 257.841 258.149 1.00 0.00 C +ATOM 25 CA SER A 25 272.230 259.420 260.400 1.00 0.00 C +ATOM 26 CA HIS A 26 269.660 261.386 262.411 1.00 0.00 C +ATOM 27 CA ASP A 27 269.671 264.948 263.765 1.00 0.00 C +ATOM 28 CA GLN A 28 266.373 265.576 265.565 1.00 0.00 C +ATOM 29 CA HIS A 29 265.513 268.389 267.986 1.00 0.00 C +ATOM 30 CA LYS A 30 268.287 268.286 270.597 1.00 0.00 C +ATOM 31 CA HIS A 31 269.317 267.946 274.249 1.00 0.00 C +ATOM 32 CA ASP A 32 268.957 268.063 278.040 1.00 0.00 C +ATOM 33 CA GLN A 33 265.772 268.256 280.122 1.00 0.00 C +ATOM 34 CA HIS A 34 264.064 266.861 283.229 1.00 0.00 C +ATOM 35 CA ALA A 35 261.948 263.980 281.909 1.00 0.00 C +ATOM 36 CA HIS A 36 261.222 262.743 278.380 1.00 0.00 C +ATOM 37 CA GLY A 37 257.623 262.712 277.130 1.00 0.00 C +ATOM 38 CA ASP A 38 255.756 260.540 274.617 1.00 0.00 C +ATOM 39 CA HIS A 39 257.871 259.970 271.500 1.00 0.00 C +ATOM 40 CA PRO A 40 257.902 258.306 268.072 1.00 0.00 C +ATOM 41 CA LYS A 41 257.930 258.441 264.265 1.00 0.00 C +ATOM 42 CA PRO A 42 255.822 260.990 262.374 1.00 0.00 C +ATOM 43 CA GLU A 43 252.880 262.214 264.463 1.00 0.00 C +ATOM 44 CA GLY A 44 250.086 260.219 266.113 1.00 0.00 C +ATOM 45 CA GLU A 45 246.460 259.528 267.060 1.00 0.00 C +ATOM 46 CA HIS A 46 243.983 261.166 269.446 1.00 0.00 C +ATOM 47 CA LYS A 47 244.377 264.755 270.664 1.00 0.00 C +ATOM 48 CA GLU A 48 243.924 268.340 269.457 1.00 0.00 C +ATOM 49 CA GLY A 49 241.333 269.284 266.828 1.00 0.00 C +ATOM 50 CA PHE A 50 239.733 268.181 263.550 1.00 0.00 C +ATOM 51 CA MET A 51 238.063 264.816 262.916 1.00 0.00 C +ATOM 52 CA ASP A 52 234.849 264.642 264.955 1.00 0.00 C +ATOM 53 CA LYS A 53 231.406 263.526 263.766 1.00 0.00 C +ATOM 54 CA ILE A 54 229.524 261.331 261.285 1.00 0.00 C +ATOM 55 CA LYS A 55 231.163 260.703 257.904 1.00 0.00 C +ATOM 56 CA ASP A 56 232.883 258.259 255.541 1.00 0.00 C +ATOM 57 CA LYS A 57 230.870 255.853 253.379 1.00 0.00 C +ATOM 58 CA ILE A 58 232.940 254.506 250.478 1.00 0.00 C +ATOM 59 CA HIS A 59 236.509 255.812 250.744 1.00 0.00 C +ATOM 60 CA GLY A 60 237.881 258.113 248.035 1.00 0.00 C +ATOM 61 CA ASP A 61 239.345 258.263 244.521 1.00 0.00 C +ATOM 62 CA GLU A 62 238.270 256.827 241.160 1.00 0.00 C +ATOM 63 CA LYS A 63 237.633 257.710 237.509 1.00 0.00 C +ATOM 64 CA GLY A 64 239.364 255.991 234.582 1.00 0.00 C +ATOM 65 CA HIS A 65 238.283 252.485 233.557 1.00 0.00 C +ATOM 66 CA GLU A 66 241.190 250.101 234.175 1.00 0.00 C +ATOM 67 CA HIS A 67 242.840 247.525 236.447 1.00 0.00 C +ATOM 68 CA GLY A 68 241.012 246.427 239.604 1.00 0.00 C +ATOM 69 CA HIS A 69 241.985 246.402 243.287 1.00 0.00 C +ATOM 70 CA GLY A 70 243.616 246.192 246.724 1.00 0.00 C +ATOM 71 CA GLU A 71 242.826 242.689 247.998 1.00 0.00 C +ATOM 72 CA SER A 72 239.805 241.124 246.282 1.00 0.00 C +ATOM 73 CA GLY A 73 237.406 238.681 247.955 1.00 0.00 C +ATOM 74 CA GLU A 74 236.268 235.232 246.804 1.00 0.00 C +ATOM 75 CA LYS A 75 236.546 232.387 244.286 1.00 0.00 C +ATOM 76 CA LYS A 76 237.592 232.500 240.624 1.00 0.00 C +ATOM 77 CA LYS A 77 240.575 230.139 240.426 1.00 0.00 C +ATOM 78 CA LYS A 78 241.583 226.510 240.999 1.00 0.00 C +ATOM 79 CA LYS A 79 239.574 223.961 239.004 1.00 0.00 C +ATOM 80 CA LYS A 80 240.162 224.139 235.244 1.00 0.00 C +ATOM 81 CA GLU A 81 240.429 223.036 231.607 1.00 0.00 C +ATOM 82 CA LYS A 82 243.753 221.921 230.116 1.00 0.00 C +ATOM 83 CA LYS A 83 246.468 222.327 232.758 1.00 0.00 C +ATOM 84 CA LYS A 84 245.915 219.568 235.327 1.00 0.00 C +ATOM 85 CA HIS A 85 244.550 216.013 235.429 1.00 0.00 C +ATOM 86 CA GLU A 86 241.307 214.399 234.245 1.00 0.00 C +ATOM 87 CA HIS A 87 238.267 216.644 233.764 1.00 0.00 C +ATOM 88 CA GLY A 88 235.722 217.972 236.270 1.00 0.00 C +ATOM 89 CA HIS A 89 235.972 216.814 239.891 1.00 0.00 C +ATOM 90 CA SER A 90 235.169 213.552 241.688 1.00 0.00 C +ATOM 91 CA SER A 91 236.449 210.210 240.381 1.00 0.00 C +ATOM 92 CA SER A 92 236.710 206.532 239.422 1.00 0.00 C +ATOM 93 CA SER A 93 234.769 204.273 237.045 1.00 0.00 C +ATOM 94 CA ASP A 94 232.382 202.596 234.594 1.00 0.00 C +ATOM 95 CA SER A 95 228.718 203.591 234.909 1.00 0.00 C +ATOM 96 CA ASP A 96 226.642 206.745 235.416 1.00 0.00 C +TER 97 ASP A 96 +END diff --git a/Plants/Q8RX52/Q8RX52.dcd b/Plants/Q8RX52/Q8RX52.dcd new file mode 100644 index 0000000000000000000000000000000000000000..193e18841f73e2436d4a61bf30763ca823221a57 --- /dev/null +++ b/Plants/Q8RX52/Q8RX52.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:519b0fa746bd6300db57d58bb25bcf2a3dcfc44be69c6668e8626da095f0bc7e +size 7880276 diff --git a/Plants/Q8RX52/top.pdb b/Plants/Q8RX52/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..7c3a83778c54a03800ca0baa1b18b2e0f0242564 --- /dev/null +++ b/Plants/Q8RX52/top.pdb @@ -0,0 +1,63 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA ASP A 1 205.012 275.388 265.253 1.00 0.00 C +ATOM 2 CA LEU A 2 203.425 272.282 266.785 1.00 0.00 C +ATOM 3 CA GLU A 3 205.863 269.374 267.125 1.00 0.00 C +ATOM 4 CA ARG A 4 203.947 266.673 269.009 1.00 0.00 C +ATOM 5 CA GLU A 5 205.210 264.117 271.536 1.00 0.00 C +ATOM 6 CA GLN A 6 207.594 261.145 271.576 1.00 0.00 C +ATOM 7 CA THR A 7 211.217 261.890 270.663 1.00 0.00 C +ATOM 8 CA LEU A 8 213.472 262.389 267.633 1.00 0.00 C +ATOM 9 CA GLU A 9 214.595 265.239 265.368 1.00 0.00 C +ATOM 10 CA SER A 10 216.769 267.954 263.812 1.00 0.00 C +ATOM 11 CA GLU A 11 220.347 266.655 263.972 1.00 0.00 C +ATOM 12 CA THR A 12 223.600 264.822 264.731 1.00 0.00 C +ATOM 13 CA ILE A 13 224.517 262.398 261.938 1.00 0.00 C +ATOM 14 CA GLU A 14 226.041 261.784 258.501 1.00 0.00 C +ATOM 15 CA THR A 15 227.515 259.045 256.301 1.00 0.00 C +ATOM 16 CA THR A 16 230.901 259.449 254.601 1.00 0.00 C +ATOM 17 CA ALA A 17 233.165 256.705 253.238 1.00 0.00 C +ATOM 18 CA GLN A 18 232.978 253.385 251.378 1.00 0.00 C +ATOM 19 CA ALA A 19 235.023 253.449 248.163 1.00 0.00 C +ATOM 20 CA VAL A 20 237.560 254.332 245.461 1.00 0.00 C +ATOM 21 CA GLY A 21 240.743 255.652 247.086 1.00 0.00 C +ATOM 22 CA THR A 22 243.897 256.860 245.322 1.00 0.00 C +ATOM 23 CA GLY A 23 247.128 258.389 246.643 1.00 0.00 C +ATOM 24 CA ASN A 24 250.511 259.214 248.188 1.00 0.00 C +ATOM 25 CA GLY A 25 252.187 256.902 250.710 1.00 0.00 C +ATOM 26 CA SER A 26 251.817 253.291 249.550 1.00 0.00 C +ATOM 27 CA LEU A 27 253.798 252.141 246.505 1.00 0.00 C +ATOM 28 CA ASN A 28 257.432 252.721 247.489 1.00 0.00 C +ATOM 29 CA GLY A 29 259.362 249.592 246.491 1.00 0.00 C +ATOM 30 CA ASN A 30 262.301 248.537 244.307 1.00 0.00 C +ATOM 31 CA ALA A 31 265.575 248.691 242.365 1.00 0.00 C +ATOM 32 CA ALA A 32 268.786 249.117 244.372 1.00 0.00 C +ATOM 33 CA THR A 33 272.235 247.726 245.202 1.00 0.00 C +ATOM 34 CA PRO A 34 275.242 247.533 247.533 1.00 0.00 C +ATOM 35 CA THR A 35 277.414 244.870 249.177 1.00 0.00 C +ATOM 36 CA ASN A 36 278.723 242.186 246.811 1.00 0.00 C +ATOM 37 CA GLY A 37 279.484 243.735 243.414 1.00 0.00 C +ATOM 38 CA ALA A 38 280.452 243.890 239.732 1.00 0.00 C +ATOM 39 CA VAL A 39 279.508 247.030 237.793 1.00 0.00 C +ATOM 40 CA ILE A 40 276.826 249.216 236.198 1.00 0.00 C +ATOM 41 CA LYS A 41 273.201 248.295 235.468 1.00 0.00 C +ATOM 42 CA PRO A 42 271.565 248.104 238.903 1.00 0.00 C +ATOM 43 CA SER A 43 269.733 244.864 239.717 1.00 0.00 C +ATOM 44 CA GLN A 44 268.185 241.542 238.672 1.00 0.00 C +ATOM 45 CA GLU A 45 268.262 237.734 238.594 1.00 0.00 C +ATOM 46 CA PRO A 46 267.665 234.031 237.923 1.00 0.00 C +ATOM 47 CA GLU A 47 264.923 231.477 238.610 1.00 0.00 C +ATOM 48 CA SER A 48 266.375 228.090 237.643 1.00 0.00 C +ATOM 49 CA THR A 49 266.754 224.946 239.761 1.00 0.00 C +ATOM 50 CA PRO A 50 267.569 225.687 243.408 1.00 0.00 C +ATOM 51 CA SER A 51 264.645 226.178 245.800 1.00 0.00 C +ATOM 52 CA GLU A 52 264.379 229.829 246.856 1.00 0.00 C +ATOM 53 CA LYS A 53 265.627 232.952 245.066 1.00 0.00 C +ATOM 54 CA SER A 54 264.416 236.563 245.168 1.00 0.00 C +ATOM 55 CA GLY A 55 266.493 239.066 247.151 1.00 0.00 C +ATOM 56 CA GLN A 56 268.955 241.705 248.375 1.00 0.00 C +ATOM 57 CA GLN A 57 272.068 239.895 249.619 1.00 0.00 C +ATOM 58 CA SER A 58 273.476 237.038 247.529 1.00 0.00 C +ATOM 59 CA GLN A 59 273.536 236.238 243.804 1.00 0.00 C +TER 60 GLN A 59 +END diff --git a/Plants/Q8RXV9/Q8RXV9.dcd b/Plants/Q8RXV9/Q8RXV9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..ad3599f2ec0b805c762ce41703321ffd91f1ffbc --- /dev/null +++ b/Plants/Q8RXV9/Q8RXV9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:8612b0be33cc37bbea09b49df110179f3da5e69fc3e928aef4b9f970fcf25852 +size 22160276 diff --git a/Plants/Q8RXV9/top.pdb b/Plants/Q8RXV9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..5ce1e854ae2cf08f7a4c5457ae34d21ae6d70383 --- /dev/null +++ b/Plants/Q8RXV9/top.pdb @@ -0,0 +1,182 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 325.624 297.218 300.037 1.00 0.00 C +ATOM 2 CA GLN A 2 324.970 294.921 303.005 1.00 0.00 C +ATOM 3 CA GLY A 3 322.926 294.128 306.121 1.00 0.00 C +ATOM 4 CA GLY A 4 320.055 295.272 308.349 1.00 0.00 C +ATOM 5 CA GLY A 5 316.275 294.790 308.365 1.00 0.00 C +ATOM 6 CA GLY A 6 315.225 293.785 304.844 1.00 0.00 C +ATOM 7 CA SER A 7 314.455 295.609 301.588 1.00 0.00 C +ATOM 8 CA TYR A 8 312.098 296.509 298.733 1.00 0.00 C +ATOM 9 CA GLY A 9 308.970 294.640 297.621 1.00 0.00 C +ATOM 10 CA PRO A 10 305.935 296.266 295.988 1.00 0.00 C +ATOM 11 CA GLN A 11 306.579 299.333 293.821 1.00 0.00 C +ATOM 12 CA GLN A 12 307.769 300.990 290.603 1.00 0.00 C +ATOM 13 CA GLY A 13 305.524 303.526 288.858 1.00 0.00 C +ATOM 14 CA TYR A 14 302.493 304.246 286.664 1.00 0.00 C +ATOM 15 CA ALA A 15 298.802 303.484 286.106 1.00 0.00 C +ATOM 16 CA THR A 16 296.183 306.239 285.848 1.00 0.00 C +ATOM 17 CA PRO A 17 294.088 308.211 288.346 1.00 0.00 C +ATOM 18 CA GLY A 18 292.369 309.155 291.613 1.00 0.00 C +ATOM 19 CA GLN A 19 288.984 310.899 291.728 1.00 0.00 C +ATOM 20 CA GLY A 20 285.707 310.465 293.622 1.00 0.00 C +ATOM 21 CA GLN A 21 282.272 311.845 292.719 1.00 0.00 C +ATOM 22 CA GLY A 22 279.981 314.653 293.895 1.00 0.00 C +ATOM 23 CA THR A 23 277.458 313.232 296.371 1.00 0.00 C +ATOM 24 CA GLN A 24 274.594 311.096 297.693 1.00 0.00 C +ATOM 25 CA ALA A 25 273.261 307.899 299.282 1.00 0.00 C +ATOM 26 CA PRO A 26 269.581 307.647 298.329 1.00 0.00 C +ATOM 27 CA PRO A 27 266.942 309.499 296.298 1.00 0.00 C +ATOM 28 CA PRO A 28 265.750 308.748 292.759 1.00 0.00 C +ATOM 29 CA PHE A 29 262.517 308.197 290.819 1.00 0.00 C +ATOM 30 CA GLN A 30 259.310 307.669 292.807 1.00 0.00 C +ATOM 31 CA GLY A 31 256.969 310.459 293.926 1.00 0.00 C +ATOM 32 CA GLY A 32 258.148 313.638 295.665 1.00 0.00 C +ATOM 33 CA TYR A 33 257.825 314.499 299.362 1.00 0.00 C +ATOM 34 CA ASN A 34 254.135 314.066 300.206 1.00 0.00 C +ATOM 35 CA GLN A 35 250.412 313.344 300.570 1.00 0.00 C +ATOM 36 CA GLY A 36 249.483 309.951 299.107 1.00 0.00 C +ATOM 37 CA PRO A 37 250.022 310.251 295.347 1.00 0.00 C +ATOM 38 CA ARG A 38 248.903 309.807 291.733 1.00 0.00 C +ATOM 39 CA SER A 39 245.154 309.482 291.138 1.00 0.00 C +ATOM 40 CA PRO A 40 244.345 307.162 288.226 1.00 0.00 C +ATOM 41 CA PRO A 41 241.052 306.441 286.450 1.00 0.00 C +ATOM 42 CA PRO A 42 238.495 303.899 285.218 1.00 0.00 C +ATOM 43 CA PRO A 43 239.564 300.313 284.503 1.00 0.00 C +ATOM 44 CA TYR A 44 240.071 297.362 282.147 1.00 0.00 C +ATOM 45 CA GLN A 45 239.849 297.702 278.359 1.00 0.00 C +ATOM 46 CA ALA A 46 242.263 298.130 275.443 1.00 0.00 C +ATOM 47 CA GLY A 47 242.608 299.663 271.972 1.00 0.00 C +ATOM 48 CA TYR A 48 241.369 301.751 269.035 1.00 0.00 C +ATOM 49 CA ASN A 49 239.342 304.975 268.927 1.00 0.00 C +ATOM 50 CA GLN A 50 240.043 308.677 268.365 1.00 0.00 C +ATOM 51 CA GLY A 51 237.929 311.744 269.164 1.00 0.00 C +ATOM 52 CA GLN A 52 240.014 314.861 269.835 1.00 0.00 C +ATOM 53 CA GLY A 53 238.099 318.138 270.168 1.00 0.00 C +ATOM 54 CA SER A 54 235.455 319.867 268.039 1.00 0.00 C +ATOM 55 CA PRO A 55 232.149 318.233 268.997 1.00 0.00 C +ATOM 56 CA VAL A 56 229.331 318.597 266.460 1.00 0.00 C +ATOM 57 CA PRO A 57 226.765 316.181 265.012 1.00 0.00 C +ATOM 58 CA PRO A 58 225.576 313.074 266.868 1.00 0.00 C +ATOM 59 CA TYR A 59 224.869 309.867 264.935 1.00 0.00 C +ATOM 60 CA GLN A 60 225.577 306.640 266.832 1.00 0.00 C +ATOM 61 CA ALA A 61 227.328 303.344 266.065 1.00 0.00 C +ATOM 62 CA GLY A 62 224.550 301.028 264.867 1.00 0.00 C +ATOM 63 CA TYR A 63 222.174 302.337 262.192 1.00 0.00 C +ATOM 64 CA ASN A 64 224.390 304.395 259.876 1.00 0.00 C +ATOM 65 CA GLN A 65 226.912 307.040 258.797 1.00 0.00 C +ATOM 66 CA VAL A 66 229.833 307.594 256.414 1.00 0.00 C +ATOM 67 CA GLN A 67 233.360 308.634 257.412 1.00 0.00 C +ATOM 68 CA GLY A 68 236.737 308.917 255.671 1.00 0.00 C +ATOM 69 CA SER A 69 238.704 310.574 252.860 1.00 0.00 C +ATOM 70 CA PRO A 70 237.990 311.185 249.168 1.00 0.00 C +ATOM 71 CA VAL A 71 238.353 308.005 247.101 1.00 0.00 C +ATOM 72 CA PRO A 72 241.072 306.402 244.967 1.00 0.00 C +ATOM 73 CA PRO A 73 243.450 303.608 243.940 1.00 0.00 C +ATOM 74 CA TYR A 74 246.155 304.070 241.297 1.00 0.00 C +ATOM 75 CA GLN A 75 248.107 307.072 239.996 1.00 0.00 C +ATOM 76 CA GLY A 76 251.910 306.853 239.948 1.00 0.00 C +ATOM 77 CA THR A 77 254.036 303.910 238.793 1.00 0.00 C +ATOM 78 CA GLN A 78 251.762 300.879 239.186 1.00 0.00 C +ATOM 79 CA SER A 79 251.154 297.824 241.381 1.00 0.00 C +ATOM 80 CA SER A 80 248.917 294.770 240.950 1.00 0.00 C +ATOM 81 CA TYR A 81 246.764 291.645 240.615 1.00 0.00 C +ATOM 82 CA GLY A 82 245.941 289.550 237.540 1.00 0.00 C +ATOM 83 CA GLN A 83 246.626 290.193 233.848 1.00 0.00 C +ATOM 84 CA GLY A 84 246.347 289.258 230.165 1.00 0.00 C +ATOM 85 CA GLY A 85 248.894 286.849 228.674 1.00 0.00 C +ATOM 86 CA SER A 86 249.903 283.249 229.410 1.00 0.00 C +ATOM 87 CA GLY A 87 247.686 280.414 228.159 1.00 0.00 C +ATOM 88 CA ASN A 88 248.200 276.656 228.516 1.00 0.00 C +ATOM 89 CA TYR A 89 250.596 274.358 226.647 1.00 0.00 C +ATOM 90 CA SER A 90 252.074 273.165 223.344 1.00 0.00 C +ATOM 91 CA GLN A 91 249.794 271.842 220.593 1.00 0.00 C +ATOM 92 CA GLY A 92 250.865 270.840 217.076 1.00 0.00 C +ATOM 93 CA PRO A 93 253.489 268.529 215.564 1.00 0.00 C +ATOM 94 CA GLN A 94 254.257 265.154 213.971 1.00 0.00 C +ATOM 95 CA GLY A 95 255.608 264.059 210.581 1.00 0.00 C +ATOM 96 CA GLY A 96 253.769 260.915 209.465 1.00 0.00 C +ATOM 97 CA TYR A 97 252.034 257.524 209.537 1.00 0.00 C +ATOM 98 CA ASN A 98 250.820 255.627 206.463 1.00 0.00 C +ATOM 99 CA GLN A 99 247.018 255.573 206.697 1.00 0.00 C +ATOM 100 CA GLY A 100 245.704 252.248 208.014 1.00 0.00 C +ATOM 101 CA GLY A 101 245.716 248.597 209.103 1.00 0.00 C +ATOM 102 CA PRO A 102 246.929 246.519 212.058 1.00 0.00 C +ATOM 103 CA ARG A 103 247.456 243.769 214.642 1.00 0.00 C +ATOM 104 CA ASN A 104 246.081 241.833 217.620 1.00 0.00 C +ATOM 105 CA TYR A 105 244.486 239.573 220.241 1.00 0.00 C +ATOM 106 CA ASN A 106 241.709 237.276 219.006 1.00 0.00 C +ATOM 107 CA PRO A 107 241.885 234.029 220.992 1.00 0.00 C +ATOM 108 CA GLN A 108 244.776 231.773 222.027 1.00 0.00 C +ATOM 109 CA GLY A 109 245.999 228.923 224.241 1.00 0.00 C +ATOM 110 CA ALA A 110 246.260 225.137 223.901 1.00 0.00 C +ATOM 111 CA GLY A 111 243.470 223.150 222.234 1.00 0.00 C +ATOM 112 CA ASN A 112 242.682 220.100 220.090 1.00 0.00 C +ATOM 113 CA PHE A 113 239.363 220.232 218.224 1.00 0.00 C +ATOM 114 CA GLY A 114 236.462 219.067 216.046 1.00 0.00 C +ATOM 115 CA PRO A 115 234.669 216.149 217.715 1.00 0.00 C +ATOM 116 CA ALA A 116 232.638 217.563 220.612 1.00 0.00 C +ATOM 117 CA SER A 117 231.018 218.416 223.953 1.00 0.00 C +ATOM 118 CA GLY A 118 227.347 219.094 223.192 1.00 0.00 C +ATOM 119 CA ALA A 119 225.812 219.939 226.575 1.00 0.00 C +ATOM 120 CA GLY A 120 225.170 219.650 230.319 1.00 0.00 C +ATOM 121 CA ASN A 121 227.302 216.841 231.762 1.00 0.00 C +ATOM 122 CA LEU A 122 227.250 213.041 232.039 1.00 0.00 C +ATOM 123 CA GLY A 123 225.380 211.684 229.010 1.00 0.00 C +ATOM 124 CA PRO A 124 227.790 209.589 226.931 1.00 0.00 C +ATOM 125 CA ALA A 125 229.612 206.254 227.191 1.00 0.00 C +ATOM 126 CA PRO A 126 230.076 202.473 227.271 1.00 0.00 C +ATOM 127 CA GLY A 127 228.674 199.087 226.226 1.00 0.00 C +ATOM 128 CA ALA A 128 231.315 196.362 225.892 1.00 0.00 C +ATOM 129 CA GLY A 129 233.329 196.022 229.108 1.00 0.00 C +ATOM 130 CA ASN A 130 236.512 194.153 230.054 1.00 0.00 C +ATOM 131 CA PRO A 131 238.635 191.636 228.136 1.00 0.00 C +ATOM 132 CA GLY A 132 237.564 188.013 227.643 1.00 0.00 C +ATOM 133 CA TYR A 133 235.232 185.931 229.820 1.00 0.00 C +ATOM 134 CA GLY A 134 231.914 185.168 231.531 1.00 0.00 C +ATOM 135 CA GLN A 135 231.122 185.641 235.228 1.00 0.00 C +ATOM 136 CA GLY A 136 231.422 182.736 237.674 1.00 0.00 C +ATOM 137 CA TYR A 137 231.450 180.111 240.436 1.00 0.00 C +ATOM 138 CA SER A 138 229.375 180.893 243.534 1.00 0.00 C +ATOM 139 CA GLY A 139 226.625 183.054 245.045 1.00 0.00 C +ATOM 140 CA PRO A 140 223.928 183.825 242.467 1.00 0.00 C +ATOM 141 CA GLY A 141 221.041 181.588 241.383 1.00 0.00 C +ATOM 142 CA GLN A 142 217.723 182.686 239.864 1.00 0.00 C +ATOM 143 CA GLU A 143 217.448 182.664 236.064 1.00 0.00 C +ATOM 144 CA GLN A 144 219.892 184.567 233.845 1.00 0.00 C +ATOM 145 CA ASN A 145 221.868 182.038 231.791 1.00 0.00 C +ATOM 146 CA GLN A 146 223.170 178.515 231.151 1.00 0.00 C +ATOM 147 CA THR A 147 226.442 176.837 230.153 1.00 0.00 C +ATOM 148 CA PHE A 148 228.754 175.974 227.251 1.00 0.00 C +ATOM 149 CA PRO A 149 228.410 177.013 223.602 1.00 0.00 C +ATOM 150 CA GLN A 150 230.438 176.107 220.507 1.00 0.00 C +ATOM 151 CA ALA A 151 233.915 174.655 221.074 1.00 0.00 C +ATOM 152 CA ASP A 152 236.737 176.875 219.800 1.00 0.00 C +ATOM 153 CA GLN A 153 240.375 177.934 220.207 1.00 0.00 C +ATOM 154 CA ARG A 154 242.787 176.247 217.788 1.00 0.00 C +ATOM 155 CA ASN A 155 245.253 173.352 218.016 1.00 0.00 C +ATOM 156 CA ARG A 156 246.651 172.299 214.632 1.00 0.00 C +ATOM 157 CA ASP A 157 248.893 169.762 212.884 1.00 0.00 C +ATOM 158 CA TRP A 158 250.081 167.136 215.376 1.00 0.00 C +ATOM 159 CA ASN A 159 249.895 163.342 215.088 1.00 0.00 C +ATOM 160 CA ASN A 160 251.315 161.163 217.873 1.00 0.00 C +ATOM 161 CA ASN A 161 252.105 157.969 219.794 1.00 0.00 C +ATOM 162 CA ASN A 162 249.463 157.603 222.515 1.00 0.00 C +ATOM 163 CA PRO A 163 248.703 154.538 224.647 1.00 0.00 C +ATOM 164 CA ALA A 164 247.080 155.631 227.915 1.00 0.00 C +ATOM 165 CA GLY A 165 249.282 154.884 230.933 1.00 0.00 C +ATOM 166 CA GLN A 166 252.322 152.603 231.202 1.00 0.00 C +ATOM 167 CA PRO A 167 254.280 149.334 231.213 1.00 0.00 C +ATOM 168 CA GLY A 168 255.906 147.706 234.250 1.00 0.00 C +ATOM 169 CA SER A 169 257.439 146.868 237.636 1.00 0.00 C +ATOM 170 CA ASP A 170 256.062 144.121 239.889 1.00 0.00 C +ATOM 171 CA GLN A 171 254.335 141.857 242.419 1.00 0.00 C +ATOM 172 CA PHE A 172 253.477 138.329 241.265 1.00 0.00 C +ATOM 173 CA PRO A 173 255.919 135.763 242.671 1.00 0.00 C +ATOM 174 CA GLN A 174 256.044 132.108 243.738 1.00 0.00 C +ATOM 175 CA GLY A 175 254.184 128.785 243.863 1.00 0.00 C +ATOM 176 CA ARG A 176 252.662 126.843 246.766 1.00 0.00 C +ATOM 177 CA ARG A 177 250.370 126.269 249.755 1.00 0.00 C +ATOM 178 CA TYR A 178 249.041 129.689 250.784 1.00 0.00 C +TER 179 TYR A 178 +END diff --git a/Plants/Q8RYG3/Q8RYG3.dcd b/Plants/Q8RYG3/Q8RYG3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..203101ec096938b33cc7417c3b56585116c7c871 --- /dev/null +++ b/Plants/Q8RYG3/Q8RYG3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:89b12fe99a0409cbcbc0f2c83af1852b08a2fd405a5dd1a1ac1a27132a51dc3e +size 9200276 diff --git a/Plants/Q8RYG3/top.pdb b/Plants/Q8RYG3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..312fdafaddbaae07f1f65cd930706c155091939b --- /dev/null +++ b/Plants/Q8RYG3/top.pdb @@ -0,0 +1,74 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 249.611 251.880 278.926 1.00 0.00 C +ATOM 2 CA ASP A 2 246.611 249.541 279.143 1.00 0.00 C +ATOM 3 CA ALA A 3 244.786 248.388 276.003 1.00 0.00 C +ATOM 4 CA ASP A 4 242.734 247.424 272.941 1.00 0.00 C +ATOM 5 CA LEU A 5 239.175 247.416 271.581 1.00 0.00 C +ATOM 6 CA SER A 6 235.517 248.216 270.876 1.00 0.00 C +ATOM 7 CA PRO A 7 232.977 245.407 271.298 1.00 0.00 C +ATOM 8 CA ILE A 8 230.779 243.787 273.955 1.00 0.00 C +ATOM 9 CA ASN A 9 230.577 244.702 277.648 1.00 0.00 C +ATOM 10 CA ALA A 10 229.703 245.994 281.123 1.00 0.00 C +ATOM 11 CA ALA A 11 228.696 249.067 283.138 1.00 0.00 C +ATOM 12 CA ASP A 12 228.883 252.570 281.651 1.00 0.00 C +ATOM 13 CA ASP A 13 231.722 254.467 279.962 1.00 0.00 C +ATOM 14 CA GLY A 14 235.218 253.997 281.402 1.00 0.00 C +ATOM 15 CA ARG A 15 238.127 256.077 280.088 1.00 0.00 C +ATOM 16 CA ARG A 16 241.642 255.773 278.649 1.00 0.00 C +ATOM 17 CA ARG A 17 243.173 256.735 275.296 1.00 0.00 C +ATOM 18 CA ARG A 18 242.975 254.202 272.457 1.00 0.00 C +ATOM 19 CA PRO A 19 244.941 255.825 269.625 1.00 0.00 C +ATOM 20 CA SER A 20 246.207 252.932 267.493 1.00 0.00 C +ATOM 21 CA ASN A 21 249.837 251.899 268.019 1.00 0.00 C +ATOM 22 CA ARG A 22 253.314 250.953 269.256 1.00 0.00 C +ATOM 23 CA GLN A 23 254.649 252.286 272.566 1.00 0.00 C +ATOM 24 CA PRO A 24 257.207 255.031 271.902 1.00 0.00 C +ATOM 25 CA ILE A 25 260.720 253.584 271.612 1.00 0.00 C +ATOM 26 CA LYS A 26 262.853 251.410 269.324 1.00 0.00 C +ATOM 27 CA HIS A 27 262.514 250.214 265.722 1.00 0.00 C +ATOM 28 CA ALA A 28 260.900 251.698 262.606 1.00 0.00 C +ATOM 29 CA GLY A 29 263.659 253.592 260.786 1.00 0.00 C +ATOM 30 CA THR A 30 264.553 251.789 257.551 1.00 0.00 C +ATOM 31 CA LYS A 31 264.342 248.886 255.092 1.00 0.00 C +ATOM 32 CA THR A 32 267.364 246.587 254.781 1.00 0.00 C +ATOM 33 CA THR A 33 268.281 244.543 257.863 1.00 0.00 C +ATOM 34 CA PRO A 34 271.114 242.216 258.898 1.00 0.00 C +ATOM 35 CA SER A 35 272.953 241.024 255.781 1.00 0.00 C +ATOM 36 CA PRO A 36 270.691 239.430 253.162 1.00 0.00 C +ATOM 37 CA PRO A 37 272.927 238.023 250.417 1.00 0.00 C +ATOM 38 CA SER A 38 271.994 237.004 246.866 1.00 0.00 C +ATOM 39 CA ASP A 39 271.073 239.435 244.081 1.00 0.00 C +ATOM 40 CA ARG A 40 267.337 240.100 243.739 1.00 0.00 C +ATOM 41 CA PRO A 41 265.620 242.493 241.322 1.00 0.00 C +ATOM 42 CA THR A 42 262.876 244.517 239.622 1.00 0.00 C +ATOM 43 CA ASP A 43 260.769 247.603 238.878 1.00 0.00 C +ATOM 44 CA GLY A 44 259.075 250.882 237.933 1.00 0.00 C +ATOM 45 CA HIS A 45 260.423 254.343 237.084 1.00 0.00 C +ATOM 46 CA ASP A 46 264.060 254.532 238.201 1.00 0.00 C +ATOM 47 CA ARG A 47 266.240 255.633 235.276 1.00 0.00 C +ATOM 48 CA SER A 48 265.901 254.347 231.705 1.00 0.00 C +ATOM 49 CA PRO A 49 264.233 251.833 229.379 1.00 0.00 C +ATOM 50 CA PRO A 50 261.112 249.660 229.612 1.00 0.00 C +ATOM 51 CA PHE A 51 258.516 250.115 226.860 1.00 0.00 C +ATOM 52 CA ALA A 52 258.503 248.793 223.287 1.00 0.00 C +ATOM 53 CA GLY A 53 260.605 250.859 220.873 1.00 0.00 C +ATOM 54 CA LEU A 54 258.187 253.062 218.919 1.00 0.00 C +ATOM 55 CA ILE A 55 254.507 253.764 218.228 1.00 0.00 C +ATOM 56 CA ASN A 56 251.170 252.020 218.811 1.00 0.00 C +ATOM 57 CA TYR A 57 247.776 250.514 219.663 1.00 0.00 C +ATOM 58 CA SER A 58 244.527 251.971 221.018 1.00 0.00 C +ATOM 59 CA HIS A 59 243.161 255.496 221.489 1.00 0.00 C +ATOM 60 CA CYS A 60 241.222 258.009 219.381 1.00 0.00 C +ATOM 61 CA THR A 61 237.536 257.577 218.517 1.00 0.00 C +ATOM 62 CA SER A 62 234.509 256.287 216.597 1.00 0.00 C +ATOM 63 CA LYS A 63 231.238 256.200 218.550 1.00 0.00 C +ATOM 64 CA ASP A 64 228.612 253.558 219.348 1.00 0.00 C +ATOM 65 CA GLY A 65 225.506 251.515 220.183 1.00 0.00 C +ATOM 66 CA SER A 66 224.484 248.136 221.617 1.00 0.00 C +ATOM 67 CA THR A 67 226.095 245.468 223.809 1.00 0.00 C +ATOM 68 CA VAL A 68 228.143 245.865 226.997 1.00 0.00 C +ATOM 69 CA ALA A 69 230.174 249.081 226.778 1.00 0.00 C +ATOM 70 CA PHE A 70 232.880 251.763 226.785 1.00 0.00 C +TER 71 PHE A 70 +END diff --git a/Plants/Q8RYM4/Q8RYM4.dcd b/Plants/Q8RYM4/Q8RYM4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..e89d7ecb8d1cb7d4c5b22f0ce7f2c155f25aa2e2 --- /dev/null +++ b/Plants/Q8RYM4/Q8RYM4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:7c04251ce68494dc5770ef7f3202d5f4685f617ad44a543431a6f9bad41b5ce8 +size 9200276 diff --git a/Plants/Q8RYM4/top.pdb b/Plants/Q8RYM4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..e56e7f386362fb3a885e17d280f8edcff86bc45f --- /dev/null +++ b/Plants/Q8RYM4/top.pdb @@ -0,0 +1,74 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 243.247 258.697 218.843 1.00 0.00 C +ATOM 2 CA ALA A 2 243.464 255.913 216.251 1.00 0.00 C +ATOM 3 CA ALA A 3 242.457 252.778 214.334 1.00 0.00 C +ATOM 4 CA THR A 4 244.731 250.965 211.874 1.00 0.00 C +ATOM 5 CA THR A 5 248.140 252.662 212.004 1.00 0.00 C +ATOM 6 CA SER A 6 251.672 251.323 212.499 1.00 0.00 C +ATOM 7 CA GLY A 7 255.447 251.377 211.985 1.00 0.00 C +ATOM 8 CA GLU A 8 258.796 250.361 213.491 1.00 0.00 C +ATOM 9 CA ASN A 9 261.533 247.853 214.350 1.00 0.00 C +ATOM 10 CA GLY A 10 263.442 246.133 217.163 1.00 0.00 C +ATOM 11 CA HIS A 11 263.768 243.525 219.921 1.00 0.00 C +ATOM 12 CA ARG A 12 262.649 243.554 223.563 1.00 0.00 C +ATOM 13 CA ARG A 13 264.792 244.745 226.479 1.00 0.00 C +ATOM 14 CA PRO A 14 268.461 245.236 225.576 1.00 0.00 C +ATOM 15 CA ASN A 15 270.995 247.162 223.482 1.00 0.00 C +ATOM 16 CA LYS A 16 271.581 250.868 222.817 1.00 0.00 C +ATOM 17 CA GLU A 17 271.599 254.017 224.961 1.00 0.00 C +ATOM 18 CA VAL A 18 268.449 256.048 224.273 1.00 0.00 C +ATOM 19 CA GLU A 19 267.314 259.119 226.221 1.00 0.00 C +ATOM 20 CA GLY A 20 264.507 258.418 228.700 1.00 0.00 C +ATOM 21 CA THR A 21 261.854 257.901 231.386 1.00 0.00 C +ATOM 22 CA SER A 22 258.628 259.411 232.739 1.00 0.00 C +ATOM 23 CA VAL A 23 255.202 261.075 232.842 1.00 0.00 C +ATOM 24 CA ALA A 24 252.471 262.202 230.436 1.00 0.00 C +ATOM 25 CA GLN A 25 251.895 261.925 226.680 1.00 0.00 C +ATOM 26 CA ARG A 26 249.189 263.793 224.755 1.00 0.00 C +ATOM 27 CA GLN A 27 245.574 263.666 225.952 1.00 0.00 C +ATOM 28 CA SER A 28 243.412 261.931 228.566 1.00 0.00 C +ATOM 29 CA SER A 29 243.849 259.880 231.747 1.00 0.00 C +ATOM 30 CA ASP A 30 240.477 258.877 233.209 1.00 0.00 C +ATOM 31 CA GLY A 31 238.449 255.897 234.446 1.00 0.00 C +ATOM 32 CA VAL A 32 237.721 254.995 238.075 1.00 0.00 C +ATOM 33 CA ASP A 33 237.160 255.973 241.714 1.00 0.00 C +ATOM 34 CA ALA A 34 238.712 259.233 242.930 1.00 0.00 C +ATOM 35 CA VAL A 35 236.873 260.651 245.951 1.00 0.00 C +ATOM 36 CA PHE A 36 237.364 258.995 249.347 1.00 0.00 C +ATOM 37 CA ASP A 37 236.120 255.398 249.521 1.00 0.00 C +ATOM 38 CA GLY A 38 236.710 251.993 251.125 1.00 0.00 C +ATOM 39 CA GLU A 39 239.825 250.980 253.072 1.00 0.00 C +ATOM 40 CA ALA A 40 239.722 247.840 255.228 1.00 0.00 C +ATOM 41 CA ASN A 41 240.736 244.507 253.687 1.00 0.00 C +ATOM 42 CA ALA A 42 241.297 241.892 250.973 1.00 0.00 C +ATOM 43 CA ARG A 43 243.679 238.972 251.535 1.00 0.00 C +ATOM 44 CA ILE A 44 244.731 238.166 255.107 1.00 0.00 C +ATOM 45 CA TRP A 45 246.988 237.747 258.147 1.00 0.00 C +ATOM 46 CA GLU A 46 249.298 240.083 260.076 1.00 0.00 C +ATOM 47 CA GLU A 47 251.066 239.140 263.316 1.00 0.00 C +ATOM 48 CA LYS A 48 252.362 241.748 265.774 1.00 0.00 C +ATOM 49 CA GLY A 49 254.770 242.758 268.548 1.00 0.00 C +ATOM 50 CA ASN A 50 253.818 244.420 271.842 1.00 0.00 C +ATOM 51 CA GLY A 51 253.032 242.748 275.174 1.00 0.00 C +ATOM 52 CA SER A 52 253.065 240.354 278.137 1.00 0.00 C +ATOM 53 CA ALA A 53 254.905 240.587 281.465 1.00 0.00 C +ATOM 54 CA ARG A 54 256.074 237.085 282.407 1.00 0.00 C +ATOM 55 CA GLY A 55 257.280 234.492 284.925 1.00 0.00 C +ATOM 56 CA GLY A 56 259.791 236.301 287.147 1.00 0.00 C +ATOM 57 CA GLY A 57 260.563 238.819 289.899 1.00 0.00 C +ATOM 58 CA GLY A 58 257.960 239.755 292.520 1.00 0.00 C +ATOM 59 CA LEU A 59 255.208 242.095 291.310 1.00 0.00 C +ATOM 60 CA ASN A 60 254.707 245.472 289.618 1.00 0.00 C +ATOM 61 CA ASP A 61 254.087 248.791 287.853 1.00 0.00 C +ATOM 62 CA HIS A 62 250.385 249.075 286.998 1.00 0.00 C +ATOM 63 CA SER A 63 246.933 249.955 288.348 1.00 0.00 C +ATOM 64 CA ALA A 64 243.246 249.486 289.186 1.00 0.00 C +ATOM 65 CA ARG A 65 239.591 248.541 289.704 1.00 0.00 C +ATOM 66 CA GLU A 66 235.961 249.674 289.928 1.00 0.00 C +ATOM 67 CA ILE A 67 232.206 250.069 290.441 1.00 0.00 C +ATOM 68 CA GLU A 68 229.981 251.510 293.177 1.00 0.00 C +ATOM 69 CA LYS A 69 228.332 254.938 293.384 1.00 0.00 C +ATOM 70 CA GLU A 70 229.696 257.452 290.868 1.00 0.00 C +TER 71 GLU A 70 +END diff --git a/Plants/Q8RYS4/Q8RYS4.dcd b/Plants/Q8RYS4/Q8RYS4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..6e6cdfeb0df75d80ecf3c4b2fd46b458b3e98bcd --- /dev/null +++ b/Plants/Q8RYS4/Q8RYS4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:b7509c5108c167ec365cfb036efaef8b5936f0cde359d0f369999a881e4cb0e5 +size 10160276 diff --git a/Plants/Q8RYS4/top.pdb b/Plants/Q8RYS4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..49f3c9ad6240c59849d690667f508822c93dccfe --- /dev/null +++ b/Plants/Q8RYS4/top.pdb @@ -0,0 +1,82 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 219.333 286.594 271.207 1.00 0.00 C +ATOM 2 CA PRO A 2 222.727 287.171 272.838 1.00 0.00 C +ATOM 3 CA VAL A 3 226.054 288.660 273.948 1.00 0.00 C +ATOM 4 CA VAL A 4 229.204 287.596 275.809 1.00 0.00 C +ATOM 5 CA PRO A 5 231.975 289.624 277.458 1.00 0.00 C +ATOM 6 CA PRO A 6 235.618 290.513 278.134 1.00 0.00 C +ATOM 7 CA ALA A 7 237.770 288.163 276.045 1.00 0.00 C +ATOM 8 CA ALA A 8 238.852 284.515 276.245 1.00 0.00 C +ATOM 9 CA ALA A 9 236.116 281.962 276.958 1.00 0.00 C +ATOM 10 CA ARG A 10 236.025 279.005 274.557 1.00 0.00 C +ATOM 11 CA TYR A 11 238.697 276.489 275.579 1.00 0.00 C +ATOM 12 CA SER A 12 242.429 277.163 275.953 1.00 0.00 C +ATOM 13 CA PRO A 13 245.536 279.328 275.537 1.00 0.00 C +ATOM 14 CA GLY A 14 247.502 282.377 276.701 1.00 0.00 C +ATOM 15 CA VAL A 15 250.333 283.481 274.402 1.00 0.00 C +ATOM 16 CA ALA A 16 251.296 283.321 270.719 1.00 0.00 C +ATOM 17 CA PRO A 17 250.339 281.282 267.646 1.00 0.00 C +ATOM 18 CA PRO A 18 249.419 277.638 268.266 1.00 0.00 C +ATOM 19 CA ALA A 19 250.965 274.369 269.468 1.00 0.00 C +ATOM 20 CA ALA A 20 251.200 272.016 266.481 1.00 0.00 C +ATOM 21 CA TYR A 21 253.154 270.170 263.781 1.00 0.00 C +ATOM 22 CA ARG A 22 256.504 270.891 262.115 1.00 0.00 C +ATOM 23 CA VAL A 23 260.227 270.671 262.895 1.00 0.00 C +ATOM 24 CA ARG A 24 262.694 267.882 263.700 1.00 0.00 C +ATOM 25 CA PRO A 25 261.557 264.698 261.944 1.00 0.00 C +ATOM 26 CA ARG A 26 258.921 261.947 261.999 1.00 0.00 C +ATOM 27 CA ARG A 27 255.803 263.266 263.747 1.00 0.00 C +ATOM 28 CA ALA A 28 253.104 263.332 261.059 1.00 0.00 C +ATOM 29 CA ARG A 29 250.724 260.626 259.823 1.00 0.00 C +ATOM 30 CA PRO A 30 251.779 258.832 256.631 1.00 0.00 C +ATOM 31 CA HIS A 31 253.016 255.989 254.416 1.00 0.00 C +ATOM 32 CA LEU A 32 252.157 254.980 250.844 1.00 0.00 C +ATOM 33 CA THR A 33 248.804 256.161 249.474 1.00 0.00 C +ATOM 34 CA ARG A 34 249.467 256.855 245.787 1.00 0.00 C +ATOM 35 CA ALA A 35 252.176 255.507 243.473 1.00 0.00 C +ATOM 36 CA GLY A 36 253.190 251.840 243.260 1.00 0.00 C +ATOM 37 CA ARG A 37 252.331 249.521 240.362 1.00 0.00 C +ATOM 38 CA GLU A 38 254.510 247.253 238.212 1.00 0.00 C +ATOM 39 CA GLU A 39 253.066 244.452 236.071 1.00 0.00 C +ATOM 40 CA GLY A 40 250.441 241.824 236.922 1.00 0.00 C +ATOM 41 CA GLU A 41 249.863 238.061 236.775 1.00 0.00 C +ATOM 42 CA GLU A 42 247.080 236.934 234.429 1.00 0.00 C +ATOM 43 CA ALA A 43 243.595 235.611 233.640 1.00 0.00 C +ATOM 44 CA MET A 44 240.025 234.405 233.079 1.00 0.00 C +ATOM 45 CA LEU A 45 237.663 236.097 235.543 1.00 0.00 C +ATOM 46 CA ALA A 46 235.128 237.457 238.041 1.00 0.00 C +ATOM 47 CA GLY A 47 231.662 237.925 236.530 1.00 0.00 C +ATOM 48 CA HIS A 48 228.135 238.434 235.181 1.00 0.00 C +ATOM 49 CA ARG A 49 225.125 237.129 237.117 1.00 0.00 C +ATOM 50 CA MET A 50 225.053 238.998 240.436 1.00 0.00 C +ATOM 51 CA GLY A 51 226.445 238.081 243.862 1.00 0.00 C +ATOM 52 CA ARG A 52 228.000 236.363 246.887 1.00 0.00 C +ATOM 53 CA GLU A 53 231.166 234.651 245.635 1.00 0.00 C +ATOM 54 CA GLU A 54 232.224 233.023 242.357 1.00 0.00 C +ATOM 55 CA GLY A 55 234.705 230.142 242.114 1.00 0.00 C +ATOM 56 CA GLU A 56 235.977 227.931 239.284 1.00 0.00 C +ATOM 57 CA GLU A 57 238.634 225.374 238.326 1.00 0.00 C +ATOM 58 CA ARG A 58 241.829 226.083 236.375 1.00 0.00 C +ATOM 59 CA ALA A 59 244.851 223.996 237.390 1.00 0.00 C +ATOM 60 CA GLY A 60 248.529 224.463 238.264 1.00 0.00 C +ATOM 61 CA MET A 61 250.174 221.203 239.350 1.00 0.00 C +ATOM 62 CA GLY A 62 252.972 218.662 238.866 1.00 0.00 C +ATOM 63 CA GLY A 63 255.971 216.313 238.791 1.00 0.00 C +ATOM 64 CA GLY A 64 259.742 216.854 238.804 1.00 0.00 C +ATOM 65 CA GLU A 65 262.212 219.749 238.990 1.00 0.00 C +ATOM 66 CA GLY A 66 264.670 222.393 237.772 1.00 0.00 C +ATOM 67 CA ASP A 67 267.763 220.701 236.328 1.00 0.00 C +ATOM 68 CA GLY A 68 270.573 218.416 237.512 1.00 0.00 C +ATOM 69 CA SER A 69 274.040 219.716 236.616 1.00 0.00 C +ATOM 70 CA GLU A 70 273.441 222.035 233.652 1.00 0.00 C +ATOM 71 CA GLU A 71 276.049 222.191 230.879 1.00 0.00 C +ATOM 72 CA ARG A 72 279.261 222.688 228.892 1.00 0.00 C +ATOM 73 CA ARG A 73 280.420 225.955 227.311 1.00 0.00 C +ATOM 74 CA GLY A 74 283.189 225.332 224.770 1.00 0.00 C +ATOM 75 CA ARG A 75 286.622 226.912 224.284 1.00 0.00 C +ATOM 76 CA LEU A 76 287.432 230.573 224.959 1.00 0.00 C +ATOM 77 CA LEU A 77 287.879 231.479 228.632 1.00 0.00 C +ATOM 78 CA PRO A 78 286.888 229.708 231.857 1.00 0.00 C +TER 79 PRO A 78 +END diff --git a/Plants/Q8RYT8/Q8RYT8.dcd b/Plants/Q8RYT8/Q8RYT8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..14f1c3a150fc3f3aee11f5179f98375871b80aef --- /dev/null +++ b/Plants/Q8RYT8/Q8RYT8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:89af815e7417514f9ddbaa0ebc71994da4394051e499138a029eb6d53b1ea28c +size 13640276 diff --git a/Plants/Q8RYT8/top.pdb b/Plants/Q8RYT8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..5b7e0a1ecb76cd1b6af74381658af11c4eb20c14 --- /dev/null +++ b/Plants/Q8RYT8/top.pdb @@ -0,0 +1,111 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 266.202 248.459 250.763 1.00 0.00 C +ATOM 2 CA VAL A 2 266.611 244.681 251.035 1.00 0.00 C +ATOM 3 CA GLY A 3 266.975 241.143 252.401 1.00 0.00 C +ATOM 4 CA ARG A 4 269.629 239.263 250.417 1.00 0.00 C +ATOM 5 CA GLY A 5 271.728 236.095 250.682 1.00 0.00 C +ATOM 6 CA PHE A 6 275.516 235.749 250.451 1.00 0.00 C +ATOM 7 CA GLY A 7 278.679 236.869 248.646 1.00 0.00 C +ATOM 8 CA GLY A 8 278.832 240.474 247.424 1.00 0.00 C +ATOM 9 CA HIS A 9 276.414 243.241 248.431 1.00 0.00 C +ATOM 10 CA LEU A 10 275.160 245.915 250.838 1.00 0.00 C +ATOM 11 CA HIS A 11 273.826 248.350 253.447 1.00 0.00 C +ATOM 12 CA VAL A 12 271.379 251.265 253.620 1.00 0.00 C +ATOM 13 CA GLU A 13 269.764 252.191 256.945 1.00 0.00 C +ATOM 14 CA ASP A 14 271.227 254.462 259.631 1.00 0.00 C +ATOM 15 CA ASP A 15 271.583 253.699 263.347 1.00 0.00 C +ATOM 16 CA GLU A 16 268.652 255.215 265.251 1.00 0.00 C +ATOM 17 CA THR A 17 265.945 254.516 267.839 1.00 0.00 C +ATOM 18 CA ASN A 18 264.462 255.645 271.162 1.00 0.00 C +ATOM 19 CA PRO A 19 262.490 255.305 274.404 1.00 0.00 C +ATOM 20 CA THR A 20 259.320 256.424 276.197 1.00 0.00 C +ATOM 21 CA VAL A 21 258.620 254.454 279.382 1.00 0.00 C +ATOM 22 CA LEU A 22 256.624 251.208 279.368 1.00 0.00 C +ATOM 23 CA THR A 23 257.371 247.621 278.322 1.00 0.00 C +ATOM 24 CA THR A 24 257.418 243.850 277.786 1.00 0.00 C +ATOM 25 CA THR A 25 255.616 241.322 279.996 1.00 0.00 C +ATOM 26 CA THR A 26 254.223 237.886 279.121 1.00 0.00 C +ATOM 27 CA THR A 27 253.258 235.993 275.958 1.00 0.00 C +ATOM 28 CA ASP A 28 252.033 238.195 273.101 1.00 0.00 C +ATOM 29 CA VAL A 29 250.548 241.435 271.753 1.00 0.00 C +ATOM 30 CA GLY A 30 251.445 245.114 272.167 1.00 0.00 C +ATOM 31 CA ARG A 31 251.015 248.811 272.981 1.00 0.00 C +ATOM 32 CA ARG A 32 248.060 251.159 273.502 1.00 0.00 C +ATOM 33 CA PRO A 33 247.011 253.574 270.748 1.00 0.00 C +ATOM 34 CA ALA A 34 246.674 254.436 267.052 1.00 0.00 C +ATOM 35 CA THR A 35 246.599 252.794 263.615 1.00 0.00 C +ATOM 36 CA LYS A 36 247.307 252.014 259.953 1.00 0.00 C +ATOM 37 CA GLY A 37 248.595 250.847 256.563 1.00 0.00 C +ATOM 38 CA ALA A 38 250.667 251.146 253.379 1.00 0.00 C +ATOM 39 CA ALA A 39 252.134 252.172 250.016 1.00 0.00 C +ATOM 40 CA ALA A 40 253.708 253.785 246.944 1.00 0.00 C +ATOM 41 CA ALA A 41 255.736 251.135 245.106 1.00 0.00 C +ATOM 42 CA ALA A 42 255.661 248.885 242.032 1.00 0.00 C +ATOM 43 CA ARG A 43 257.729 250.706 239.401 1.00 0.00 C +ATOM 44 CA LEU A 44 261.410 250.246 240.267 1.00 0.00 C +ATOM 45 CA ASP A 45 262.985 252.397 242.989 1.00 0.00 C +ATOM 46 CA ARG A 46 266.659 252.813 242.072 1.00 0.00 C +ATOM 47 CA ARG A 47 269.756 253.831 240.100 1.00 0.00 C +ATOM 48 CA ARG A 48 272.475 256.223 241.283 1.00 0.00 C +ATOM 49 CA ARG A 49 275.091 258.908 240.599 1.00 0.00 C +ATOM 50 CA ALA A 50 277.997 260.547 238.759 1.00 0.00 C +ATOM 51 CA THR A 51 277.898 262.854 235.729 1.00 0.00 C +ATOM 52 CA ALA A 52 277.511 266.206 233.959 1.00 0.00 C +ATOM 53 CA ALA A 53 274.665 267.957 235.790 1.00 0.00 C +ATOM 54 CA GLY A 54 271.285 266.898 234.386 1.00 0.00 C +ATOM 55 CA GLY A 55 269.843 263.489 233.484 1.00 0.00 C +ATOM 56 CA GLU A 56 267.746 260.692 234.999 1.00 0.00 C +ATOM 57 CA GLY A 57 264.840 258.322 234.328 1.00 0.00 C +ATOM 58 CA GLY A 58 261.388 256.718 234.151 1.00 0.00 C +ATOM 59 CA ARG A 59 257.987 255.173 234.900 1.00 0.00 C +ATOM 60 CA ALA A 60 255.736 256.454 232.106 1.00 0.00 C +ATOM 61 CA ALA A 61 253.275 255.267 229.450 1.00 0.00 C +ATOM 62 CA GLY A 62 252.174 252.219 227.448 1.00 0.00 C +ATOM 63 CA LEU A 63 249.301 249.846 228.241 1.00 0.00 C +ATOM 64 CA PRO A 64 246.354 249.387 230.612 1.00 0.00 C +ATOM 65 CA HIS A 65 243.065 251.065 231.553 1.00 0.00 C +ATOM 66 CA SER A 66 239.408 251.793 230.771 1.00 0.00 C +ATOM 67 CA SER A 67 237.409 250.351 227.865 1.00 0.00 C +ATOM 68 CA ALA A 68 234.942 252.979 226.630 1.00 0.00 C +ATOM 69 CA HIS A 69 231.471 252.072 227.914 1.00 0.00 C +ATOM 70 CA LEU A 70 228.767 252.747 225.316 1.00 0.00 C +ATOM 71 CA LEU A 71 226.171 255.382 226.229 1.00 0.00 C +ATOM 72 CA ALA A 72 227.076 258.370 228.413 1.00 0.00 C +ATOM 73 CA ALA A 73 227.148 261.034 231.136 1.00 0.00 C +ATOM 74 CA ALA A 74 227.491 264.004 233.497 1.00 0.00 C +ATOM 75 CA ALA A 75 226.724 267.333 235.183 1.00 0.00 C +ATOM 76 CA SER A 76 224.226 267.909 238.001 1.00 0.00 C +ATOM 77 CA GLY A 77 223.148 265.048 240.275 1.00 0.00 C +ATOM 78 CA GLY A 78 221.470 261.802 239.197 1.00 0.00 C +ATOM 79 CA ASP A 79 220.733 261.474 235.474 1.00 0.00 C +ATOM 80 CA GLY A 80 220.782 258.152 233.608 1.00 0.00 C +ATOM 81 CA ARG A 81 222.828 255.380 235.232 1.00 0.00 C +ATOM 82 CA SER A 82 221.309 252.016 236.179 1.00 0.00 C +ATOM 83 CA GLY A 83 221.674 248.238 235.852 1.00 0.00 C +ATOM 84 CA ALA A 84 222.906 246.109 238.762 1.00 0.00 C +ATOM 85 CA ALA A 85 226.119 244.718 240.264 1.00 0.00 C +ATOM 86 CA ALA A 86 229.233 245.929 242.097 1.00 0.00 C +ATOM 87 CA ARG A 87 231.291 246.919 245.146 1.00 0.00 C +ATOM 88 CA LEU A 88 232.610 243.866 247.004 1.00 0.00 C +ATOM 89 CA ALA A 89 231.412 240.451 245.813 1.00 0.00 C +ATOM 90 CA SER A 90 229.989 239.765 242.346 1.00 0.00 C +ATOM 91 CA ALA A 91 232.619 237.968 240.256 1.00 0.00 C +ATOM 92 CA GLY A 92 235.807 236.731 241.936 1.00 0.00 C +ATOM 93 CA GLY A 93 236.641 236.033 245.588 1.00 0.00 C +ATOM 94 CA GLY A 94 236.475 233.387 248.324 1.00 0.00 C +ATOM 95 CA LYS A 95 234.020 234.702 250.924 1.00 0.00 C +ATOM 96 CA ARG A 96 234.200 236.376 254.342 1.00 0.00 C +ATOM 97 CA THR A 97 235.167 238.504 257.351 1.00 0.00 C +ATOM 98 CA LYS A 98 234.279 238.334 261.052 1.00 0.00 C +ATOM 99 CA ARG A 99 234.872 240.560 264.087 1.00 0.00 C +ATOM 100 CA ARG A 100 237.731 242.941 263.267 1.00 0.00 C +ATOM 101 CA GLY A 101 241.534 243.107 263.109 1.00 0.00 C +ATOM 102 CA SER A 102 243.141 242.926 266.558 1.00 0.00 C +ATOM 103 CA ASP A 103 242.336 241.349 269.932 1.00 0.00 C +ATOM 104 CA SER A 104 241.971 243.937 272.704 1.00 0.00 C +ATOM 105 CA THR A 105 240.907 246.914 274.830 1.00 0.00 C +ATOM 106 CA ALA A 106 239.867 249.147 277.736 1.00 0.00 C +ATOM 107 CA HIS A 107 240.210 248.223 281.417 1.00 0.00 C +TER 108 HIS A 107 +END diff --git a/Plants/Q8RZC6/Q8RZC6.dcd b/Plants/Q8RZC6/Q8RZC6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..0e495cd13a999040d4de8e838efec4d495d91e94 --- /dev/null +++ b/Plants/Q8RZC6/Q8RZC6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:601c485ebc52c8a685723a88e74ce967fb8385dec32247a07d1a440da298dca5 +size 11480276 diff --git a/Plants/Q8RZC6/top.pdb b/Plants/Q8RZC6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a8a45e771028254ed868bc01c9b808f957bda4a8 --- /dev/null +++ b/Plants/Q8RZC6/top.pdb @@ -0,0 +1,93 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 198.986 243.776 247.328 1.00 0.00 C +ATOM 2 CA GLN A 2 198.622 247.403 248.434 1.00 0.00 C +ATOM 3 CA VAL A 3 198.517 249.684 251.484 1.00 0.00 C +ATOM 4 CA ALA A 4 200.273 251.855 254.076 1.00 0.00 C +ATOM 5 CA ASP A 5 203.322 250.603 255.988 1.00 0.00 C +ATOM 6 CA ARG A 6 205.536 247.599 256.753 1.00 0.00 C +ATOM 7 CA PRO A 7 208.166 244.856 256.473 1.00 0.00 C +ATOM 8 CA ALA A 8 207.874 241.499 258.250 1.00 0.00 C +ATOM 9 CA ASP A 9 210.424 239.658 260.401 1.00 0.00 C +ATOM 10 CA GLU A 10 211.757 238.676 263.832 1.00 0.00 C +ATOM 11 CA SER A 11 215.084 238.265 265.642 1.00 0.00 C +ATOM 12 CA ASN A 12 218.502 236.589 265.809 1.00 0.00 C +ATOM 13 CA LYS A 13 220.684 234.215 263.780 1.00 0.00 C +ATOM 14 CA GLN A 14 220.827 230.911 261.887 1.00 0.00 C +ATOM 15 CA HIS A 15 223.563 228.369 261.135 1.00 0.00 C +ATOM 16 CA GLY A 16 225.215 226.721 258.123 1.00 0.00 C +ATOM 17 CA ARG A 17 228.802 227.793 257.415 1.00 0.00 C +ATOM 18 CA PRO A 18 231.608 228.465 259.903 1.00 0.00 C +ATOM 19 CA LEU A 19 235.408 228.305 260.132 1.00 0.00 C +ATOM 20 CA GLN A 20 238.239 228.595 257.599 1.00 0.00 C +ATOM 21 CA HIS A 21 241.329 226.440 257.031 1.00 0.00 C +ATOM 22 CA SER A 22 244.539 226.604 254.985 1.00 0.00 C +ATOM 23 CA THR A 23 243.745 228.354 251.695 1.00 0.00 C +ATOM 24 CA GLN A 24 246.837 229.416 249.739 1.00 0.00 C +ATOM 25 CA GLN A 25 250.016 231.512 249.873 1.00 0.00 C +ATOM 26 CA ARG A 26 251.749 234.787 248.987 1.00 0.00 C +ATOM 27 CA ALA A 27 254.639 235.115 246.525 1.00 0.00 C +ATOM 28 CA GLN A 28 255.156 237.908 243.985 1.00 0.00 C +ATOM 29 CA GLU A 29 255.576 241.616 243.217 1.00 0.00 C +ATOM 30 CA GLY A 30 257.600 244.828 242.897 1.00 0.00 C +ATOM 31 CA MET A 31 256.329 248.331 243.694 1.00 0.00 C +ATOM 32 CA HIS A 32 254.942 251.847 244.167 1.00 0.00 C +ATOM 33 CA ALA A 33 252.186 254.330 243.295 1.00 0.00 C +ATOM 34 CA ALA A 34 252.735 255.168 239.619 1.00 0.00 C +ATOM 35 CA ASN A 35 254.202 255.203 236.103 1.00 0.00 C +ATOM 36 CA SER A 36 256.582 252.287 235.509 1.00 0.00 C +ATOM 37 CA HIS A 37 259.709 252.458 237.679 1.00 0.00 C +ATOM 38 CA GLY A 38 261.898 255.449 238.561 1.00 0.00 C +ATOM 39 CA HIS A 39 262.534 255.725 242.307 1.00 0.00 C +ATOM 40 CA GLY A 40 263.788 252.312 243.444 1.00 0.00 C +ATOM 41 CA HIS A 41 264.308 248.615 244.204 1.00 0.00 C +ATOM 42 CA GLY A 42 266.758 245.749 243.659 1.00 0.00 C +ATOM 43 CA SER A 43 270.140 244.894 245.191 1.00 0.00 C +ATOM 44 CA GLU A 44 270.883 243.639 248.711 1.00 0.00 C +ATOM 45 CA TRP A 45 271.532 240.902 251.280 1.00 0.00 C +ATOM 46 CA PRO A 46 274.308 240.585 253.870 1.00 0.00 C +ATOM 47 CA LEU A 47 275.004 236.850 254.153 1.00 0.00 C +ATOM 48 CA PRO A 48 271.695 234.997 254.518 1.00 0.00 C +ATOM 49 CA GLY A 49 269.569 237.218 256.768 1.00 0.00 C +ATOM 50 CA GLN A 50 265.789 237.309 257.238 1.00 0.00 C +ATOM 51 CA ALA A 51 262.252 237.295 255.822 1.00 0.00 C +ATOM 52 CA THR A 52 262.234 239.845 252.991 1.00 0.00 C +ATOM 53 CA MET A 53 263.295 242.521 250.496 1.00 0.00 C +ATOM 54 CA GLY A 54 261.106 243.997 247.749 1.00 0.00 C +ATOM 55 CA SER A 55 258.197 245.574 249.637 1.00 0.00 C +ATOM 56 CA GLN A 56 259.167 249.036 250.898 1.00 0.00 C +ATOM 57 CA GLN A 57 258.561 252.614 252.061 1.00 0.00 C +ATOM 58 CA GLN A 58 258.415 254.014 255.601 1.00 0.00 C +ATOM 59 CA GLN A 59 257.369 254.723 259.195 1.00 0.00 C +ATOM 60 CA ARG A 60 253.601 255.074 259.636 1.00 0.00 C +ATOM 61 CA HIS A 61 252.081 258.137 257.957 1.00 0.00 C +ATOM 62 CA ARG A 62 253.948 261.225 256.733 1.00 0.00 C +ATOM 63 CA ALA A 63 256.484 261.737 253.937 1.00 0.00 C +ATOM 64 CA ARG A 64 256.765 264.506 251.334 1.00 0.00 C +ATOM 65 CA ILE A 65 256.272 266.111 247.914 1.00 0.00 C +ATOM 66 CA HIS A 66 256.346 269.871 248.520 1.00 0.00 C +ATOM 67 CA ALA A 67 253.392 271.894 249.823 1.00 0.00 C +ATOM 68 CA SER A 68 250.084 271.277 248.036 1.00 0.00 C +ATOM 69 CA GLY A 69 249.541 269.196 244.891 1.00 0.00 C +ATOM 70 CA SER A 70 249.873 266.523 242.196 1.00 0.00 C +ATOM 71 CA GLY A 71 253.434 265.363 241.498 1.00 0.00 C +ATOM 72 CA ALA A 72 255.491 262.365 240.361 1.00 0.00 C +ATOM 73 CA ARG A 73 258.542 261.819 242.576 1.00 0.00 C +ATOM 74 CA THR A 74 261.962 262.946 243.820 1.00 0.00 C +ATOM 75 CA SER A 75 264.391 264.576 241.378 1.00 0.00 C +ATOM 76 CA SER A 76 263.211 268.147 240.770 1.00 0.00 C +ATOM 77 CA HIS A 77 264.670 271.663 240.925 1.00 0.00 C +ATOM 78 CA PRO A 78 266.754 272.474 237.840 1.00 0.00 C +ATOM 79 CA ALA A 79 269.358 270.208 236.228 1.00 0.00 C +ATOM 80 CA GLY A 80 269.555 266.403 236.223 1.00 0.00 C +ATOM 81 CA ALA A 81 270.839 263.383 238.158 1.00 0.00 C +ATOM 82 CA ASP A 82 272.817 262.748 241.352 1.00 0.00 C +ATOM 83 CA HIS A 83 272.120 265.540 243.849 1.00 0.00 C +ATOM 84 CA GLY A 84 271.138 266.292 247.453 1.00 0.00 C +ATOM 85 CA HIS A 85 270.638 268.175 250.727 1.00 0.00 C +ATOM 86 CA SER A 86 267.316 269.949 251.303 1.00 0.00 C +ATOM 87 CA PRO A 87 265.910 270.415 254.814 1.00 0.00 C +ATOM 88 CA ARG A 88 263.952 268.687 257.588 1.00 0.00 C +ATOM 89 CA ARG A 89 261.439 269.391 260.363 1.00 0.00 C +TER 90 ARG A 89 +END diff --git a/Plants/Q8RZF2/Q8RZF2.dcd b/Plants/Q8RZF2/Q8RZF2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..80c4a2b686680a2c9c61911f5cc85ab744c64e91 --- /dev/null +++ b/Plants/Q8RZF2/Q8RZF2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f36682feefd226ac69ce52079bd8a2ad4af2470537cc48870a8c03fde00a29f3 +size 7160276 diff --git a/Plants/Q8RZF2/top.pdb b/Plants/Q8RZF2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..bff6cdd9fd62e9b8d12f5222d31bc4972c0dd4af --- /dev/null +++ b/Plants/Q8RZF2/top.pdb @@ -0,0 +1,57 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 238.916 229.001 262.919 1.00 0.00 C +ATOM 2 CA ARG A 2 242.109 230.461 264.399 1.00 0.00 C +ATOM 3 CA GLY A 3 244.163 233.287 262.881 1.00 0.00 C +ATOM 4 CA TRP A 4 243.535 236.831 261.630 1.00 0.00 C +ATOM 5 CA SER A 5 246.077 239.526 262.519 1.00 0.00 C +ATOM 6 CA GLY A 6 244.479 242.933 263.121 1.00 0.00 C +ATOM 7 CA GLY A 7 243.347 245.476 260.520 1.00 0.00 C +ATOM 8 CA THR A 8 241.391 248.622 261.412 1.00 0.00 C +ATOM 9 CA GLY A 9 238.553 250.500 259.699 1.00 0.00 C +ATOM 10 CA GLU A 10 239.712 253.722 258.028 1.00 0.00 C +ATOM 11 CA LEU A 11 242.801 255.868 258.629 1.00 0.00 C +ATOM 12 CA ALA A 12 246.177 255.496 256.902 1.00 0.00 C +ATOM 13 CA GLU A 13 249.160 255.847 259.246 1.00 0.00 C +ATOM 14 CA GLY A 14 252.453 256.085 261.147 1.00 0.00 C +ATOM 15 CA GLY A 15 254.888 256.630 264.027 1.00 0.00 C +ATOM 16 CA ARG A 16 258.298 255.184 263.136 1.00 0.00 C +ATOM 17 CA ARG A 17 261.603 254.453 261.386 1.00 0.00 C +ATOM 18 CA VAL A 18 261.444 251.203 259.404 1.00 0.00 C +ATOM 19 CA ARG A 19 262.235 249.843 255.934 1.00 0.00 C +ATOM 20 CA ARG A 20 261.059 248.062 252.778 1.00 0.00 C +ATOM 21 CA GLN A 21 260.506 245.503 250.010 1.00 0.00 C +ATOM 22 CA ALA A 22 261.575 245.147 246.370 1.00 0.00 C +ATOM 23 CA ALA A 23 260.551 248.178 244.301 1.00 0.00 C +ATOM 24 CA ALA A 24 260.924 251.630 245.869 1.00 0.00 C +ATOM 25 CA THR A 25 259.895 255.261 245.345 1.00 0.00 C +ATOM 26 CA THR A 26 260.470 257.586 242.382 1.00 0.00 C +ATOM 27 CA GLY A 27 259.888 259.782 239.323 1.00 0.00 C +ATOM 28 CA LEU A 28 258.777 263.292 240.302 1.00 0.00 C +ATOM 29 CA ARG A 29 255.997 262.782 242.858 1.00 0.00 C +ATOM 30 CA ARG A 30 257.638 262.899 246.294 1.00 0.00 C +ATOM 31 CA GLY A 31 256.703 262.221 249.925 1.00 0.00 C +ATOM 32 CA GLY A 32 257.257 258.923 251.751 1.00 0.00 C +ATOM 33 CA GLY A 33 258.404 255.300 252.025 1.00 0.00 C +ATOM 34 CA VAL A 34 256.246 252.509 250.588 1.00 0.00 C +ATOM 35 CA GLU A 35 252.900 252.449 252.409 1.00 0.00 C +ATOM 36 CA ALA A 36 250.119 255.007 251.926 1.00 0.00 C +ATOM 37 CA THR A 37 248.459 256.858 249.039 1.00 0.00 C +ATOM 38 CA ARG A 38 245.632 257.891 246.702 1.00 0.00 C +ATOM 39 CA HIS A 39 242.138 257.251 245.325 1.00 0.00 C +ATOM 40 CA GLY A 40 239.738 256.539 242.452 1.00 0.00 C +ATOM 41 CA ARG A 41 236.844 254.069 242.640 1.00 0.00 C +ATOM 42 CA GLY A 42 237.356 250.389 243.485 1.00 0.00 C +ATOM 43 CA LEU A 43 238.923 247.417 245.280 1.00 0.00 C +ATOM 44 CA ALA A 44 240.884 244.188 244.781 1.00 0.00 C +ATOM 45 CA ALA A 45 244.433 244.941 243.617 1.00 0.00 C +ATOM 46 CA ALA A 46 245.108 245.679 239.940 1.00 0.00 C +ATOM 47 CA ALA A 47 248.711 245.356 238.744 1.00 0.00 C +ATOM 48 CA GLY A 48 249.838 245.029 235.120 1.00 0.00 C +ATOM 49 CA ARG A 49 250.862 241.423 234.438 1.00 0.00 C +ATOM 50 CA PRO A 50 248.277 239.117 236.024 1.00 0.00 C +ATOM 51 CA ARG A 51 244.513 239.663 235.796 1.00 0.00 C +ATOM 52 CA SER A 52 243.676 241.472 232.549 1.00 0.00 C +ATOM 53 CA ASN A 53 244.359 245.219 232.674 1.00 0.00 C +TER 54 ASN A 53 +END diff --git a/Plants/Q8S0L1/Q8S0L1.dcd b/Plants/Q8S0L1/Q8S0L1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..7ae13239de723add8c3145d736f7cb3d2af03353 --- /dev/null +++ b/Plants/Q8S0L1/Q8S0L1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c3e37289d44ac1cb9f57874e37584e3540ed1b7e0fb3938da7a8e028978953bb +size 7760276 diff --git a/Plants/Q8S0L1/top.pdb b/Plants/Q8S0L1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..73c3972a226c67da1fd967ba9ec367352d62c76b --- /dev/null +++ b/Plants/Q8S0L1/top.pdb @@ -0,0 +1,62 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 262.213 249.928 254.352 1.00 0.00 C +ATOM 2 CA ALA A 2 263.378 251.503 257.620 1.00 0.00 C +ATOM 3 CA SER A 3 265.868 253.524 259.677 1.00 0.00 C +ATOM 4 CA ALA A 4 268.912 255.808 259.500 1.00 0.00 C +ATOM 5 CA GLY A 5 269.984 258.986 257.692 1.00 0.00 C +ATOM 6 CA PRO A 6 272.247 258.234 254.720 1.00 0.00 C +ATOM 7 CA PRO A 7 273.361 254.833 253.413 1.00 0.00 C +ATOM 8 CA HIS A 8 274.065 254.251 249.714 1.00 0.00 C +ATOM 9 CA ARG A 9 270.953 254.332 247.516 1.00 0.00 C +ATOM 10 CA ARG A 10 269.456 256.413 244.697 1.00 0.00 C +ATOM 11 CA LEU A 11 267.378 257.716 241.782 1.00 0.00 C +ATOM 12 CA ARG A 12 264.183 259.068 240.207 1.00 0.00 C +ATOM 13 CA LEU A 13 265.151 260.457 236.793 1.00 0.00 C +ATOM 14 CA ARG A 14 265.060 258.260 233.682 1.00 0.00 C +ATOM 15 CA GLY A 15 261.991 259.367 231.714 1.00 0.00 C +ATOM 16 CA ALA A 16 259.372 257.266 229.913 1.00 0.00 C +ATOM 17 CA ARG A 17 256.768 254.746 231.089 1.00 0.00 C +ATOM 18 CA SER A 18 255.588 254.065 234.647 1.00 0.00 C +ATOM 19 CA GLY A 19 254.591 252.193 237.812 1.00 0.00 C +ATOM 20 CA ARG A 20 253.865 248.513 237.146 1.00 0.00 C +ATOM 21 CA ASP A 21 253.546 244.739 236.726 1.00 0.00 C +ATOM 22 CA TRP A 22 254.417 241.817 234.441 1.00 0.00 C +ATOM 23 CA GLU A 23 251.300 240.852 232.474 1.00 0.00 C +ATOM 24 CA THR A 24 249.412 244.124 231.979 1.00 0.00 C +ATOM 25 CA MET A 25 248.841 247.885 232.188 1.00 0.00 C +ATOM 26 CA GLU A 26 245.482 249.670 231.970 1.00 0.00 C +ATOM 27 CA TRP A 27 244.184 252.899 233.521 1.00 0.00 C +ATOM 28 CA ARG A 28 244.153 255.391 236.403 1.00 0.00 C +ATOM 29 CA PRO A 29 246.122 253.647 239.159 1.00 0.00 C +ATOM 30 CA ARG A 30 246.970 252.797 242.775 1.00 0.00 C +ATOM 31 CA ASP A 31 249.966 250.608 243.638 1.00 0.00 C +ATOM 32 CA LEU A 32 252.382 248.773 245.944 1.00 0.00 C +ATOM 33 CA ASP A 33 251.249 248.513 249.572 1.00 0.00 C +ATOM 34 CA HIS A 34 249.858 247.888 253.064 1.00 0.00 C +ATOM 35 CA PRO A 35 249.721 244.498 254.797 1.00 0.00 C +ATOM 36 CA ALA A 36 251.294 241.575 256.668 1.00 0.00 C +ATOM 37 CA SER A 37 252.200 239.604 259.800 1.00 0.00 C +ATOM 38 CA SER A 38 255.715 240.031 261.209 1.00 0.00 C +ATOM 39 CA ALA A 39 255.622 241.064 264.875 1.00 0.00 C +ATOM 40 CA ALA A 40 257.006 242.305 268.201 1.00 0.00 C +ATOM 41 CA PRO A 41 256.847 246.110 268.113 1.00 0.00 C +ATOM 42 CA SER A 42 253.322 247.410 268.744 1.00 0.00 C +ATOM 43 CA PRO A 43 251.570 250.650 269.721 1.00 0.00 C +ATOM 44 CA ALA A 44 248.899 251.153 267.051 1.00 0.00 C +ATOM 45 CA ALA A 45 245.756 250.621 264.964 1.00 0.00 C +ATOM 46 CA VAL A 46 242.994 248.141 264.106 1.00 0.00 C +ATOM 47 CA ASP A 47 239.315 248.321 265.081 1.00 0.00 C +ATOM 48 CA ASP A 48 236.602 247.820 262.454 1.00 0.00 C +ATOM 49 CA GLY A 49 234.170 249.441 260.009 1.00 0.00 C +ATOM 50 CA ALA A 50 232.026 249.037 256.886 1.00 0.00 C +ATOM 51 CA ALA A 51 228.302 249.764 257.234 1.00 0.00 C +ATOM 52 CA ARG A 52 225.839 247.121 258.447 1.00 0.00 C +ATOM 53 CA ARG A 53 222.842 245.007 257.417 1.00 0.00 C +ATOM 54 CA ARG A 54 219.673 243.878 255.628 1.00 0.00 C +ATOM 55 CA GLY A 55 218.367 246.909 253.724 1.00 0.00 C +ATOM 56 CA ASP A 56 214.772 248.010 253.111 1.00 0.00 C +ATOM 57 CA GLU A 57 213.058 247.933 256.513 1.00 0.00 C +ATOM 58 CA GLY A 58 211.824 244.532 257.708 1.00 0.00 C +TER 59 GLY A 58 +END diff --git a/Plants/Q8S1A2/Q8S1A2.dcd b/Plants/Q8S1A2/Q8S1A2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..2b9ece97016c67ad36061b347cbbc39b4daa8a6a --- /dev/null +++ b/Plants/Q8S1A2/Q8S1A2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c4ba61afc51a8195d2e380a8f12f90578c70e8bafbd3587ec0867aca110af087 +size 22160276 diff --git a/Plants/Q8S1A2/top.pdb b/Plants/Q8S1A2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..4fdca80e35de63beb4731121865a0f980de27a40 --- /dev/null +++ b/Plants/Q8S1A2/top.pdb @@ -0,0 +1,182 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 271.299 214.135 200.499 1.00 0.00 C +ATOM 2 CA GLN A 2 268.170 214.160 202.672 1.00 0.00 C +ATOM 3 CA PRO A 3 266.544 215.083 205.992 1.00 0.00 C +ATOM 4 CA HIS A 4 265.411 218.555 207.078 1.00 0.00 C +ATOM 5 CA GLY A 5 264.087 221.158 209.525 1.00 0.00 C +ATOM 6 CA PRO A 6 265.320 224.702 210.190 1.00 0.00 C +ATOM 7 CA ARG A 7 263.945 227.718 208.313 1.00 0.00 C +ATOM 8 CA TRP A 8 265.150 227.956 204.706 1.00 0.00 C +ATOM 9 CA THR A 9 263.425 226.230 201.780 1.00 0.00 C +ATOM 10 CA ALA A 10 263.389 227.232 198.104 1.00 0.00 C +ATOM 11 CA LEU A 11 262.008 230.510 196.739 1.00 0.00 C +ATOM 12 CA THR A 12 258.259 230.785 197.360 1.00 0.00 C +ATOM 13 CA GLY A 13 256.975 227.470 198.730 1.00 0.00 C +ATOM 14 CA ARG A 14 255.585 226.540 202.153 1.00 0.00 C +ATOM 15 CA VAL A 15 253.471 223.715 203.593 1.00 0.00 C +ATOM 16 CA GLU A 16 255.017 223.000 207.000 1.00 0.00 C +ATOM 17 CA ARG A 17 253.380 223.829 210.339 1.00 0.00 C +ATOM 18 CA ARG A 18 253.364 227.378 211.726 1.00 0.00 C +ATOM 19 CA GLU A 19 256.243 229.570 212.918 1.00 0.00 C +ATOM 20 CA ARG A 20 255.816 230.745 216.517 1.00 0.00 C +ATOM 21 CA PRO A 21 255.437 232.621 219.811 1.00 0.00 C +ATOM 22 CA ILE A 22 253.734 232.345 223.209 1.00 0.00 C +ATOM 23 CA GLU A 23 252.402 235.632 224.599 1.00 0.00 C +ATOM 24 CA VAL A 24 252.146 237.092 228.109 1.00 0.00 C +ATOM 25 CA GLY A 25 255.271 238.052 230.066 1.00 0.00 C +ATOM 26 CA SER A 26 258.294 235.959 231.064 1.00 0.00 C +ATOM 27 CA THR A 27 260.796 233.185 230.317 1.00 0.00 C +ATOM 28 CA ARG A 28 264.233 234.768 229.869 1.00 0.00 C +ATOM 29 CA SER A 29 267.233 232.486 229.313 1.00 0.00 C +ATOM 30 CA ARG A 30 268.627 229.643 227.194 1.00 0.00 C +ATOM 31 CA PRO A 31 270.900 229.099 224.185 1.00 0.00 C +ATOM 32 CA ARG A 32 274.108 227.308 225.192 1.00 0.00 C +ATOM 33 CA TRP A 33 276.345 228.905 227.830 1.00 0.00 C +ATOM 34 CA HIS A 34 279.123 230.152 230.120 1.00 0.00 C +ATOM 35 CA ARG A 35 278.146 229.046 233.632 1.00 0.00 C +ATOM 36 CA ARG A 36 279.994 225.869 234.636 1.00 0.00 C +ATOM 37 CA GLY A 37 282.206 224.350 237.341 1.00 0.00 C +ATOM 38 CA ALA A 38 281.461 222.854 240.765 1.00 0.00 C +ATOM 39 CA PHE A 39 282.142 222.708 244.511 1.00 0.00 C +ATOM 40 CA VAL A 40 282.618 224.826 247.643 1.00 0.00 C +ATOM 41 CA ALA A 41 282.964 228.593 248.097 1.00 0.00 C +ATOM 42 CA ALA A 42 280.524 229.654 250.824 1.00 0.00 C +ATOM 43 CA THR A 43 276.869 228.651 251.211 1.00 0.00 C +ATOM 44 CA ARG A 44 273.173 228.425 250.312 1.00 0.00 C +ATOM 45 CA ALA A 45 270.598 230.133 248.083 1.00 0.00 C +ATOM 46 CA GLY A 46 271.892 233.633 247.314 1.00 0.00 C +ATOM 47 CA GLU A 47 270.166 235.851 244.741 1.00 0.00 C +ATOM 48 CA ARG A 48 272.369 238.909 244.182 1.00 0.00 C +ATOM 49 CA LYS A 49 276.046 238.147 243.538 1.00 0.00 C +ATOM 50 CA THR A 50 278.519 235.774 245.203 1.00 0.00 C +ATOM 51 CA LYS A 51 281.143 237.857 247.017 1.00 0.00 C +ATOM 52 CA ALA A 52 283.019 239.615 244.205 1.00 0.00 C +ATOM 53 CA PRO A 53 286.378 241.406 244.048 1.00 0.00 C +ATOM 54 CA ALA A 54 290.127 241.620 243.401 1.00 0.00 C +ATOM 55 CA ALA A 55 291.311 245.083 242.343 1.00 0.00 C +ATOM 56 CA ASN A 56 289.115 246.887 239.805 1.00 0.00 C +ATOM 57 CA GLY A 57 285.444 246.379 240.690 1.00 0.00 C +ATOM 58 CA ARG A 58 282.820 247.924 242.980 1.00 0.00 C +ATOM 59 CA TRP A 59 281.577 251.429 243.805 1.00 0.00 C +ATOM 60 CA ALA A 60 277.816 252.029 243.909 1.00 0.00 C +ATOM 61 CA ALA A 61 275.350 254.765 242.936 1.00 0.00 C +ATOM 62 CA ALA A 62 274.914 258.242 244.431 1.00 0.00 C +ATOM 63 CA VAL A 63 273.036 260.694 246.662 1.00 0.00 C +ATOM 64 CA SER A 64 270.169 262.239 244.685 1.00 0.00 C +ATOM 65 CA PRO A 65 267.955 265.194 243.745 1.00 0.00 C +ATOM 66 CA GLY A 66 269.302 267.652 241.165 1.00 0.00 C +ATOM 67 CA ARG A 67 266.931 268.560 238.324 1.00 0.00 C +ATOM 68 CA ARG A 68 263.317 267.796 239.259 1.00 0.00 C +ATOM 69 CA ALA A 69 259.633 268.740 239.038 1.00 0.00 C +ATOM 70 CA THR A 70 256.725 270.656 240.585 1.00 0.00 C +ATOM 71 CA THR A 71 257.890 274.169 241.489 1.00 0.00 C +ATOM 72 CA ARG A 72 261.365 274.704 240.021 1.00 0.00 C +ATOM 73 CA GLY A 73 264.702 276.290 240.951 1.00 0.00 C +ATOM 74 CA ASP A 74 266.859 276.822 244.046 1.00 0.00 C +ATOM 75 CA GLY A 75 264.662 277.424 247.099 1.00 0.00 C +ATOM 76 CA VAL A 76 261.110 276.226 247.781 1.00 0.00 C +ATOM 77 CA TYR A 77 258.470 277.719 250.088 1.00 0.00 C +ATOM 78 CA THR A 78 256.260 280.287 251.831 1.00 0.00 C +ATOM 79 CA GLY A 79 252.576 280.456 252.789 1.00 0.00 C +ATOM 80 CA MET A 80 251.301 276.867 252.685 1.00 0.00 C +ATOM 81 CA THR A 81 251.874 273.408 251.194 1.00 0.00 C +ATOM 82 CA ARG A 82 254.435 271.692 248.955 1.00 0.00 C +ATOM 83 CA GLU A 83 257.587 270.395 247.254 1.00 0.00 C +ATOM 84 CA ASN A 84 257.469 266.834 245.905 1.00 0.00 C +ATOM 85 CA GLU A 85 253.858 265.621 245.829 1.00 0.00 C +ATOM 86 CA ARG A 86 251.856 263.196 243.678 1.00 0.00 C +ATOM 87 CA GLU A 87 248.851 264.258 241.590 1.00 0.00 C +ATOM 88 CA ARG A 88 245.552 262.951 242.975 1.00 0.00 C +ATOM 89 CA ALA A 89 242.592 263.332 240.607 1.00 0.00 C +ATOM 90 CA ASN A 90 240.692 260.698 238.616 1.00 0.00 C +ATOM 91 CA GLY A 91 240.261 256.962 238.005 1.00 0.00 C +ATOM 92 CA LEU A 92 239.859 253.184 238.290 1.00 0.00 C +ATOM 93 CA ASP A 93 240.391 249.412 238.304 1.00 0.00 C +ATOM 94 CA SER A 94 243.796 248.798 236.709 1.00 0.00 C +ATOM 95 CA PRO A 95 246.797 248.585 239.046 1.00 0.00 C +ATOM 96 CA GLU A 96 249.493 249.177 241.674 1.00 0.00 C +ATOM 97 CA GLY A 97 252.550 251.444 241.837 1.00 0.00 C +ATOM 98 CA ALA A 98 252.268 255.202 241.279 1.00 0.00 C +ATOM 99 CA ARG A 99 255.515 257.020 242.095 1.00 0.00 C +ATOM 100 CA ARG A 100 257.737 255.138 244.553 1.00 0.00 C +ATOM 101 CA ARG A 101 260.863 253.963 242.720 1.00 0.00 C +ATOM 102 CA ARG A 102 263.897 253.230 240.535 1.00 0.00 C +ATOM 103 CA ILE A 103 265.445 256.387 239.067 1.00 0.00 C +ATOM 104 CA ALA A 104 265.952 258.815 241.959 1.00 0.00 C +ATOM 105 CA ALA A 105 264.006 260.468 244.787 1.00 0.00 C +ATOM 106 CA ALA A 106 262.805 262.721 247.615 1.00 0.00 C +ATOM 107 CA ALA A 107 263.116 266.369 248.669 1.00 0.00 C +ATOM 108 CA THR A 108 263.660 269.670 246.845 1.00 0.00 C +ATOM 109 CA GLY A 109 267.061 270.903 248.041 1.00 0.00 C +ATOM 110 CA GLY A 110 270.089 273.108 248.738 1.00 0.00 C +ATOM 111 CA GLU A 111 273.048 271.524 250.541 1.00 0.00 C +ATOM 112 CA GLU A 112 273.243 267.935 251.805 1.00 0.00 C +ATOM 113 CA ARG A 113 271.596 264.655 252.827 1.00 0.00 C +ATOM 114 CA GLY A 114 270.330 261.125 252.149 1.00 0.00 C +ATOM 115 CA LYS A 115 271.573 257.524 252.208 1.00 0.00 C +ATOM 116 CA ARG A 116 271.888 255.227 255.231 1.00 0.00 C +ATOM 117 CA ARG A 117 272.666 252.507 257.783 1.00 0.00 C +ATOM 118 CA ARG A 118 270.804 250.789 260.629 1.00 0.00 C +ATOM 119 CA GLY A 119 269.621 247.323 261.680 1.00 0.00 C +ATOM 120 CA HIS A 120 269.370 246.438 265.377 1.00 0.00 C +ATOM 121 CA GLU A 121 266.252 248.270 266.574 1.00 0.00 C +ATOM 122 CA GLY A 122 263.179 249.942 268.084 1.00 0.00 C +ATOM 123 CA PRO A 123 259.698 251.446 267.719 1.00 0.00 C +ATOM 124 CA ILE A 124 256.597 251.079 265.535 1.00 0.00 C +ATOM 125 CA PRO A 125 252.818 250.877 265.096 1.00 0.00 C +ATOM 126 CA GLY A 126 250.381 253.462 263.718 1.00 0.00 C +ATOM 127 CA GLY A 127 248.815 255.591 266.462 1.00 0.00 C +ATOM 128 CA GLU A 128 247.280 253.467 269.228 1.00 0.00 C +ATOM 129 CA SER A 129 244.457 250.956 268.740 1.00 0.00 C +ATOM 130 CA ILE A 130 240.683 250.533 268.428 1.00 0.00 C +ATOM 131 CA TYR A 131 239.017 252.153 271.447 1.00 0.00 C +ATOM 132 CA ALA A 132 240.655 251.233 274.762 1.00 0.00 C +ATOM 133 CA ALA A 133 239.759 252.610 278.200 1.00 0.00 C +ATOM 134 CA THR A 134 238.665 254.187 281.491 1.00 0.00 C +ATOM 135 CA GLY A 135 236.788 256.215 284.114 1.00 0.00 C +ATOM 136 CA ILE A 136 233.194 254.971 284.343 1.00 0.00 C +ATOM 137 CA HIS A 137 229.428 254.600 283.904 1.00 0.00 C +ATOM 138 CA PRO A 138 227.174 256.624 281.593 1.00 0.00 C +ATOM 139 CA LEU A 139 226.977 260.410 281.212 1.00 0.00 C +ATOM 140 CA ARG A 140 227.146 262.143 277.823 1.00 0.00 C +ATOM 141 CA ARG A 141 223.897 263.825 276.757 1.00 0.00 C +ATOM 142 CA ILE A 142 220.896 265.142 274.813 1.00 0.00 C +ATOM 143 CA ARG A 143 217.487 264.454 273.257 1.00 0.00 C +ATOM 144 CA ARG A 144 214.162 262.944 272.171 1.00 0.00 C +ATOM 145 CA SER A 145 211.351 262.804 274.738 1.00 0.00 C +ATOM 146 CA TYR A 146 211.090 260.352 277.643 1.00 0.00 C +ATOM 147 CA ALA A 147 207.600 259.088 278.504 1.00 0.00 C +ATOM 148 CA GLN A 148 205.421 262.161 279.074 1.00 0.00 C +ATOM 149 CA ARG A 149 201.751 261.984 278.068 1.00 0.00 C +ATOM 150 CA GLY A 150 198.616 263.590 279.519 1.00 0.00 C +ATOM 151 CA ARG A 151 196.345 265.139 276.881 1.00 0.00 C +ATOM 152 CA ARG A 152 194.560 267.452 274.435 1.00 0.00 C +ATOM 153 CA ARG A 153 192.487 265.211 272.155 1.00 0.00 C +ATOM 154 CA GLU A 154 191.308 262.884 269.378 1.00 0.00 C +ATOM 155 CA ALA A 155 193.542 259.832 268.918 1.00 0.00 C +ATOM 156 CA LEU A 156 195.956 259.182 271.793 1.00 0.00 C +ATOM 157 CA SER A 157 199.700 258.485 271.667 1.00 0.00 C +ATOM 158 CA SER A 158 200.728 255.854 274.223 1.00 0.00 C +ATOM 159 CA SER A 159 201.799 252.378 275.357 1.00 0.00 C +ATOM 160 CA GLY A 160 201.376 248.864 276.768 1.00 0.00 C +ATOM 161 CA GLY A 161 200.997 246.635 279.834 1.00 0.00 C +ATOM 162 CA ASP A 162 200.217 245.428 283.362 1.00 0.00 C +ATOM 163 CA GLY A 163 199.899 246.902 286.861 1.00 0.00 C +ATOM 164 CA GLY A 164 201.547 249.917 288.508 1.00 0.00 C +ATOM 165 CA GLU A 165 199.940 253.251 287.605 1.00 0.00 C +ATOM 166 CA HIS A 166 201.717 255.239 284.883 1.00 0.00 C +ATOM 167 CA THR A 167 202.092 259.030 284.843 1.00 0.00 C +ATOM 168 CA ALA A 168 205.038 261.396 285.332 1.00 0.00 C +ATOM 169 CA SER A 169 207.867 259.881 287.385 1.00 0.00 C +ATOM 170 CA GLY A 170 210.749 258.464 289.436 1.00 0.00 C +ATOM 171 CA GLY A 171 209.871 255.525 291.695 1.00 0.00 C +ATOM 172 CA SER A 172 211.998 252.468 292.497 1.00 0.00 C +ATOM 173 CA SER A 173 212.384 249.031 294.097 1.00 0.00 C +ATOM 174 CA ARG A 174 213.138 246.614 291.250 1.00 0.00 C +ATOM 175 CA GLY A 175 214.866 246.675 287.855 1.00 0.00 C +ATOM 176 CA GLY A 176 214.589 247.466 284.138 1.00 0.00 C +ATOM 177 CA ALA A 177 216.002 247.288 280.604 1.00 0.00 C +ATOM 178 CA SER A 178 217.113 247.533 276.968 1.00 0.00 C +TER 179 SER A 178 +END diff --git a/Plants/Q8S1Q1/Q8S1Q1.dcd b/Plants/Q8S1Q1/Q8S1Q1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..dfb94fc4d6c18885aaf005f1d01911a814fe44b9 --- /dev/null +++ b/Plants/Q8S1Q1/Q8S1Q1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:21e48fa334f21e98df1141b5f9dcfacb1340f25e4d7063c74792da08ccf5fc54 +size 40260276 diff --git a/Plants/Q8S1Q1/top.pdb b/Plants/Q8S1Q1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..49f07a12684dfdc78305e0247d84304eb1ab395b --- /dev/null +++ b/Plants/Q8S1Q1/top.pdb @@ -0,0 +1,221 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 260.475 266.228 297.393 1.00 0.00 C +ATOM 2 CA PHE A 2 261.640 269.220 299.443 1.00 0.00 C +ATOM 3 CA ILE A 3 264.887 268.939 301.417 1.00 0.00 C +ATOM 4 CA ALA A 4 264.353 267.937 305.054 1.00 0.00 C +ATOM 5 CA SER A 5 263.160 264.331 305.358 1.00 0.00 C +ATOM 6 CA ALA A 6 259.943 264.000 303.345 1.00 0.00 C +ATOM 7 CA GLU A 7 257.151 266.590 303.484 1.00 0.00 C +ATOM 8 CA GLY A 8 254.846 266.918 306.499 1.00 0.00 C +ATOM 9 CA GLU A 9 251.725 269.105 306.486 1.00 0.00 C +ATOM 10 CA GLY A 10 248.419 270.978 306.761 1.00 0.00 C +ATOM 11 CA ALA A 11 245.940 270.455 303.916 1.00 0.00 C +ATOM 12 CA ARG A 12 247.056 271.856 300.553 1.00 0.00 C +ATOM 13 CA THR A 13 249.424 269.507 298.711 1.00 0.00 C +ATOM 14 CA GLY A 14 249.077 267.061 295.810 1.00 0.00 C +ATOM 15 CA SER A 15 246.908 265.091 293.376 1.00 0.00 C +ATOM 16 CA THR A 16 243.784 267.169 292.713 1.00 0.00 C +ATOM 17 CA GLY A 17 241.045 266.870 290.082 1.00 0.00 C +ATOM 18 CA VAL A 18 237.262 267.288 290.258 1.00 0.00 C +ATOM 19 CA GLY A 19 235.870 268.440 286.904 1.00 0.00 C +ATOM 20 CA PRO A 20 232.651 267.741 284.988 1.00 0.00 C +ATOM 21 CA THR A 21 229.771 265.251 284.845 1.00 0.00 C +ATOM 22 CA ARG A 22 227.801 264.277 281.733 1.00 0.00 C +ATOM 23 CA GLN A 23 228.518 266.287 278.577 1.00 0.00 C +ATOM 24 CA PRO A 24 230.542 269.502 278.291 1.00 0.00 C +ATOM 25 CA LEU A 25 230.201 272.449 280.682 1.00 0.00 C +ATOM 26 CA GLY A 26 230.741 276.173 281.278 1.00 0.00 C +ATOM 27 CA PRO A 27 234.148 277.075 279.830 1.00 0.00 C +ATOM 28 CA ARG A 28 237.460 277.389 277.973 1.00 0.00 C +ATOM 29 CA TRP A 29 241.075 276.229 277.662 1.00 0.00 C +ATOM 30 CA THR A 30 243.998 273.815 278.044 1.00 0.00 C +ATOM 31 CA GLY A 31 247.590 275.012 278.472 1.00 0.00 C +ATOM 32 CA SER A 32 250.513 273.722 280.548 1.00 0.00 C +ATOM 33 CA THR A 33 253.827 274.031 282.402 1.00 0.00 C +ATOM 34 CA ARG A 34 257.077 272.955 280.730 1.00 0.00 C +ATOM 35 CA LEU A 35 260.784 272.318 280.124 1.00 0.00 C +ATOM 36 CA ALA A 36 263.073 275.354 279.878 1.00 0.00 C +ATOM 37 CA ALA A 37 264.189 278.557 278.142 1.00 0.00 C +ATOM 38 CA VAL A 38 262.514 281.894 278.898 1.00 0.00 C +ATOM 39 CA GLY A 39 264.870 284.854 279.353 1.00 0.00 C +ATOM 40 CA ALA A 40 264.578 287.480 276.608 1.00 0.00 C +ATOM 41 CA PRO A 41 260.944 287.687 275.482 1.00 0.00 C +ATOM 42 CA ARG A 42 257.167 287.289 275.787 1.00 0.00 C +ATOM 43 CA GLY A 43 254.382 285.283 274.133 1.00 0.00 C +ATOM 44 CA ALA A 44 253.179 282.602 271.708 1.00 0.00 C +ATOM 45 CA PRO A 45 254.105 278.908 271.811 1.00 0.00 C +ATOM 46 CA GLU A 46 255.059 275.617 273.478 1.00 0.00 C +ATOM 47 CA GLY A 47 251.782 273.680 273.641 1.00 0.00 C +ATOM 48 CA GLY A 48 250.393 270.394 274.979 1.00 0.00 C +ATOM 49 CA LEU A 49 251.635 267.000 273.775 1.00 0.00 C +ATOM 50 CA ALA A 50 250.429 263.586 274.960 1.00 0.00 C +ATOM 51 CA GLY A 51 250.640 260.618 272.580 1.00 0.00 C +ATOM 52 CA ALA A 52 248.638 257.623 271.340 1.00 0.00 C +ATOM 53 CA ALA A 53 247.950 254.991 274.008 1.00 0.00 C +ATOM 54 CA GLU A 54 247.608 256.379 277.540 1.00 0.00 C +ATOM 55 CA GLY A 55 245.046 259.188 277.291 1.00 0.00 C +ATOM 56 CA ARG A 56 243.381 260.862 280.282 1.00 0.00 C +ATOM 57 CA GLY A 57 240.475 259.022 281.920 1.00 0.00 C +ATOM 58 CA THR A 58 238.637 256.212 280.119 1.00 0.00 C +ATOM 59 CA ARG A 59 235.967 255.024 282.564 1.00 0.00 C +ATOM 60 CA PRO A 60 235.345 252.562 285.404 1.00 0.00 C +ATOM 61 CA ARG A 61 235.079 252.625 289.204 1.00 0.00 C +ATOM 62 CA PRO A 62 233.142 252.902 292.474 1.00 0.00 C +ATOM 63 CA ASP A 63 230.768 255.878 292.619 1.00 0.00 C +ATOM 64 CA GLY A 64 227.297 254.550 291.780 1.00 0.00 C +ATOM 65 CA HIS A 65 224.012 253.686 290.055 1.00 0.00 C +ATOM 66 CA ARG A 66 224.838 253.543 286.338 1.00 0.00 C +ATOM 67 CA ARG A 67 227.036 251.505 283.987 1.00 0.00 C +ATOM 68 CA ARG A 68 229.011 251.337 280.733 1.00 0.00 C +ATOM 69 CA PRO A 69 232.497 250.301 279.596 1.00 0.00 C +ATOM 70 CA PRO A 70 233.282 246.664 278.777 1.00 0.00 C +ATOM 71 CA ALA A 71 234.010 242.927 278.614 1.00 0.00 C +ATOM 72 CA ARG A 72 231.556 240.614 276.842 1.00 0.00 C +ATOM 73 CA ARG A 73 230.606 238.349 273.930 1.00 0.00 C +ATOM 74 CA SER A 74 227.363 236.355 274.080 1.00 0.00 C +ATOM 75 CA GLY A 75 224.050 234.933 275.314 1.00 0.00 C +ATOM 76 CA THR A 76 220.423 236.026 274.909 1.00 0.00 C +ATOM 77 CA ARG A 77 217.823 234.666 277.340 1.00 0.00 C +ATOM 78 CA GLU A 78 215.408 232.006 276.072 1.00 0.00 C +ATOM 79 CA ARG A 79 213.689 230.414 279.077 1.00 0.00 C +ATOM 80 CA GLY A 80 210.835 228.588 280.819 1.00 0.00 C +ATOM 81 CA GLY A 81 209.959 227.336 284.309 1.00 0.00 C +ATOM 82 CA LYS A 82 213.097 226.845 286.414 1.00 0.00 C +ATOM 83 CA GLY A 83 216.375 228.718 285.901 1.00 0.00 C +ATOM 84 CA GLU A 84 218.833 229.932 283.255 1.00 0.00 C +ATOM 85 CA ALA A 85 221.861 229.116 281.092 1.00 0.00 C +ATOM 86 CA ARG A 86 223.905 227.614 278.249 1.00 0.00 C +ATOM 87 CA GLY A 87 227.637 227.416 278.989 1.00 0.00 C +ATOM 88 CA THR A 88 228.285 229.209 282.289 1.00 0.00 C +ATOM 89 CA VAL A 89 231.580 229.620 284.156 1.00 0.00 C +ATOM 90 CA PHE A 90 234.417 230.247 281.691 1.00 0.00 C +ATOM 91 CA GLY A 91 237.022 230.984 279.010 1.00 0.00 C +ATOM 92 CA SER A 92 238.261 227.849 277.235 1.00 0.00 C +ATOM 93 CA PRO A 93 241.377 227.690 275.048 1.00 0.00 C +ATOM 94 CA ARG A 94 240.135 226.181 271.778 1.00 0.00 C +ATOM 95 CA SER A 95 239.081 223.216 269.630 1.00 0.00 C +ATOM 96 CA THR A 96 237.032 220.013 269.865 1.00 0.00 C +ATOM 97 CA ALA A 97 237.347 217.041 267.502 1.00 0.00 C +ATOM 98 CA THR A 98 236.610 213.426 266.551 1.00 0.00 C +ATOM 99 CA THR A 99 234.830 210.395 268.021 1.00 0.00 C +ATOM 100 CA GLY A 100 232.015 207.830 267.912 1.00 0.00 C +ATOM 101 CA THR A 101 228.414 208.264 269.079 1.00 0.00 C +ATOM 102 CA ALA A 102 226.029 206.055 267.092 1.00 0.00 C +ATOM 103 CA ALA A 103 223.631 208.194 265.045 1.00 0.00 C +ATOM 104 CA GLU A 104 222.448 210.178 262.015 1.00 0.00 C +ATOM 105 CA ALA A 105 225.384 210.399 259.597 1.00 0.00 C +ATOM 106 CA GLU A 106 225.213 213.881 258.061 1.00 0.00 C +ATOM 107 CA GLU A 107 226.806 217.105 256.801 1.00 0.00 C +ATOM 108 CA GLY A 108 229.964 219.192 256.368 1.00 0.00 C +ATOM 109 CA GLY A 109 232.882 216.826 257.005 1.00 0.00 C +ATOM 110 CA GLY A 110 236.512 216.821 255.849 1.00 0.00 C +ATOM 111 CA ALA A 111 238.423 219.971 256.819 1.00 0.00 C +ATOM 112 CA VAL A 112 239.528 221.783 253.655 1.00 0.00 C +ATOM 113 CA ARG A 113 238.322 222.773 250.179 1.00 0.00 C +ATOM 114 CA ASP A 114 240.202 224.081 247.134 1.00 0.00 C +ATOM 115 CA ASP A 115 238.771 224.757 243.669 1.00 0.00 C +ATOM 116 CA ASP A 116 237.746 225.766 240.140 1.00 0.00 C +ATOM 117 CA ASP A 117 240.169 224.984 237.306 1.00 0.00 C +ATOM 118 CA ASP A 118 241.094 227.022 234.222 1.00 0.00 C +ATOM 119 CA GLY A 119 243.460 227.569 231.286 1.00 0.00 C +ATOM 120 CA ALA A 120 245.222 230.941 231.490 1.00 0.00 C +ATOM 121 CA PRO A 121 246.479 234.537 231.524 1.00 0.00 C +ATOM 122 CA ALA A 122 247.535 235.559 228.009 1.00 0.00 C +ATOM 123 CA VAL A 123 251.113 234.801 226.940 1.00 0.00 C +ATOM 124 CA GLY A 124 254.499 236.391 226.217 1.00 0.00 C +ATOM 125 CA GLY A 125 255.285 239.794 224.695 1.00 0.00 C +ATOM 126 CA ARG A 126 256.983 242.792 223.068 1.00 0.00 C +ATOM 127 CA ASN A 127 255.182 244.578 220.226 1.00 0.00 C +ATOM 128 CA GLY A 128 254.361 243.869 216.574 1.00 0.00 C +ATOM 129 CA ASP A 129 251.000 243.100 214.952 1.00 0.00 C +ATOM 130 CA ALA A 130 248.236 241.022 216.552 1.00 0.00 C +ATOM 131 CA ASP A 131 247.315 237.981 218.655 1.00 0.00 C +ATOM 132 CA GLY A 132 243.665 237.014 219.165 1.00 0.00 C +ATOM 133 CA VAL A 133 241.139 237.880 221.882 1.00 0.00 C +ATOM 134 CA ASP A 134 239.521 241.117 223.074 1.00 0.00 C +ATOM 135 CA GLY A 135 238.571 243.737 225.672 1.00 0.00 C +ATOM 136 CA ASN A 136 241.650 245.893 226.293 1.00 0.00 C +ATOM 137 CA ALA A 137 243.468 248.144 223.814 1.00 0.00 C +ATOM 138 CA ALA A 138 245.180 247.580 220.457 1.00 0.00 C +ATOM 139 CA LYS A 139 246.134 247.746 216.773 1.00 0.00 C +ATOM 140 CA PRO A 140 243.841 249.752 214.485 1.00 0.00 C +ATOM 141 CA MET A 141 242.022 248.150 211.546 1.00 0.00 C +ATOM 142 CA GLU A 142 241.243 244.562 212.565 1.00 0.00 C +ATOM 143 CA VAL A 143 238.897 242.043 210.932 1.00 0.00 C +ATOM 144 CA THR A 144 240.177 239.050 208.952 1.00 0.00 C +ATOM 145 CA PRO A 145 240.158 239.729 205.203 1.00 0.00 C +ATOM 146 CA ARG A 146 238.258 242.554 203.493 1.00 0.00 C +ATOM 147 CA ARG A 147 239.246 243.182 199.867 1.00 0.00 C +ATOM 148 CA GLU A 148 240.007 240.968 196.861 1.00 0.00 C +ATOM 149 CA GLU A 149 243.077 239.217 195.439 1.00 0.00 C +ATOM 150 CA ASP A 150 246.336 241.192 195.440 1.00 0.00 C +ATOM 151 CA ARG A 151 246.245 243.445 192.370 1.00 0.00 C +ATOM 152 CA SER A 152 249.186 245.855 192.616 1.00 0.00 C +ATOM 153 CA ASP A 153 251.978 248.189 193.743 1.00 0.00 C +ATOM 154 CA ASP A 154 254.717 247.536 196.309 1.00 0.00 C +ATOM 155 CA GLY A 155 258.513 247.668 196.612 1.00 0.00 C +ATOM 156 CA GLY A 156 260.024 247.743 200.108 1.00 0.00 C +ATOM 157 CA GLU A 157 260.439 247.093 203.840 1.00 0.00 C +ATOM 158 CA THR A 158 261.710 244.631 206.455 1.00 0.00 C +ATOM 159 CA GLU A 159 262.876 246.527 209.547 1.00 0.00 C +ATOM 160 CA LEU A 160 260.710 245.156 212.366 1.00 0.00 C +ATOM 161 CA GLY A 161 260.495 245.089 216.169 1.00 0.00 C +ATOM 162 CA GLY A 162 263.532 243.553 217.882 1.00 0.00 C +ATOM 163 CA ASP A 163 263.406 240.906 220.620 1.00 0.00 C +ATOM 164 CA GLY A 164 262.465 239.996 224.199 1.00 0.00 C +ATOM 165 CA GLY A 165 263.375 238.875 227.725 1.00 0.00 C +ATOM 166 CA GLU A 166 265.083 235.533 228.379 1.00 0.00 C +ATOM 167 CA ARG A 167 268.498 234.392 227.135 1.00 0.00 C +ATOM 168 CA GLY A 168 271.211 231.876 228.045 1.00 0.00 C +ATOM 169 CA ALA A 169 274.652 232.212 226.445 1.00 0.00 C +ATOM 170 CA ARG A 170 276.166 233.666 223.266 1.00 0.00 C +ATOM 171 CA ARG A 171 274.611 235.083 220.089 1.00 0.00 C +ATOM 172 CA GLU A 172 270.847 235.674 220.080 1.00 0.00 C +ATOM 173 CA HIS A 173 268.314 236.201 217.284 1.00 0.00 C +ATOM 174 CA GLU A 174 269.025 237.743 213.873 1.00 0.00 C +ATOM 175 CA SER A 175 269.376 241.518 213.498 1.00 0.00 C +ATOM 176 CA ASP A 176 272.537 243.062 214.960 1.00 0.00 C +ATOM 177 CA GLY A 177 272.260 246.365 216.837 1.00 0.00 C +ATOM 178 CA LYS A 178 274.829 246.422 219.650 1.00 0.00 C +ATOM 179 CA SER A 179 277.161 248.852 221.430 1.00 0.00 C +ATOM 180 CA GLU A 180 277.729 247.556 224.968 1.00 0.00 C +ATOM 181 CA ARG A 181 279.758 244.665 226.396 1.00 0.00 C +ATOM 182 CA ARG A 182 282.188 241.976 227.572 1.00 0.00 C +ATOM 183 CA ALA A 183 284.439 243.598 230.184 1.00 0.00 C +ATOM 184 CA ALA A 184 286.017 246.561 228.384 1.00 0.00 C +ATOM 185 CA GLU A 185 288.512 248.721 226.479 1.00 0.00 C +ATOM 186 CA THR A 186 289.144 249.520 222.807 1.00 0.00 C +ATOM 187 CA GLU A 187 289.362 251.722 219.705 1.00 0.00 C +ATOM 188 CA GLU A 188 288.288 255.366 219.995 1.00 0.00 C +ATOM 189 CA ARG A 189 290.924 257.829 221.217 1.00 0.00 C +ATOM 190 CA SER A 190 290.136 259.294 224.645 1.00 0.00 C +ATOM 191 CA SER A 191 288.213 262.394 225.746 1.00 0.00 C +ATOM 192 CA GLY A 192 288.187 265.859 227.330 1.00 0.00 C +ATOM 193 CA ILE A 193 288.266 269.654 227.002 1.00 0.00 C +ATOM 194 CA ASP A 194 286.015 271.461 229.488 1.00 0.00 C +ATOM 195 CA PHE A 195 284.242 269.986 232.521 1.00 0.00 C +ATOM 196 CA ILE A 196 283.570 266.243 232.748 1.00 0.00 C +ATOM 197 CA ALA A 197 280.725 265.039 230.519 1.00 0.00 C +ATOM 198 CA PRO A 198 282.068 264.458 227.001 1.00 0.00 C +ATOM 199 CA ARG A 199 280.801 266.601 224.117 1.00 0.00 C +ATOM 200 CA GLY A 200 279.210 266.826 220.662 1.00 0.00 C +ATOM 201 CA GLY A 201 275.702 265.897 219.503 1.00 0.00 C +ATOM 202 CA GLU A 202 272.864 268.397 219.041 1.00 0.00 C +ATOM 203 CA ARG A 203 269.544 270.253 218.816 1.00 0.00 C +ATOM 204 CA GLY A 204 268.302 269.618 215.270 1.00 0.00 C +ATOM 205 CA ARG A 205 267.052 269.282 211.687 1.00 0.00 C +ATOM 206 CA ARG A 206 267.197 268.004 208.100 1.00 0.00 C +ATOM 207 CA GLY A 207 265.049 266.725 205.226 1.00 0.00 C +ATOM 208 CA ARG A 208 262.641 269.303 203.786 1.00 0.00 C +ATOM 209 CA LYS A 209 260.641 267.417 201.148 1.00 0.00 C +ATOM 210 CA ARG A 210 259.457 268.860 197.826 1.00 0.00 C +ATOM 211 CA PRO A 211 259.634 272.654 197.533 1.00 0.00 C +ATOM 212 CA ARG A 212 260.960 276.224 197.643 1.00 0.00 C +ATOM 213 CA ARG A 213 261.742 279.677 199.051 1.00 0.00 C +ATOM 214 CA SER A 214 262.927 279.831 202.669 1.00 0.00 C +ATOM 215 CA ARG A 215 262.353 280.116 206.425 1.00 0.00 C +ATOM 216 CA LEU A 216 262.136 279.736 210.209 1.00 0.00 C +ATOM 217 CA HIS A 217 264.932 277.898 212.032 1.00 0.00 C +TER 218 HIS A 217 +END diff --git a/Plants/Q8S262/Q8S262.dcd b/Plants/Q8S262/Q8S262.dcd new file mode 100644 index 0000000000000000000000000000000000000000..751820c1216a8ba2ff1f77ba1211bd5356bb2643 --- /dev/null +++ b/Plants/Q8S262/Q8S262.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c268ef41db5495b9f4349dfb8e963eb19a937eaedd7ed8de6dbdac96c803cec4 +size 13040276 diff --git a/Plants/Q8S262/top.pdb b/Plants/Q8S262/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..27e637afc18926c9469822433622cec0cb8c8be7 --- /dev/null +++ b/Plants/Q8S262/top.pdb @@ -0,0 +1,106 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 258.991 289.319 246.880 1.00 0.00 C +ATOM 2 CA THR A 2 256.171 288.737 249.374 1.00 0.00 C +ATOM 3 CA THR A 3 255.242 285.363 250.882 1.00 0.00 C +ATOM 4 CA PRO A 4 257.452 282.282 251.254 1.00 0.00 C +ATOM 5 CA SER A 5 255.535 279.503 253.020 1.00 0.00 C +ATOM 6 CA ALA A 6 253.877 278.853 256.388 1.00 0.00 C +ATOM 7 CA ILE A 7 251.305 276.047 256.219 1.00 0.00 C +ATOM 8 CA LEU A 8 248.566 273.472 256.838 1.00 0.00 C +ATOM 9 CA SER A 9 247.541 269.802 256.864 1.00 0.00 C +ATOM 10 CA LEU A 10 249.255 268.058 253.943 1.00 0.00 C +ATOM 11 CA SER A 11 249.089 265.822 250.862 1.00 0.00 C +ATOM 12 CA LEU A 12 250.284 264.836 247.381 1.00 0.00 C +ATOM 13 CA SER A 13 251.552 265.660 243.884 1.00 0.00 C +ATOM 14 CA GLY A 14 253.171 265.426 240.443 1.00 0.00 C +ATOM 15 CA GLY A 15 252.479 267.162 237.123 1.00 0.00 C +ATOM 16 CA ASP A 16 249.713 269.781 237.183 1.00 0.00 C +ATOM 17 CA GLY A 17 249.591 272.411 234.428 1.00 0.00 C +ATOM 18 CA GLN A 18 247.936 272.894 231.030 1.00 0.00 C +ATOM 19 CA GLY A 19 244.841 274.309 229.318 1.00 0.00 C +ATOM 20 CA ASP A 20 244.377 272.814 225.845 1.00 0.00 C +ATOM 21 CA THR A 21 245.445 274.232 222.474 1.00 0.00 C +ATOM 22 CA GLN A 22 246.291 276.723 219.718 1.00 0.00 C +ATOM 23 CA ASP A 23 249.732 275.628 218.504 1.00 0.00 C +ATOM 24 CA LEU A 24 250.062 271.994 217.408 1.00 0.00 C +ATOM 25 CA ALA A 25 251.158 269.679 220.228 1.00 0.00 C +ATOM 26 CA GLU A 26 252.287 266.376 218.702 1.00 0.00 C +ATOM 27 CA GLY A 27 250.289 263.133 218.813 1.00 0.00 C +ATOM 28 CA GLY A 28 249.882 261.731 222.332 1.00 0.00 C +ATOM 29 CA ARG A 29 247.293 259.908 224.450 1.00 0.00 C +ATOM 30 CA GLY A 30 246.912 259.919 228.241 1.00 0.00 C +ATOM 31 CA GLU A 31 247.098 260.482 232.004 1.00 0.00 C +ATOM 32 CA GLY A 32 245.832 261.975 235.273 1.00 0.00 C +ATOM 33 CA GLY A 33 245.061 263.490 238.683 1.00 0.00 C +ATOM 34 CA GLY A 34 242.614 266.378 239.114 1.00 0.00 C +ATOM 35 CA ARG A 35 239.015 265.264 238.549 1.00 0.00 C +ATOM 36 CA ARG A 36 237.312 263.798 235.472 1.00 0.00 C +ATOM 37 CA TRP A 37 234.926 261.225 233.988 1.00 0.00 C +ATOM 38 CA PHE A 38 234.921 257.415 233.969 1.00 0.00 C +ATOM 39 CA PRO A 39 237.164 254.800 232.341 1.00 0.00 C +ATOM 40 CA SER A 40 240.743 253.837 233.223 1.00 0.00 C +ATOM 41 CA LEU A 41 243.466 256.033 234.733 1.00 0.00 C +ATOM 42 CA PRO A 42 244.687 255.295 238.266 1.00 0.00 C +ATOM 43 CA ASP A 43 247.997 256.930 239.209 1.00 0.00 C +ATOM 44 CA LEU A 44 251.727 256.295 239.659 1.00 0.00 C +ATOM 45 CA VAL A 45 254.930 254.558 240.769 1.00 0.00 C +ATOM 46 CA LYS A 46 253.838 251.160 242.103 1.00 0.00 C +ATOM 47 CA GLY A 47 250.692 249.039 242.452 1.00 0.00 C +ATOM 48 CA ARG A 48 248.316 246.970 240.309 1.00 0.00 C +ATOM 49 CA PRO A 49 246.956 243.537 241.249 1.00 0.00 C +ATOM 50 CA GLY A 50 246.188 241.513 244.384 1.00 0.00 C +ATOM 51 CA GLU A 51 244.691 242.233 247.813 1.00 0.00 C +ATOM 52 CA GLY A 52 241.787 241.531 250.177 1.00 0.00 C +ATOM 53 CA SER A 53 238.048 241.944 250.784 1.00 0.00 C +ATOM 54 CA GLY A 54 234.648 242.307 252.463 1.00 0.00 C +ATOM 55 CA GLY A 55 233.126 238.885 253.165 1.00 0.00 C +ATOM 56 CA GLY A 56 229.617 238.763 254.646 1.00 0.00 C +ATOM 57 CA GLY A 57 228.869 236.524 257.637 1.00 0.00 C +ATOM 58 CA GLY A 58 228.451 237.697 261.237 1.00 0.00 C +ATOM 59 CA SER A 59 227.440 237.203 264.877 1.00 0.00 C +ATOM 60 CA PRO A 60 230.080 235.439 266.983 1.00 0.00 C +ATOM 61 CA PRO A 61 233.416 236.349 268.584 1.00 0.00 C +ATOM 62 CA SER A 62 234.011 236.165 272.343 1.00 0.00 C +ATOM 63 CA GLN A 63 232.823 234.078 275.300 1.00 0.00 C +ATOM 64 CA ILE A 64 235.228 232.690 277.909 1.00 0.00 C +ATOM 65 CA ARG A 65 234.156 230.069 280.459 1.00 0.00 C +ATOM 66 CA PRO A 66 233.953 226.266 280.361 1.00 0.00 C +ATOM 67 CA GLU A 67 237.176 224.338 281.004 1.00 0.00 C +ATOM 68 CA GLY A 68 240.011 221.870 280.383 1.00 0.00 C +ATOM 69 CA GLY A 69 242.421 219.081 279.419 1.00 0.00 C +ATOM 70 CA ARG A 70 246.102 218.928 280.390 1.00 0.00 C +ATOM 71 CA GLY A 71 249.910 218.965 280.253 1.00 0.00 C +ATOM 72 CA ARG A 72 252.292 218.698 283.214 1.00 0.00 C +ATOM 73 CA ALA A 73 254.830 219.179 286.015 1.00 0.00 C +ATOM 74 CA ALA A 74 257.211 221.417 287.974 1.00 0.00 C +ATOM 75 CA ALA A 75 259.116 224.360 286.482 1.00 0.00 C +ATOM 76 CA VAL A 76 258.523 225.505 282.897 1.00 0.00 C +ATOM 77 CA ALA A 77 258.729 229.215 282.051 1.00 0.00 C +ATOM 78 CA ALA A 78 259.194 232.200 279.730 1.00 0.00 C +ATOM 79 CA VAL A 79 258.621 233.465 276.182 1.00 0.00 C +ATOM 80 CA PRO A 80 259.813 231.134 273.415 1.00 0.00 C +ATOM 81 CA LEU A 81 257.747 228.443 271.681 1.00 0.00 C +ATOM 82 CA PRO A 82 257.512 227.703 267.951 1.00 0.00 C +ATOM 83 CA LEU A 83 260.523 229.471 266.426 1.00 0.00 C +ATOM 84 CA ARG A 84 262.911 231.034 263.902 1.00 0.00 C +ATOM 85 CA SER A 85 262.435 232.018 260.252 1.00 0.00 C +ATOM 86 CA GLY A 86 260.369 233.334 257.334 1.00 0.00 C +ATOM 87 CA ARG A 87 258.007 232.147 254.590 1.00 0.00 C +ATOM 88 CA ARG A 88 259.554 231.220 251.233 1.00 0.00 C +ATOM 89 CA GLU A 89 261.199 231.744 247.837 1.00 0.00 C +ATOM 90 CA ALA A 90 264.726 233.149 248.153 1.00 0.00 C +ATOM 91 CA GLY A 91 267.504 235.419 249.437 1.00 0.00 C +ATOM 92 CA GLY A 92 269.741 236.923 246.745 1.00 0.00 C +ATOM 93 CA GLY A 93 270.987 238.960 243.776 1.00 0.00 C +ATOM 94 CA GLN A 94 269.346 242.337 243.131 1.00 0.00 C +ATOM 95 CA TRP A 95 270.473 245.965 242.834 1.00 0.00 C +ATOM 96 CA ARG A 96 268.814 248.781 240.877 1.00 0.00 C +ATOM 97 CA GLN A 97 270.287 252.295 240.874 1.00 0.00 C +ATOM 98 CA GLN A 98 268.765 255.327 239.140 1.00 0.00 C +ATOM 99 CA ARG A 99 267.123 257.472 236.453 1.00 0.00 C +ATOM 100 CA PRO A 100 265.316 257.621 233.102 1.00 0.00 C +ATOM 101 CA HIS A 101 261.636 256.650 233.275 1.00 0.00 C +ATOM 102 CA HIS A 102 260.933 253.622 231.072 1.00 0.00 C +TER 103 HIS A 102 +END diff --git a/Plants/Q8S2Q9/Q8S2Q9.dcd b/Plants/Q8S2Q9/Q8S2Q9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..e8b16587d29069a13818bcbe18a9d2db5bd9aa63 --- /dev/null +++ b/Plants/Q8S2Q9/Q8S2Q9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:687e9d701f8c9d8a958cff7e8004a9bf706c83111a2e3c54161545fbdb6bc621 +size 7040276 diff --git a/Plants/Q8S2Q9/top.pdb b/Plants/Q8S2Q9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..41f78b3bde679f19d935b5e0beed6adfbebdfa27 --- /dev/null +++ b/Plants/Q8S2Q9/top.pdb @@ -0,0 +1,56 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 255.945 236.283 286.533 1.00 0.00 C +ATOM 2 CA THR A 2 252.177 236.197 285.979 1.00 0.00 C +ATOM 3 CA ARG A 3 248.759 234.596 285.463 1.00 0.00 C +ATOM 4 CA GLY A 4 246.493 231.559 285.058 1.00 0.00 C +ATOM 5 CA ARG A 5 247.091 228.812 282.487 1.00 0.00 C +ATOM 6 CA GLN A 6 249.774 227.427 280.163 1.00 0.00 C +ATOM 7 CA PRO A 7 248.039 225.047 277.745 1.00 0.00 C +ATOM 8 CA TYR A 8 249.254 225.560 274.171 1.00 0.00 C +ATOM 9 CA ARG A 9 247.234 227.224 271.402 1.00 0.00 C +ATOM 10 CA GLY A 10 247.752 230.862 270.397 1.00 0.00 C +ATOM 11 CA GLY A 11 246.605 232.223 267.028 1.00 0.00 C +ATOM 12 CA GLY A 12 247.839 229.889 264.280 1.00 0.00 C +ATOM 13 CA ARG A 13 251.229 228.179 263.972 1.00 0.00 C +ATOM 14 CA PRO A 14 253.655 230.847 262.742 1.00 0.00 C +ATOM 15 CA VAL A 15 255.790 233.899 261.938 1.00 0.00 C +ATOM 16 CA GLY A 16 257.310 233.095 258.538 1.00 0.00 C +ATOM 17 CA GLU A 17 255.623 234.201 255.306 1.00 0.00 C +ATOM 18 CA VAL A 18 256.471 235.575 251.855 1.00 0.00 C +ATOM 19 CA ASP A 19 255.792 239.275 251.252 1.00 0.00 C +ATOM 20 CA LEU A 20 258.106 240.291 248.401 1.00 0.00 C +ATOM 21 CA GLY A 21 260.985 242.665 249.170 1.00 0.00 C +ATOM 22 CA GLY A 22 264.272 244.211 250.319 1.00 0.00 C +ATOM 23 CA SER A 23 267.869 245.435 250.595 1.00 0.00 C +ATOM 24 CA GLY A 24 269.891 248.321 249.146 1.00 0.00 C +ATOM 25 CA SER A 25 269.850 250.891 246.334 1.00 0.00 C +ATOM 26 CA ALA A 26 267.511 249.998 243.462 1.00 0.00 C +ATOM 27 CA GLY A 27 263.970 251.404 243.520 1.00 0.00 C +ATOM 28 CA PRO A 28 262.579 250.739 247.005 1.00 0.00 C +ATOM 29 CA THR A 29 259.568 248.444 247.430 1.00 0.00 C +ATOM 30 CA ASN A 30 256.180 249.133 245.828 1.00 0.00 C +ATOM 31 CA GLY A 31 255.421 247.718 242.373 1.00 0.00 C +ATOM 32 CA VAL A 32 254.992 250.285 239.591 1.00 0.00 C +ATOM 33 CA ALA A 33 251.682 251.676 238.314 1.00 0.00 C +ATOM 34 CA ALA A 34 247.926 251.274 237.817 1.00 0.00 C +ATOM 35 CA SER A 35 246.195 250.162 241.024 1.00 0.00 C +ATOM 36 CA GLN A 36 244.592 252.634 243.440 1.00 0.00 C +ATOM 37 CA LEU A 37 244.349 256.419 243.080 1.00 0.00 C +ATOM 38 CA ALA A 38 243.927 259.968 241.759 1.00 0.00 C +ATOM 39 CA LYS A 39 241.891 261.928 239.203 1.00 0.00 C +ATOM 40 CA LEU A 40 239.462 264.587 237.960 1.00 0.00 C +ATOM 41 CA SER A 41 236.452 265.856 235.999 1.00 0.00 C +ATOM 42 CA ARG A 42 236.264 268.714 233.486 1.00 0.00 C +ATOM 43 CA GLY A 43 237.708 270.463 230.425 1.00 0.00 C +ATOM 44 CA LYS A 44 241.093 269.747 228.830 1.00 0.00 C +ATOM 45 CA GLY A 45 242.645 273.086 227.851 1.00 0.00 C +ATOM 46 CA ALA A 46 241.093 276.417 226.847 1.00 0.00 C +ATOM 47 CA GLU A 47 238.942 279.454 226.029 1.00 0.00 C +ATOM 48 CA GLN A 48 240.895 281.830 223.781 1.00 0.00 C +ATOM 49 CA CYS A 49 239.863 285.471 224.224 1.00 0.00 C +ATOM 50 CA LYS A 50 236.311 286.717 224.812 1.00 0.00 C +ATOM 51 CA ILE A 51 233.289 285.410 226.730 1.00 0.00 C +ATOM 52 CA LYS A 52 231.395 287.902 228.902 1.00 0.00 C +TER 53 LYS A 52 +END diff --git a/Plants/Q8S2Z1/Q8S2Z1.dcd b/Plants/Q8S2Z1/Q8S2Z1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..023aef1b3424f8593b4182cc860d579c649b3f4d --- /dev/null +++ b/Plants/Q8S2Z1/Q8S2Z1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:715615a821f5eb41417e6098b6b3267841fc58def57cd2f34d6ef4a9a464f1c4 +size 4640276 diff --git a/Plants/Q8S2Z1/top.pdb b/Plants/Q8S2Z1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..f40677df344a33a8cf648920f4da08a29363ccc9 --- /dev/null +++ b/Plants/Q8S2Z1/top.pdb @@ -0,0 +1,36 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA ALA A 1 261.000 225.620 250.663 1.00 0.00 C +ATOM 2 CA ASP A 2 261.958 227.831 247.712 1.00 0.00 C +ATOM 3 CA GLN A 3 263.580 229.070 244.495 1.00 0.00 C +ATOM 4 CA LEU A 4 266.089 228.167 241.774 1.00 0.00 C +ATOM 5 CA ASP A 5 268.562 230.991 241.118 1.00 0.00 C +ATOM 6 CA HIS A 6 269.072 233.257 244.138 1.00 0.00 C +ATOM 7 CA ALA A 7 269.918 236.657 245.634 1.00 0.00 C +ATOM 8 CA LYS A 8 267.329 239.240 246.701 1.00 0.00 C +ATOM 9 CA ALA A 9 264.224 240.623 244.978 1.00 0.00 C +ATOM 10 CA ARG A 10 261.696 242.075 242.526 1.00 0.00 C +ATOM 11 CA LEU A 11 259.195 244.361 244.268 1.00 0.00 C +ATOM 12 CA ALA A 12 256.976 245.392 247.189 1.00 0.00 C +ATOM 13 CA SER A 13 253.829 247.046 248.557 1.00 0.00 C +ATOM 14 CA LYS A 14 251.588 249.771 249.995 1.00 0.00 C +ATOM 15 CA ALA A 15 251.151 250.843 253.625 1.00 0.00 C +ATOM 16 CA ARG A 16 252.653 254.282 254.288 1.00 0.00 C +ATOM 17 CA ASP A 17 252.458 256.628 251.292 1.00 0.00 C +ATOM 18 CA ILE A 18 251.033 260.154 251.067 1.00 0.00 C +ATOM 19 CA LYS A 19 248.654 262.853 249.812 1.00 0.00 C +ATOM 20 CA ASP A 20 248.358 265.841 252.157 1.00 0.00 C +ATOM 21 CA ALA A 21 247.722 268.574 254.733 1.00 0.00 C +ATOM 22 CA ALA A 22 245.245 271.005 256.305 1.00 0.00 C +ATOM 23 CA GLN A 23 241.954 269.761 257.769 1.00 0.00 C +ATOM 24 CA HIS A 24 240.239 266.421 257.119 1.00 0.00 C +ATOM 25 CA ARG A 25 237.509 263.778 256.839 1.00 0.00 C +ATOM 26 CA ILE A 26 234.255 262.179 258.010 1.00 0.00 C +ATOM 27 CA ASP A 27 232.110 260.881 255.141 1.00 0.00 C +ATOM 28 CA GLN A 28 231.120 257.224 254.741 1.00 0.00 C +ATOM 29 CA ALA A 29 229.491 254.507 252.624 1.00 0.00 C +ATOM 30 CA GLN A 30 229.479 251.391 250.432 1.00 0.00 C +ATOM 31 CA GLY A 31 227.646 252.158 247.181 1.00 0.00 C +ATOM 32 CA SER A 32 223.909 251.417 247.118 1.00 0.00 C +TER 33 SER A 32 +END diff --git a/Plants/Q8S5E3/Q8S5E3.dcd b/Plants/Q8S5E3/Q8S5E3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..dbf149422ccf5d129e6ff0afe81db00a98af7251 --- /dev/null +++ b/Plants/Q8S5E3/Q8S5E3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:0ef70e9528756c33a940dd159392aa069d33b863dc8a9d985e7ab6d35ab47c2a +size 13760276 diff --git a/Plants/Q8S5E3/top.pdb b/Plants/Q8S5E3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..cf589d9ab4a271cbbb027e9e384ffc44d7d49e38 --- /dev/null +++ b/Plants/Q8S5E3/top.pdb @@ -0,0 +1,112 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 297.607 261.973 213.934 1.00 0.00 C +ATOM 2 CA GLU A 2 296.311 259.081 211.818 1.00 0.00 C +ATOM 3 CA GLY A 3 292.966 259.585 210.066 1.00 0.00 C +ATOM 4 CA ARG A 4 290.361 256.824 210.402 1.00 0.00 C +ATOM 5 CA GLY A 5 286.598 256.876 210.997 1.00 0.00 C +ATOM 6 CA GLY A 6 284.657 259.942 212.158 1.00 0.00 C +ATOM 7 CA GLY A 7 286.363 261.524 215.175 1.00 0.00 C +ATOM 8 CA GLY A 8 285.947 259.552 218.409 1.00 0.00 C +ATOM 9 CA LEU A 9 286.838 261.003 221.817 1.00 0.00 C +ATOM 10 CA PRO A 10 286.303 264.658 222.751 1.00 0.00 C +ATOM 11 CA THR A 11 284.395 267.455 221.004 1.00 0.00 C +ATOM 12 CA ALA A 12 281.686 269.894 222.113 1.00 0.00 C +ATOM 13 CA THR A 13 279.201 271.870 220.007 1.00 0.00 C +ATOM 14 CA ALA A 14 277.959 273.832 216.986 1.00 0.00 C +ATOM 15 CA ALA A 15 274.641 273.711 215.117 1.00 0.00 C +ATOM 16 CA THR A 16 271.471 271.599 215.177 1.00 0.00 C +ATOM 17 CA ALA A 17 267.849 271.864 216.331 1.00 0.00 C +ATOM 18 CA THR A 18 264.932 274.307 216.135 1.00 0.00 C +ATOM 19 CA ALA A 19 262.165 273.486 218.621 1.00 0.00 C +ATOM 20 CA ALA A 20 260.204 274.481 221.733 1.00 0.00 C +ATOM 21 CA GLN A 21 257.123 273.230 223.594 1.00 0.00 C +ATOM 22 CA GLY A 22 256.512 269.482 223.296 1.00 0.00 C +ATOM 23 CA GLY A 23 258.304 266.424 224.693 1.00 0.00 C +ATOM 24 CA ASP A 24 260.825 265.655 227.445 1.00 0.00 C +ATOM 25 CA ALA A 25 262.942 267.625 229.926 1.00 0.00 C +ATOM 26 CA ARG A 26 266.145 265.676 230.602 1.00 0.00 C +ATOM 27 CA ARG A 27 269.818 264.864 231.210 1.00 0.00 C +ATOM 28 CA GLY A 28 270.700 262.176 228.657 1.00 0.00 C +ATOM 29 CA GLY A 29 268.529 259.761 226.665 1.00 0.00 C +ATOM 30 CA SER A 30 266.322 261.476 224.075 1.00 0.00 C +ATOM 31 CA GLY A 31 262.870 259.888 224.350 1.00 0.00 C +ATOM 32 CA ALA A 32 259.710 260.491 222.309 1.00 0.00 C +ATOM 33 CA THR A 33 256.825 259.150 224.407 1.00 0.00 C +ATOM 34 CA VAL A 34 256.964 255.694 226.004 1.00 0.00 C +ATOM 35 CA ARG A 35 257.356 253.036 228.705 1.00 0.00 C +ATOM 36 CA ARG A 36 256.848 249.260 228.651 1.00 0.00 C +ATOM 37 CA LEU A 37 253.841 247.372 227.270 1.00 0.00 C +ATOM 38 CA ARG A 38 250.367 245.985 227.994 1.00 0.00 C +ATOM 39 CA ARG A 39 250.460 242.208 228.486 1.00 0.00 C +ATOM 40 CA ARG A 40 251.630 239.982 231.348 1.00 0.00 C +ATOM 41 CA GLN A 41 252.337 240.501 235.055 1.00 0.00 C +ATOM 42 CA ARG A 42 250.069 241.162 238.044 1.00 0.00 C +ATOM 43 CA GLY A 43 248.576 243.911 240.220 1.00 0.00 C +ATOM 44 CA GLY A 44 244.876 244.170 239.352 1.00 0.00 C +ATOM 45 CA THR A 45 242.588 246.043 241.755 1.00 0.00 C +ATOM 46 CA THR A 46 242.963 244.669 245.288 1.00 0.00 C +ATOM 47 CA THR A 47 244.621 243.579 248.540 1.00 0.00 C +ATOM 48 CA ALA A 48 244.644 240.607 250.925 1.00 0.00 C +ATOM 49 CA ALA A 49 246.585 238.024 252.944 1.00 0.00 C +ATOM 50 CA ARG A 50 245.164 236.089 255.903 1.00 0.00 C +ATOM 51 CA GLY A 51 245.397 233.078 258.226 1.00 0.00 C +ATOM 52 CA GLU A 52 245.059 229.687 256.522 1.00 0.00 C +ATOM 53 CA GLY A 53 241.406 228.605 256.522 1.00 0.00 C +ATOM 54 CA GLY A 54 239.494 231.717 255.438 1.00 0.00 C +ATOM 55 CA GLU A 55 238.425 235.289 254.654 1.00 0.00 C +ATOM 56 CA GLY A 56 237.395 238.856 253.799 1.00 0.00 C +ATOM 57 CA GLU A 57 238.647 242.411 253.239 1.00 0.00 C +ATOM 58 CA GLU A 58 237.736 243.824 249.820 1.00 0.00 C +ATOM 59 CA GLU A 59 237.005 246.349 247.062 1.00 0.00 C +ATOM 60 CA GLY A 60 239.358 249.303 246.556 1.00 0.00 C +ATOM 61 CA MET A 61 237.959 252.110 248.721 1.00 0.00 C +ATOM 62 CA GLU A 62 240.378 252.299 251.658 1.00 0.00 C +ATOM 63 CA TRP A 63 244.065 252.285 252.619 1.00 0.00 C +ATOM 64 CA GLY A 64 246.922 251.933 255.114 1.00 0.00 C +ATOM 65 CA GLU A 65 246.670 248.780 257.239 1.00 0.00 C +ATOM 66 CA ARG A 66 244.310 248.695 260.228 1.00 0.00 C +ATOM 67 CA GLY A 67 244.087 246.121 263.028 1.00 0.00 C +ATOM 68 CA LYS A 68 241.413 243.444 263.482 1.00 0.00 C +ATOM 69 CA LYS A 69 242.870 240.174 264.786 1.00 0.00 C +ATOM 70 CA GLU A 70 246.504 240.314 265.920 1.00 0.00 C +ATOM 71 CA ARG A 71 247.469 237.811 268.625 1.00 0.00 C +ATOM 72 CA GLY A 72 250.349 239.477 270.482 1.00 0.00 C +ATOM 73 CA ARG A 73 250.719 238.095 274.013 1.00 0.00 C +ATOM 74 CA GLY A 74 249.397 235.661 276.630 1.00 0.00 C +ATOM 75 CA GLY A 75 246.220 236.755 278.426 1.00 0.00 C +ATOM 76 CA ARG A 76 242.594 236.303 277.348 1.00 0.00 C +ATOM 77 CA PRO A 77 239.274 236.778 279.156 1.00 0.00 C +ATOM 78 CA ASP A 78 237.693 233.506 280.300 1.00 0.00 C +ATOM 79 CA VAL A 79 234.791 232.991 277.885 1.00 0.00 C +ATOM 80 CA THR A 80 234.778 233.481 274.107 1.00 0.00 C +ATOM 81 CA ALA A 81 237.687 232.902 271.716 1.00 0.00 C +ATOM 82 CA ALA A 82 238.925 231.448 268.418 1.00 0.00 C +ATOM 83 CA ARG A 83 238.287 232.591 264.840 1.00 0.00 C +ATOM 84 CA GLY A 84 240.282 234.555 262.255 1.00 0.00 C +ATOM 85 CA SER A 85 239.036 237.583 260.308 1.00 0.00 C +ATOM 86 CA GLY A 86 236.324 240.207 259.784 1.00 0.00 C +ATOM 87 CA ARG A 87 234.269 240.741 262.947 1.00 0.00 C +ATOM 88 CA ARG A 88 233.968 243.730 265.291 1.00 0.00 C +ATOM 89 CA ARG A 89 236.384 244.696 268.074 1.00 0.00 C +ATOM 90 CA ASP A 90 238.179 242.216 270.342 1.00 0.00 C +ATOM 91 CA SER A 91 240.531 242.813 273.280 1.00 0.00 C +ATOM 92 CA GLY A 92 242.156 245.044 275.907 1.00 0.00 C +ATOM 93 CA ASP A 93 242.011 247.654 278.678 1.00 0.00 C +ATOM 94 CA GLY A 94 240.492 249.968 281.296 1.00 0.00 C +ATOM 95 CA ASP A 95 239.091 249.176 284.749 1.00 0.00 C +ATOM 96 CA GLY A 96 235.427 248.247 285.229 1.00 0.00 C +ATOM 97 CA ALA A 97 233.410 250.562 282.973 1.00 0.00 C +ATOM 98 CA ARG A 98 230.326 252.581 282.010 1.00 0.00 C +ATOM 99 CA ARG A 99 227.094 253.099 283.960 1.00 0.00 C +ATOM 100 CA GLN A 100 224.098 252.949 286.310 1.00 0.00 C +ATOM 101 CA THR A 101 222.441 255.778 288.249 1.00 0.00 C +ATOM 102 CA ALA A 102 220.521 256.894 291.345 1.00 0.00 C +ATOM 103 CA THR A 103 218.334 254.369 293.177 1.00 0.00 C +ATOM 104 CA ALA A 104 216.522 251.020 293.282 1.00 0.00 C +ATOM 105 CA THR A 105 214.112 248.524 291.707 1.00 0.00 C +ATOM 106 CA ALA A 106 213.013 244.900 291.292 1.00 0.00 C +ATOM 107 CA ARG A 107 211.228 243.788 294.469 1.00 0.00 C +ATOM 108 CA GLY A 108 212.504 244.122 298.044 1.00 0.00 C +TER 109 GLY A 108 +END diff --git a/Plants/Q8S5F0/Q8S5F0.dcd b/Plants/Q8S5F0/Q8S5F0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..632b01dd13d425e9a96fd49211e6774dcfa30513 --- /dev/null +++ b/Plants/Q8S5F0/Q8S5F0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:1f70dbae85dac36672be722927d42241c9b31f445b3fd6061903715d28409e3d +size 20720276 diff --git a/Plants/Q8S5F0/top.pdb b/Plants/Q8S5F0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..5368ccb8b828df3902e8333d48d58f05e592cc29 --- /dev/null +++ b/Plants/Q8S5F0/top.pdb @@ -0,0 +1,170 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 276.160 218.626 293.789 1.00 0.00 C +ATOM 2 CA ARG A 2 273.925 221.219 292.116 1.00 0.00 C +ATOM 3 CA ALA A 3 276.112 224.224 291.276 1.00 0.00 C +ATOM 4 CA PRO A 4 274.243 227.242 289.894 1.00 0.00 C +ATOM 5 CA HIS A 5 274.481 228.038 286.176 1.00 0.00 C +ATOM 6 CA GLY A 6 276.724 225.654 284.225 1.00 0.00 C +ATOM 7 CA SER A 7 280.407 226.208 285.029 1.00 0.00 C +ATOM 8 CA ASP A 8 282.792 224.023 287.041 1.00 0.00 C +ATOM 9 CA SER A 9 285.107 221.265 288.287 1.00 0.00 C +ATOM 10 CA GLY A 10 288.754 222.238 287.767 1.00 0.00 C +ATOM 11 CA GLY A 11 291.741 224.091 286.297 1.00 0.00 C +ATOM 12 CA GLY A 12 294.420 226.690 285.533 1.00 0.00 C +ATOM 13 CA PRO A 13 296.923 229.134 287.042 1.00 0.00 C +ATOM 14 CA ARG A 14 299.558 231.464 285.578 1.00 0.00 C +ATOM 15 CA TRP A 15 301.302 234.851 285.607 1.00 0.00 C +ATOM 16 CA SER A 16 304.306 236.045 283.590 1.00 0.00 C +ATOM 17 CA GLY A 17 304.294 239.699 282.510 1.00 0.00 C +ATOM 18 CA SER A 18 305.566 240.386 278.985 1.00 0.00 C +ATOM 19 CA THR A 19 304.438 241.397 275.489 1.00 0.00 C +ATOM 20 CA ASP A 20 304.832 244.888 274.016 1.00 0.00 C +ATOM 21 CA ARG A 21 301.378 246.494 274.087 1.00 0.00 C +ATOM 22 CA GLU A 22 299.294 246.119 270.920 1.00 0.00 C +ATOM 23 CA ARG A 23 296.140 244.486 269.542 1.00 0.00 C +ATOM 24 CA GLY A 24 292.399 244.865 268.925 1.00 0.00 C +ATOM 25 CA SER A 25 288.991 245.640 267.409 1.00 0.00 C +ATOM 26 CA ALA A 26 285.778 247.508 266.570 1.00 0.00 C +ATOM 27 CA PRO A 27 284.234 245.910 263.474 1.00 0.00 C +ATOM 28 CA ARG A 28 282.462 242.566 263.040 1.00 0.00 C +ATOM 29 CA GLY A 29 280.449 239.668 264.476 1.00 0.00 C +ATOM 30 CA ALA A 30 276.791 239.210 263.512 1.00 0.00 C +ATOM 31 CA ASP A 31 276.507 239.610 259.734 1.00 0.00 C +ATOM 32 CA VAL A 32 276.090 237.925 256.342 1.00 0.00 C +ATOM 33 CA ALA A 33 276.359 236.573 252.790 1.00 0.00 C +ATOM 34 CA PRO A 34 273.568 238.209 250.777 1.00 0.00 C +ATOM 35 CA THR A 35 270.678 236.010 249.624 1.00 0.00 C +ATOM 36 CA ARG A 36 271.070 232.258 249.090 1.00 0.00 C +ATOM 37 CA ARG A 37 271.230 228.631 247.936 1.00 0.00 C +ATOM 38 CA PRO A 38 270.047 226.765 244.832 1.00 0.00 C +ATOM 39 CA ARG A 39 267.064 226.211 242.528 1.00 0.00 C +ATOM 40 CA GLY A 40 267.757 223.113 240.420 1.00 0.00 C +ATOM 41 CA SER A 41 265.587 223.009 237.290 1.00 0.00 C +ATOM 42 CA HIS A 42 264.129 224.637 234.169 1.00 0.00 C +ATOM 43 CA ALA A 43 262.338 227.027 231.804 1.00 0.00 C +ATOM 44 CA GLY A 44 261.130 229.867 234.039 1.00 0.00 C +ATOM 45 CA ASP A 45 257.883 230.052 236.024 1.00 0.00 C +ATOM 46 CA ARG A 46 254.485 231.069 234.634 1.00 0.00 C +ATOM 47 CA THR A 47 251.524 230.918 237.027 1.00 0.00 C +ATOM 48 CA ASP A 48 248.955 230.741 239.835 1.00 0.00 C +ATOM 49 CA GLY A 49 246.634 233.224 241.557 1.00 0.00 C +ATOM 50 CA PRO A 50 246.863 237.005 241.144 1.00 0.00 C +ATOM 51 CA ASP A 51 245.631 240.198 239.470 1.00 0.00 C +ATOM 52 CA PRO A 52 248.036 242.314 237.408 1.00 0.00 C +ATOM 53 CA LEU A 53 247.505 245.608 235.567 1.00 0.00 C +ATOM 54 CA GLY A 54 244.612 247.331 237.350 1.00 0.00 C +ATOM 55 CA VAL A 55 240.823 247.342 237.750 1.00 0.00 C +ATOM 56 CA ASP A 56 238.179 247.344 240.493 1.00 0.00 C +ATOM 57 CA GLY A 57 238.282 246.279 244.150 1.00 0.00 C +ATOM 58 CA TRP A 58 240.287 247.586 247.114 1.00 0.00 C +ATOM 59 CA ARG A 59 238.432 248.170 250.390 1.00 0.00 C +ATOM 60 CA ARG A 60 237.059 250.892 252.675 1.00 0.00 C +ATOM 61 CA ARG A 61 233.693 250.214 254.325 1.00 0.00 C +ATOM 62 CA ARG A 62 231.146 248.256 252.277 1.00 0.00 C +ATOM 63 CA HIS A 63 231.876 247.595 248.597 1.00 0.00 C +ATOM 64 CA ALA A 64 231.686 244.476 246.417 1.00 0.00 C +ATOM 65 CA ALA A 65 229.382 242.693 243.962 1.00 0.00 C +ATOM 66 CA GLY A 66 226.100 240.917 244.728 1.00 0.00 C +ATOM 67 CA ALA A 67 223.287 239.335 242.704 1.00 0.00 C +ATOM 68 CA HIS A 68 222.928 236.583 240.093 1.00 0.00 C +ATOM 69 CA GLY A 69 221.758 235.367 236.677 1.00 0.00 C +ATOM 70 CA ARG A 70 222.715 231.827 235.641 1.00 0.00 C +ATOM 71 CA LEU A 71 219.612 229.652 235.244 1.00 0.00 C +ATOM 72 CA LYS A 72 218.051 228.804 231.874 1.00 0.00 C +ATOM 73 CA LEU A 73 216.832 231.030 229.031 1.00 0.00 C +ATOM 74 CA THR A 74 217.323 234.783 229.464 1.00 0.00 C +ATOM 75 CA ARG A 75 219.905 235.756 226.837 1.00 0.00 C +ATOM 76 CA TRP A 76 223.711 235.738 227.020 1.00 0.00 C +ATOM 77 CA PRO A 77 224.820 236.930 230.465 1.00 0.00 C +ATOM 78 CA TRP A 78 227.181 236.977 233.454 1.00 0.00 C +ATOM 79 CA SER A 79 228.684 239.872 235.424 1.00 0.00 C +ATOM 80 CA ALA A 80 228.256 243.650 235.184 1.00 0.00 C +ATOM 81 CA ALA A 81 228.266 247.383 234.421 1.00 0.00 C +ATOM 82 CA ALA A 82 225.838 250.087 235.566 1.00 0.00 C +ATOM 83 CA ARG A 83 224.433 252.509 232.982 1.00 0.00 C +ATOM 84 CA ARG A 84 225.494 254.646 230.011 1.00 0.00 C +ATOM 85 CA ASP A 85 227.419 256.523 227.312 1.00 0.00 C +ATOM 86 CA ALA A 86 230.879 255.062 226.675 1.00 0.00 C +ATOM 87 CA THR A 87 233.532 252.738 228.117 1.00 0.00 C +ATOM 88 CA ALA A 88 235.938 251.077 225.673 1.00 0.00 C +ATOM 89 CA THR A 89 239.365 251.052 227.336 1.00 0.00 C +ATOM 90 CA GLN A 90 243.035 251.150 228.356 1.00 0.00 C +ATOM 91 CA GLY A 91 245.551 248.747 226.802 1.00 0.00 C +ATOM 92 CA GLY A 92 248.794 246.764 226.541 1.00 0.00 C +ATOM 93 CA GLU A 93 249.351 244.674 229.678 1.00 0.00 C +ATOM 94 CA ARG A 94 252.696 242.878 229.993 1.00 0.00 C +ATOM 95 CA PRO A 95 254.778 243.870 233.025 1.00 0.00 C +ATOM 96 CA MET A 96 257.995 245.218 234.560 1.00 0.00 C +ATOM 97 CA ALA A 97 257.228 247.722 237.328 1.00 0.00 C +ATOM 98 CA GLY A 98 256.017 247.383 240.924 1.00 0.00 C +ATOM 99 CA SER A 99 252.709 248.974 241.946 1.00 0.00 C +ATOM 100 CA GLY A 100 250.843 251.893 243.531 1.00 0.00 C +ATOM 101 CA GLY A 101 249.411 255.118 244.970 1.00 0.00 C +ATOM 102 CA ASP A 102 251.165 258.108 243.389 1.00 0.00 C +ATOM 103 CA ARG A 103 253.124 257.200 240.250 1.00 0.00 C +ATOM 104 CA ARG A 104 253.593 258.811 236.829 1.00 0.00 C +ATOM 105 CA ARG A 105 254.535 262.122 235.196 1.00 0.00 C +ATOM 106 CA ALA A 106 251.505 264.373 235.711 1.00 0.00 C +ATOM 107 CA ALA A 107 248.657 262.656 237.570 1.00 0.00 C +ATOM 108 CA VAL A 108 245.021 263.105 236.524 1.00 0.00 C +ATOM 109 CA HIS A 109 241.737 261.219 236.941 1.00 0.00 C +ATOM 110 CA PHE A 110 238.646 259.768 238.631 1.00 0.00 C +ATOM 111 CA GLU A 111 235.493 261.738 237.799 1.00 0.00 C +ATOM 112 CA ARG A 112 232.767 263.640 239.661 1.00 0.00 C +ATOM 113 CA ARG A 113 231.701 263.746 243.317 1.00 0.00 C +ATOM 114 CA ARG A 114 233.512 265.632 246.088 1.00 0.00 C +ATOM 115 CA HIS A 115 232.913 264.300 249.607 1.00 0.00 C +ATOM 116 CA ASP A 116 230.307 263.012 252.071 1.00 0.00 C +ATOM 117 CA SER A 117 229.387 259.390 251.329 1.00 0.00 C +ATOM 118 CA GLU A 118 227.072 256.597 250.165 1.00 0.00 C +ATOM 119 CA ARG A 119 226.367 255.147 246.714 1.00 0.00 C +ATOM 120 CA GLN A 120 228.516 252.218 245.564 1.00 0.00 C +ATOM 121 CA GLY A 121 228.203 252.224 241.767 1.00 0.00 C +ATOM 122 CA SER A 122 224.840 253.547 240.561 1.00 0.00 C +ATOM 123 CA GLY A 123 221.159 254.444 240.162 1.00 0.00 C +ATOM 124 CA ALA A 124 218.326 255.384 237.794 1.00 0.00 C +ATOM 125 CA LYS A 125 215.253 256.604 239.686 1.00 0.00 C +ATOM 126 CA ARG A 126 212.814 259.466 239.070 1.00 0.00 C +ATOM 127 CA GLU A 127 212.502 262.872 240.749 1.00 0.00 C +ATOM 128 CA ARG A 128 212.893 265.908 243.016 1.00 0.00 C +ATOM 129 CA GLU A 129 211.471 265.585 246.536 1.00 0.00 C +ATOM 130 CA LYS A 130 212.511 266.499 250.086 1.00 0.00 C +ATOM 131 CA THR A 131 215.213 268.411 251.972 1.00 0.00 C +ATOM 132 CA THR A 132 216.485 268.462 255.563 1.00 0.00 C +ATOM 133 CA GLY A 133 216.574 270.183 258.961 1.00 0.00 C +ATOM 134 CA ARG A 134 216.244 273.708 260.369 1.00 0.00 C +ATOM 135 CA CYS A 135 219.269 275.876 261.185 1.00 0.00 C +ATOM 136 CA SER A 136 222.293 276.034 258.874 1.00 0.00 C +ATOM 137 CA PRO A 137 224.847 273.217 258.626 1.00 0.00 C +ATOM 138 CA GLY A 138 228.534 273.472 257.699 1.00 0.00 C +ATOM 139 CA PHE A 139 230.374 276.490 256.277 1.00 0.00 C +ATOM 140 CA GLY A 140 230.862 280.257 255.977 1.00 0.00 C +ATOM 141 CA ARG A 141 232.347 283.539 254.737 1.00 0.00 C +ATOM 142 CA HIS A 142 236.129 283.975 254.890 1.00 0.00 C +ATOM 143 CA GLY A 143 238.655 281.151 254.492 1.00 0.00 C +ATOM 144 CA ALA A 144 240.305 279.514 251.473 1.00 0.00 C +ATOM 145 CA THR A 145 239.547 275.852 250.744 1.00 0.00 C +ATOM 146 CA ALA A 146 240.073 275.200 247.027 1.00 0.00 C +ATOM 147 CA ASN A 147 241.148 277.196 243.965 1.00 0.00 C +ATOM 148 CA GLY A 148 243.691 275.076 242.080 1.00 0.00 C +ATOM 149 CA ASP A 149 247.193 275.719 243.436 1.00 0.00 C +ATOM 150 CA GLU A 150 250.886 276.460 242.860 1.00 0.00 C +ATOM 151 CA LYS A 151 254.533 275.836 241.952 1.00 0.00 C +ATOM 152 CA ARG A 152 257.758 274.512 243.489 1.00 0.00 C +ATOM 153 CA PRO A 153 257.206 272.775 246.835 1.00 0.00 C +ATOM 154 CA ARG A 154 257.009 271.357 250.366 1.00 0.00 C +ATOM 155 CA ASP A 155 256.463 271.967 254.087 1.00 0.00 C +ATOM 156 CA ASP A 156 257.460 274.001 257.151 1.00 0.00 C +ATOM 157 CA ASP A 157 260.541 272.430 258.749 1.00 0.00 C +ATOM 158 CA GLU A 158 263.550 271.478 260.885 1.00 0.00 C +ATOM 159 CA ARG A 159 266.329 269.320 262.346 1.00 0.00 C +ATOM 160 CA ARG A 160 265.770 267.335 265.549 1.00 0.00 C +ATOM 161 CA THR A 161 263.789 265.067 267.883 1.00 0.00 C +ATOM 162 CA PHE A 162 261.425 263.112 265.622 1.00 0.00 C +ATOM 163 CA SER A 163 262.841 263.364 262.094 1.00 0.00 C +ATOM 164 CA GLY A 164 263.616 262.143 258.569 1.00 0.00 C +ATOM 165 CA THR A 165 266.257 263.483 256.172 1.00 0.00 C +ATOM 166 CA SER A 166 267.524 265.025 252.927 1.00 0.00 C +TER 167 SER A 166 +END diff --git a/Plants/Q8S5M9/Q8S5M9.dcd b/Plants/Q8S5M9/Q8S5M9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..ab052f84302797cf769c1b51fe19c3b7ecea4b19 --- /dev/null +++ b/Plants/Q8S5M9/Q8S5M9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f806b45d8d59f5f66e578939b1c9444093ba3a24357cf72439b3849c2de2db82 +size 8960276 diff --git a/Plants/Q8S5M9/top.pdb b/Plants/Q8S5M9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a6be515583dc6f563468086e86fd13dad40ea2e4 --- /dev/null +++ b/Plants/Q8S5M9/top.pdb @@ -0,0 +1,72 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 231.011 296.598 216.509 1.00 0.00 C +ATOM 2 CA ALA A 2 228.190 296.061 214.005 1.00 0.00 C +ATOM 3 CA GLY A 3 225.475 293.391 214.128 1.00 0.00 C +ATOM 4 CA GLY A 4 224.680 292.078 217.615 1.00 0.00 C +ATOM 5 CA SER A 5 223.275 289.880 220.392 1.00 0.00 C +ATOM 6 CA ARG A 6 221.556 286.553 221.090 1.00 0.00 C +ATOM 7 CA ARG A 7 222.162 285.620 224.734 1.00 0.00 C +ATOM 8 CA CYS A 8 225.306 285.623 226.885 1.00 0.00 C +ATOM 9 CA ARG A 9 225.642 283.916 230.275 1.00 0.00 C +ATOM 10 CA GLY A 10 226.006 280.123 230.265 1.00 0.00 C +ATOM 11 CA GLY A 11 226.782 277.119 232.476 1.00 0.00 C +ATOM 12 CA GLY A 12 227.540 276.604 236.174 1.00 0.00 C +ATOM 13 CA ARG A 13 228.962 273.943 238.501 1.00 0.00 C +ATOM 14 CA ARG A 14 230.169 275.235 241.875 1.00 0.00 C +ATOM 15 CA GLY A 15 228.582 273.738 244.998 1.00 0.00 C +ATOM 16 CA ALA A 16 228.341 272.922 248.712 1.00 0.00 C +ATOM 17 CA PRO A 17 230.852 274.904 250.781 1.00 0.00 C +ATOM 18 CA GLY A 18 233.097 273.867 253.679 1.00 0.00 C +ATOM 19 CA GLY A 19 231.660 272.750 257.026 1.00 0.00 C +ATOM 20 CA GLY A 20 229.399 273.170 260.064 1.00 0.00 C +ATOM 21 CA LYS A 21 228.020 270.382 262.265 1.00 0.00 C +ATOM 22 CA ALA A 22 229.630 267.136 263.443 1.00 0.00 C +ATOM 23 CA ALA A 23 233.319 266.246 263.784 1.00 0.00 C +ATOM 24 CA GLY A 24 235.150 262.961 263.172 1.00 0.00 C +ATOM 25 CA GLY A 25 236.848 262.493 259.794 1.00 0.00 C +ATOM 26 CA ALA A 26 235.857 260.541 256.676 1.00 0.00 C +ATOM 27 CA ALA A 27 236.609 257.247 254.914 1.00 0.00 C +ATOM 28 CA ARG A 28 236.007 253.797 256.414 1.00 0.00 C +ATOM 29 CA GLY A 29 236.959 251.881 259.566 1.00 0.00 C +ATOM 30 CA GLY A 30 235.553 249.311 262.002 1.00 0.00 C +ATOM 31 CA GLY A 31 236.837 247.166 264.878 1.00 0.00 C +ATOM 32 CA ARG A 32 236.902 249.343 268.004 1.00 0.00 C +ATOM 33 CA ARG A 33 240.535 249.303 269.154 1.00 0.00 C +ATOM 34 CA GLY A 34 243.064 247.556 266.903 1.00 0.00 C +ATOM 35 CA ALA A 35 245.474 249.956 265.187 1.00 0.00 C +ATOM 36 CA PRO A 36 248.654 250.906 267.059 1.00 0.00 C +ATOM 37 CA GLY A 37 250.351 247.672 268.142 1.00 0.00 C +ATOM 38 CA GLY A 38 252.102 245.076 265.972 1.00 0.00 C +ATOM 39 CA GLY A 39 253.676 242.148 264.110 1.00 0.00 C +ATOM 40 CA LYS A 40 253.599 238.823 265.969 1.00 0.00 C +ATOM 41 CA ALA A 41 254.458 236.199 268.594 1.00 0.00 C +ATOM 42 CA ALA A 42 255.921 232.683 268.470 1.00 0.00 C +ATOM 43 CA GLY A 43 258.235 231.255 265.801 1.00 0.00 C +ATOM 44 CA GLY A 44 260.064 234.108 264.061 1.00 0.00 C +ATOM 45 CA ALA A 45 258.108 236.443 261.773 1.00 0.00 C +ATOM 46 CA ALA A 46 255.347 237.068 259.222 1.00 0.00 C +ATOM 47 CA ARG A 47 255.798 234.472 256.471 1.00 0.00 C +ATOM 48 CA GLY A 48 258.580 231.870 256.577 1.00 0.00 C +ATOM 49 CA ASP A 49 260.282 229.466 254.161 1.00 0.00 C +ATOM 50 CA GLY A 50 262.270 227.047 251.989 1.00 0.00 C +ATOM 51 CA ARG A 51 265.327 224.775 251.929 1.00 0.00 C +ATOM 52 CA ARG A 52 268.501 224.189 249.904 1.00 0.00 C +ATOM 53 CA GLY A 53 271.822 224.405 251.759 1.00 0.00 C +ATOM 54 CA ARG A 54 274.604 224.895 249.203 1.00 0.00 C +ATOM 55 CA ALA A 55 275.394 222.116 246.719 1.00 0.00 C +ATOM 56 CA ARG A 56 275.187 221.556 242.956 1.00 0.00 C +ATOM 57 CA ARG A 57 273.986 218.223 241.554 1.00 0.00 C +ATOM 58 CA TRP A 58 276.923 215.868 242.139 1.00 0.00 C +ATOM 59 CA ALA A 59 279.158 213.668 239.976 1.00 0.00 C +ATOM 60 CA GLY A 60 282.884 214.448 239.825 1.00 0.00 C +ATOM 61 CA GLY A 61 284.224 215.832 243.112 1.00 0.00 C +ATOM 62 CA ARG A 62 283.672 215.761 246.881 1.00 0.00 C +ATOM 63 CA ARG A 63 286.192 217.987 248.673 1.00 0.00 C +ATOM 64 CA SER A 64 289.818 218.062 249.838 1.00 0.00 C +ATOM 65 CA GLU A 65 293.512 218.548 249.042 1.00 0.00 C +ATOM 66 CA MET A 66 294.579 222.129 248.296 1.00 0.00 C +ATOM 67 CA ASN A 67 295.203 225.332 250.263 1.00 0.00 C +ATOM 68 CA LEU A 68 296.116 227.556 253.219 1.00 0.00 C +TER 69 LEU A 68 +END diff --git a/Plants/Q8S5P4/Q8S5P4.dcd b/Plants/Q8S5P4/Q8S5P4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..17d067b8c54e0cadc0576797acc7b976a2295f82 --- /dev/null +++ b/Plants/Q8S5P4/Q8S5P4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:3642443ee9c4259a8845bfc5624673addb2f96833faee8f8793faeddd8b38263 +size 5600276 diff --git a/Plants/Q8S5P4/top.pdb b/Plants/Q8S5P4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..b4d4208bcea6175a49708d411b29b23d80673180 --- /dev/null +++ b/Plants/Q8S5P4/top.pdb @@ -0,0 +1,44 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 269.201 250.569 266.538 1.00 0.00 C +ATOM 2 CA VAL A 2 269.081 248.122 269.456 1.00 0.00 C +ATOM 3 CA GLN A 3 271.901 245.674 270.213 1.00 0.00 C +ATOM 4 CA PRO A 4 272.086 242.984 267.521 1.00 0.00 C +ATOM 5 CA THR A 5 272.389 241.669 263.958 1.00 0.00 C +ATOM 6 CA SER A 6 271.707 238.435 262.063 1.00 0.00 C +ATOM 7 CA ARG A 7 272.367 237.067 258.569 1.00 0.00 C +ATOM 8 CA TRP A 8 269.861 235.872 255.959 1.00 0.00 C +ATOM 9 CA SER A 9 269.278 237.667 252.649 1.00 0.00 C +ATOM 10 CA ALA A 10 267.897 238.774 249.275 1.00 0.00 C +ATOM 11 CA ALA A 11 266.435 238.782 245.757 1.00 0.00 C +ATOM 12 CA PRO A 12 262.832 239.747 244.980 1.00 0.00 C +ATOM 13 CA GLY A 13 260.315 238.877 242.255 1.00 0.00 C +ATOM 14 CA GLY A 14 261.425 240.264 238.884 1.00 0.00 C +ATOM 15 CA ASN A 15 263.361 243.295 237.627 1.00 0.00 C +ATOM 16 CA GLY A 16 264.855 246.373 239.304 1.00 0.00 C +ATOM 17 CA GLY A 17 263.042 248.806 241.608 1.00 0.00 C +ATOM 18 CA PHE A 18 261.429 252.200 242.238 1.00 0.00 C +ATOM 19 CA GLY A 19 258.625 253.433 239.973 1.00 0.00 C +ATOM 20 CA SER A 20 256.473 255.906 241.913 1.00 0.00 C +ATOM 21 CA SER A 21 252.773 256.584 242.519 1.00 0.00 C +ATOM 22 CA GLN A 22 252.482 260.361 242.926 1.00 0.00 C +ATOM 23 CA GLY A 23 249.370 261.558 244.771 1.00 0.00 C +ATOM 24 CA MET A 24 249.309 260.043 248.266 1.00 0.00 C +ATOM 25 CA ARG A 25 245.609 259.543 249.028 1.00 0.00 C +ATOM 26 CA THR A 26 242.399 258.873 247.090 1.00 0.00 C +ATOM 27 CA SER A 27 239.678 261.182 248.424 1.00 0.00 C +ATOM 28 CA PRO A 28 236.308 260.256 246.909 1.00 0.00 C +ATOM 29 CA ARG A 29 232.611 261.148 246.678 1.00 0.00 C +ATOM 30 CA ALA A 30 230.263 259.733 249.324 1.00 0.00 C +ATOM 31 CA ARG A 31 230.243 257.079 252.057 1.00 0.00 C +ATOM 32 CA LEU A 32 230.566 253.463 253.214 1.00 0.00 C +ATOM 33 CA PRO A 33 232.330 250.539 251.525 1.00 0.00 C +ATOM 34 CA ARG A 34 230.105 247.482 251.056 1.00 0.00 C +ATOM 35 CA GLN A 35 226.716 248.108 249.433 1.00 0.00 C +ATOM 36 CA PRO A 36 224.113 250.822 250.045 1.00 0.00 C +ATOM 37 CA ARG A 37 222.262 253.707 248.380 1.00 0.00 C +ATOM 38 CA ARG A 38 218.482 253.393 248.020 1.00 0.00 C +ATOM 39 CA ARG A 39 214.983 253.937 249.425 1.00 0.00 C +ATOM 40 CA PRO A 40 214.836 257.670 250.170 1.00 0.00 C +TER 41 PRO A 40 +END diff --git a/Plants/Q8S5Q6/Q8S5Q6.dcd b/Plants/Q8S5Q6/Q8S5Q6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..3ee92cd3a03a80e687bd3ea357c52f31f1227525 --- /dev/null +++ b/Plants/Q8S5Q6/Q8S5Q6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e92de0a2eb1790aa36982efc0a3da3ce4d7f8041bdb101ee10552d8b0237d3ec +size 51600276 diff --git a/Plants/Q8S5Q6/top.pdb b/Plants/Q8S5Q6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..73bef500c60a8ed3e3139fb0137758876e7cdf5b --- /dev/null +++ b/Plants/Q8S5Q6/top.pdb @@ -0,0 +1,284 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 254.766 266.661 253.412 1.00 0.00 C +ATOM 2 CA TRP A 2 252.730 264.184 255.469 1.00 0.00 C +ATOM 3 CA LYS A 3 249.244 265.672 255.854 1.00 0.00 C +ATOM 4 CA ALA A 4 247.429 268.582 254.193 1.00 0.00 C +ATOM 5 CA TYR A 5 244.830 271.082 255.420 1.00 0.00 C +ATOM 6 CA CYS A 6 245.848 274.743 255.690 1.00 0.00 C +ATOM 7 CA VAL A 7 245.751 278.358 254.490 1.00 0.00 C +ATOM 8 CA SER A 8 244.347 281.131 252.286 1.00 0.00 C +ATOM 9 CA ARG A 9 243.332 284.223 250.306 1.00 0.00 C +ATOM 10 CA GLY A 10 240.583 284.530 247.686 1.00 0.00 C +ATOM 11 CA GLU A 11 239.932 281.697 245.222 1.00 0.00 C +ATOM 12 CA GLY A 12 236.480 281.600 243.613 1.00 0.00 C +ATOM 13 CA ALA A 13 234.675 278.332 242.849 1.00 0.00 C +ATOM 14 CA ARG A 14 235.255 275.237 240.705 1.00 0.00 C +ATOM 15 CA GLY A 15 237.270 272.045 240.189 1.00 0.00 C +ATOM 16 CA PRO A 16 237.651 268.263 239.929 1.00 0.00 C +ATOM 17 CA GLY A 17 239.865 265.286 239.061 1.00 0.00 C +ATOM 18 CA PRO A 18 242.037 262.243 239.796 1.00 0.00 C +ATOM 19 CA ARG A 19 245.541 263.263 240.891 1.00 0.00 C +ATOM 20 CA GLU A 20 248.026 260.402 240.499 1.00 0.00 C +ATOM 21 CA TRP A 21 248.017 257.750 237.763 1.00 0.00 C +ATOM 22 CA GLY A 22 250.168 257.521 234.627 1.00 0.00 C +ATOM 23 CA PRO A 23 253.288 255.438 235.289 1.00 0.00 C +ATOM 24 CA ARG A 24 256.064 257.874 236.228 1.00 0.00 C +ATOM 25 CA GLY A 25 254.972 259.830 239.310 1.00 0.00 C +ATOM 26 CA SER A 26 256.764 262.854 240.781 1.00 0.00 C +ATOM 27 CA LEU A 27 256.973 266.496 239.684 1.00 0.00 C +ATOM 28 CA THR A 28 254.766 268.539 242.024 1.00 0.00 C +ATOM 29 CA VAL A 29 255.620 270.331 245.276 1.00 0.00 C +ATOM 30 CA HIS A 30 257.949 271.767 247.927 1.00 0.00 C +ATOM 31 CA GLY A 31 260.022 274.350 249.810 1.00 0.00 C +ATOM 32 CA GLY A 32 263.746 273.877 249.161 1.00 0.00 C +ATOM 33 CA PRO A 33 267.374 273.076 250.008 1.00 0.00 C +ATOM 34 CA GLY A 34 269.592 270.235 251.243 1.00 0.00 C +ATOM 35 CA ALA A 35 269.862 266.448 250.924 1.00 0.00 C +ATOM 36 CA PRO A 36 269.688 264.085 247.941 1.00 0.00 C +ATOM 37 CA GLY A 37 271.952 261.745 245.961 1.00 0.00 C +ATOM 38 CA LEU A 38 272.453 257.968 245.919 1.00 0.00 C +ATOM 39 CA THR A 39 271.653 255.196 243.431 1.00 0.00 C +ATOM 40 CA PRO A 40 270.638 253.020 240.472 1.00 0.00 C +ATOM 41 CA THR A 41 268.169 252.675 237.591 1.00 0.00 C +ATOM 42 CA GLY A 42 265.354 255.053 236.622 1.00 0.00 C +ATOM 43 CA ALA A 43 262.091 256.109 234.964 1.00 0.00 C +ATOM 44 CA VAL A 44 262.395 259.777 233.977 1.00 0.00 C +ATOM 45 CA GLY A 45 264.021 262.964 232.668 1.00 0.00 C +ATOM 46 CA PRO A 46 266.781 264.552 230.577 1.00 0.00 C +ATOM 47 CA THR A 47 270.265 263.193 231.305 1.00 0.00 C +ATOM 48 CA HIS A 48 270.049 259.390 231.341 1.00 0.00 C +ATOM 49 CA GLN A 49 271.419 255.854 230.969 1.00 0.00 C +ATOM 50 CA SER A 50 273.138 254.330 227.930 1.00 0.00 C +ATOM 51 CA HIS A 51 275.163 254.873 224.748 1.00 0.00 C +ATOM 52 CA PRO A 52 277.754 255.206 221.975 1.00 0.00 C +ATOM 53 CA ARG A 53 280.867 257.332 221.423 1.00 0.00 C +ATOM 54 CA ALA A 54 281.657 260.834 222.698 1.00 0.00 C +ATOM 55 CA ARG A 55 282.815 262.757 225.776 1.00 0.00 C +ATOM 56 CA ALA A 56 285.432 264.794 227.653 1.00 0.00 C +ATOM 57 CA ALA A 57 288.198 266.094 225.378 1.00 0.00 C +ATOM 58 CA ASP A 58 291.427 264.453 226.562 1.00 0.00 C +ATOM 59 CA GLY A 59 293.618 262.907 229.268 1.00 0.00 C +ATOM 60 CA ARG A 60 293.622 259.822 231.504 1.00 0.00 C +ATOM 61 CA ALA A 61 295.942 256.801 231.449 1.00 0.00 C +ATOM 62 CA PRO A 62 294.498 253.718 229.739 1.00 0.00 C +ATOM 63 CA ARG A 63 296.282 250.416 230.399 1.00 0.00 C +ATOM 64 CA GLY A 64 295.511 249.512 234.019 1.00 0.00 C +ATOM 65 CA SER A 65 296.558 247.129 236.801 1.00 0.00 C +ATOM 66 CA HIS A 66 299.420 244.706 236.126 1.00 0.00 C +ATOM 67 CA SER A 67 301.947 245.152 238.942 1.00 0.00 C +ATOM 68 CA ALA A 68 303.947 241.987 239.652 1.00 0.00 C +ATOM 69 CA ARG A 69 304.249 239.630 242.630 1.00 0.00 C +ATOM 70 CA PRO A 70 306.830 240.878 245.140 1.00 0.00 C +ATOM 71 CA ARG A 71 305.297 241.962 248.456 1.00 0.00 C +ATOM 72 CA ALA A 72 302.820 242.547 251.291 1.00 0.00 C +ATOM 73 CA ALA A 73 303.675 241.450 254.838 1.00 0.00 C +ATOM 74 CA LYS A 74 301.594 239.447 257.323 1.00 0.00 C +ATOM 75 CA PRO A 75 299.777 239.787 260.654 1.00 0.00 C +ATOM 76 CA ALA A 76 299.647 237.619 263.785 1.00 0.00 C +ATOM 77 CA GLN A 77 298.129 238.887 267.041 1.00 0.00 C +ATOM 78 CA PRO A 78 294.545 239.813 266.136 1.00 0.00 C +ATOM 79 CA ALA A 79 290.791 239.559 265.538 1.00 0.00 C +ATOM 80 CA GLY A 80 289.320 237.184 262.948 1.00 0.00 C +ATOM 81 CA GLY A 81 289.643 234.155 260.659 1.00 0.00 C +ATOM 82 CA GLY A 82 287.557 231.033 261.303 1.00 0.00 C +ATOM 83 CA ALA A 83 285.750 229.302 264.177 1.00 0.00 C +ATOM 84 CA ARG A 84 282.175 230.286 265.052 1.00 0.00 C +ATOM 85 CA ALA A 85 281.839 231.977 268.450 1.00 0.00 C +ATOM 86 CA PRO A 86 281.159 234.908 270.786 1.00 0.00 C +ATOM 87 CA MET A 87 277.777 236.004 272.157 1.00 0.00 C +ATOM 88 CA VAL A 88 277.388 234.371 275.577 1.00 0.00 C +ATOM 89 CA ALA A 89 274.370 233.925 277.859 1.00 0.00 C +ATOM 90 CA GLY A 90 271.318 232.111 276.477 1.00 0.00 C +ATOM 91 CA GLY A 91 268.655 232.314 273.760 1.00 0.00 C +ATOM 92 CA GLY A 92 265.760 232.844 271.340 1.00 0.00 C +ATOM 93 CA HIS A 93 264.510 229.527 269.941 1.00 0.00 C +ATOM 94 CA ARG A 94 261.987 227.606 267.830 1.00 0.00 C +ATOM 95 CA HIS A 95 259.880 226.735 264.778 1.00 0.00 C +ATOM 96 CA GLY A 96 258.720 228.231 261.471 1.00 0.00 C +ATOM 97 CA GLY A 97 258.088 230.569 258.530 1.00 0.00 C +ATOM 98 CA ALA A 98 257.094 229.242 255.100 1.00 0.00 C +ATOM 99 CA ALA A 99 253.464 228.367 254.343 1.00 0.00 C +ATOM 100 CA ALA A 100 251.464 225.224 255.140 1.00 0.00 C +ATOM 101 CA GLU A 101 253.318 222.202 256.534 1.00 0.00 C +ATOM 102 CA ARG A 102 256.161 219.712 257.020 1.00 0.00 C +ATOM 103 CA GLY A 103 256.634 217.388 254.038 1.00 0.00 C +ATOM 104 CA GLU A 104 259.135 218.619 251.440 1.00 0.00 C +ATOM 105 CA GLY A 105 262.208 220.334 249.981 1.00 0.00 C +ATOM 106 CA LYS A 106 261.595 220.452 246.222 1.00 0.00 C +ATOM 107 CA GLY A 107 259.288 223.086 244.721 1.00 0.00 C +ATOM 108 CA GLU A 108 259.606 226.165 246.943 1.00 0.00 C +ATOM 109 CA LYS A 109 262.106 228.921 246.127 1.00 0.00 C +ATOM 110 CA LYS A 110 261.713 229.574 242.394 1.00 0.00 C +ATOM 111 CA ARG A 111 261.001 228.214 238.907 1.00 0.00 C +ATOM 112 CA ARG A 112 261.346 228.118 235.114 1.00 0.00 C +ATOM 113 CA SER A 113 262.379 225.067 233.079 1.00 0.00 C +ATOM 114 CA THR A 114 262.501 223.434 229.639 1.00 0.00 C +ATOM 115 CA ALA A 115 263.849 221.795 226.475 1.00 0.00 C +ATOM 116 CA HIS A 116 263.617 218.690 224.279 1.00 0.00 C +ATOM 117 CA PRO A 117 266.513 217.066 222.410 1.00 0.00 C +ATOM 118 CA ARG A 118 268.391 213.886 223.348 1.00 0.00 C +ATOM 119 CA SER A 119 270.630 210.829 223.740 1.00 0.00 C +ATOM 120 CA THR A 120 269.083 207.977 225.738 1.00 0.00 C +ATOM 121 CA ALA A 121 266.220 205.838 224.419 1.00 0.00 C +ATOM 122 CA THR A 122 264.880 207.217 221.129 1.00 0.00 C +ATOM 123 CA THR A 123 264.473 206.617 217.389 1.00 0.00 C +ATOM 124 CA LYS A 124 266.287 205.950 214.106 1.00 0.00 C +ATOM 125 CA LYS A 125 263.682 205.168 211.437 1.00 0.00 C +ATOM 126 CA ALA A 126 263.094 201.407 211.289 1.00 0.00 C +ATOM 127 CA ALA A 127 264.087 199.888 207.939 1.00 0.00 C +ATOM 128 CA GLY A 128 261.538 197.527 206.376 1.00 0.00 C +ATOM 129 CA ALA A 129 260.295 194.872 203.942 1.00 0.00 C +ATOM 130 CA GLU A 130 261.648 191.554 205.238 1.00 0.00 C +ATOM 131 CA GLU A 131 262.994 191.951 208.781 1.00 0.00 C +ATOM 132 CA GLY A 132 263.121 193.752 212.135 1.00 0.00 C +ATOM 133 CA GLY A 133 261.241 193.131 215.391 1.00 0.00 C +ATOM 134 CA GLY A 134 257.921 192.444 217.130 1.00 0.00 C +ATOM 135 CA ALA A 135 257.582 193.548 220.760 1.00 0.00 C +ATOM 136 CA ALA A 136 260.626 194.051 222.994 1.00 0.00 C +ATOM 137 CA ARG A 137 261.301 195.426 226.483 1.00 0.00 C +ATOM 138 CA VAL A 138 258.779 196.961 228.891 1.00 0.00 C +ATOM 139 CA ASP A 139 259.728 200.277 230.510 1.00 0.00 C +ATOM 140 CA GLY A 140 258.264 202.279 233.402 1.00 0.00 C +ATOM 141 CA VAL A 141 258.676 205.996 234.132 1.00 0.00 C +ATOM 142 CA ASP A 142 259.001 206.758 237.851 1.00 0.00 C +ATOM 143 CA GLY A 143 259.311 206.653 241.647 1.00 0.00 C +ATOM 144 CA VAL A 144 259.189 203.716 244.070 1.00 0.00 C +ATOM 145 CA PRO A 145 258.137 200.108 244.698 1.00 0.00 C +ATOM 146 CA ALA A 146 255.205 197.914 243.647 1.00 0.00 C +ATOM 147 CA VAL A 147 251.988 197.654 245.672 1.00 0.00 C +ATOM 148 CA GLY A 148 248.510 198.078 244.177 1.00 0.00 C +ATOM 149 CA GLU A 149 245.517 197.043 242.058 1.00 0.00 C +ATOM 150 CA ARG A 150 242.315 197.817 243.972 1.00 0.00 C +ATOM 151 CA ASN A 151 242.489 199.686 247.287 1.00 0.00 C +ATOM 152 CA GLY A 152 240.975 203.176 247.090 1.00 0.00 C +ATOM 153 CA GLY A 153 238.951 205.899 245.356 1.00 0.00 C +ATOM 154 CA VAL A 154 240.322 209.054 243.719 1.00 0.00 C +ATOM 155 CA ASP A 155 240.897 212.810 243.439 1.00 0.00 C +ATOM 156 CA GLU A 156 243.351 215.631 242.705 1.00 0.00 C +ATOM 157 CA VAL A 157 245.106 217.658 245.411 1.00 0.00 C +ATOM 158 CA GLY A 158 247.278 220.096 247.375 1.00 0.00 C +ATOM 159 CA GLU A 159 248.595 221.005 250.832 1.00 0.00 C +ATOM 160 CA ASP A 160 248.466 218.413 253.622 1.00 0.00 C +ATOM 161 CA ALA A 161 250.800 215.890 255.265 1.00 0.00 C +ATOM 162 CA ALA A 162 250.473 212.124 255.744 1.00 0.00 C +ATOM 163 CA LYS A 163 252.346 208.961 256.745 1.00 0.00 C +ATOM 164 CA PRO A 164 256.153 208.825 256.677 1.00 0.00 C +ATOM 165 CA LYS A 165 259.178 209.494 258.895 1.00 0.00 C +ATOM 166 CA GLU A 166 259.643 212.724 260.862 1.00 0.00 C +ATOM 167 CA ALA A 167 257.190 213.372 263.704 1.00 0.00 C +ATOM 168 CA ALA A 168 254.284 213.665 266.151 1.00 0.00 C +ATOM 169 CA PRO A 169 250.681 214.610 265.352 1.00 0.00 C +ATOM 170 CA ARG A 170 248.155 215.270 262.577 1.00 0.00 C +ATOM 171 CA TRP A 171 248.055 219.068 262.284 1.00 0.00 C +ATOM 172 CA GLU A 172 249.182 222.504 261.084 1.00 0.00 C +ATOM 173 CA VAL A 173 247.222 225.764 260.873 1.00 0.00 C +ATOM 174 CA VAL A 174 249.753 228.427 261.884 1.00 0.00 C +ATOM 175 CA ARG A 175 250.621 231.616 259.989 1.00 0.00 C +ATOM 176 CA GLY A 176 252.950 233.578 257.700 1.00 0.00 C +ATOM 177 CA ASP A 177 252.387 234.913 254.176 1.00 0.00 C +ATOM 178 CA ASP A 178 250.839 235.321 250.718 1.00 0.00 C +ATOM 179 CA GLY A 179 252.731 235.065 247.421 1.00 0.00 C +ATOM 180 CA GLY A 180 255.614 237.419 246.605 1.00 0.00 C +ATOM 181 CA GLY A 181 258.819 236.933 248.607 1.00 0.00 C +ATOM 182 CA PRO A 182 260.262 238.613 251.708 1.00 0.00 C +ATOM 183 CA GLU A 183 263.444 240.008 253.272 1.00 0.00 C +ATOM 184 CA LEU A 184 266.746 238.475 252.149 1.00 0.00 C +ATOM 185 CA ASP A 185 270.488 238.586 252.860 1.00 0.00 C +ATOM 186 CA GLY A 186 271.598 242.230 252.809 1.00 0.00 C +ATOM 187 CA ASP A 187 268.816 244.740 252.119 1.00 0.00 C +ATOM 188 CA GLY A 188 265.985 245.310 249.634 1.00 0.00 C +ATOM 189 CA GLY A 189 262.184 245.570 249.665 1.00 0.00 C +ATOM 190 CA GLU A 190 259.008 247.548 250.381 1.00 0.00 C +ATOM 191 CA ARG A 191 257.627 248.434 253.820 1.00 0.00 C +ATOM 192 CA GLU A 192 255.917 251.777 254.465 1.00 0.00 C +ATOM 193 CA ARG A 193 255.247 254.963 256.445 1.00 0.00 C +ATOM 194 CA ARG A 194 258.257 256.040 258.519 1.00 0.00 C +ATOM 195 CA ARG A 195 258.450 259.574 259.927 1.00 0.00 C +ATOM 196 CA GLU A 196 261.393 261.289 261.634 1.00 0.00 C +ATOM 197 CA LEU A 197 260.028 264.186 263.698 1.00 0.00 C +ATOM 198 CA ASP A 198 257.592 267.110 263.524 1.00 0.00 C +ATOM 199 CA SER A 199 257.392 269.198 266.705 1.00 0.00 C +ATOM 200 CA GLY A 200 259.734 271.215 268.932 1.00 0.00 C +ATOM 201 CA GLU A 201 259.733 274.055 271.473 1.00 0.00 C +ATOM 202 CA GLU A 202 257.775 273.935 274.739 1.00 0.00 C +ATOM 203 CA GLU A 203 257.286 270.726 276.734 1.00 0.00 C +ATOM 204 CA GLY A 204 254.210 270.736 278.982 1.00 0.00 C +ATOM 205 CA ARG A 205 254.117 270.483 282.782 1.00 0.00 C +ATOM 206 CA ARG A 206 251.134 269.981 285.098 1.00 0.00 C +ATOM 207 CA GLU A 207 247.775 271.498 284.132 1.00 0.00 C +ATOM 208 CA ALA A 208 245.257 272.098 281.337 1.00 0.00 C +ATOM 209 CA GLU A 209 245.924 271.988 277.587 1.00 0.00 C +ATOM 210 CA THR A 210 244.038 270.064 274.893 1.00 0.00 C +ATOM 211 CA ASP A 211 242.669 266.531 274.500 1.00 0.00 C +ATOM 212 CA GLY A 212 240.606 264.321 272.181 1.00 0.00 C +ATOM 213 CA GLY A 213 238.390 261.544 273.558 1.00 0.00 C +ATOM 214 CA GLY A 214 235.558 259.000 273.415 1.00 0.00 C +ATOM 215 CA ARG A 215 232.072 258.543 271.946 1.00 0.00 C +ATOM 216 CA GLY A 216 228.608 259.190 273.394 1.00 0.00 C +ATOM 217 CA ARG A 217 224.998 258.513 274.408 1.00 0.00 C +ATOM 218 CA GLY A 218 222.548 260.977 272.845 1.00 0.00 C +ATOM 219 CA GLY A 219 218.766 260.864 273.292 1.00 0.00 C +ATOM 220 CA GLY A 220 215.720 263.020 272.527 1.00 0.00 C +ATOM 221 CA SER A 221 215.952 265.253 269.448 1.00 0.00 C +ATOM 222 CA GLY A 222 215.449 267.201 266.213 1.00 0.00 C +ATOM 223 CA GLY A 223 217.655 268.989 263.673 1.00 0.00 C +ATOM 224 CA ARG A 224 221.203 268.850 265.054 1.00 0.00 C +ATOM 225 CA LYS A 225 224.569 269.295 263.327 1.00 0.00 C +ATOM 226 CA GLY A 226 228.338 269.029 262.833 1.00 0.00 C +ATOM 227 CA MET A 227 230.181 271.976 261.274 1.00 0.00 C +ATOM 228 CA THR A 228 232.973 270.442 259.183 1.00 0.00 C +ATOM 229 CA GLY A 229 235.524 269.080 256.703 1.00 0.00 C +ATOM 230 CA GLY A 230 238.852 267.281 257.159 1.00 0.00 C +ATOM 231 CA PRO A 231 240.671 268.183 260.383 1.00 0.00 C +ATOM 232 CA HIS A 232 239.938 269.626 263.832 1.00 0.00 C +ATOM 233 CA PRO A 233 238.447 273.132 263.809 1.00 0.00 C +ATOM 234 CA SER A 234 234.950 274.364 264.685 1.00 0.00 C +ATOM 235 CA ALA A 235 232.046 275.787 266.699 1.00 0.00 C +ATOM 236 CA ARG A 236 228.307 275.395 266.084 1.00 0.00 C +ATOM 237 CA VAL A 237 226.362 278.436 267.302 1.00 0.00 C +ATOM 238 CA ALA A 238 222.871 278.119 265.811 1.00 0.00 C +ATOM 239 CA GLY A 239 219.584 279.673 266.950 1.00 0.00 C +ATOM 240 CA GLY A 240 218.281 282.727 268.819 1.00 0.00 C +ATOM 241 CA PRO A 241 216.383 283.911 271.903 1.00 0.00 C +ATOM 242 CA ALA A 242 212.620 283.477 272.315 1.00 0.00 C +ATOM 243 CA ARG A 243 209.334 281.670 271.642 1.00 0.00 C +ATOM 244 CA GLN A 244 209.323 278.241 273.302 1.00 0.00 C +ATOM 245 CA ARG A 245 210.015 274.831 271.750 1.00 0.00 C +ATOM 246 CA CYS A 246 208.251 271.468 272.065 1.00 0.00 C +ATOM 247 CA ALA A 247 205.765 270.969 269.221 1.00 0.00 C +ATOM 248 CA ARG A 248 203.094 273.569 268.433 1.00 0.00 C +ATOM 249 CA GLY A 249 203.911 276.661 266.361 1.00 0.00 C +ATOM 250 CA GLU A 250 201.499 278.270 263.890 1.00 0.00 C +ATOM 251 CA ARG A 251 199.588 281.110 265.562 1.00 0.00 C +ATOM 252 CA PRO A 252 199.209 284.901 265.589 1.00 0.00 C +ATOM 253 CA ASP A 253 198.617 288.598 264.882 1.00 0.00 C +ATOM 254 CA GLY A 254 200.426 290.078 261.873 1.00 0.00 C +ATOM 255 CA PRO A 255 199.876 289.427 258.160 1.00 0.00 C +ATOM 256 CA ARG A 256 196.215 288.576 257.536 1.00 0.00 C +ATOM 257 CA GLY A 257 193.926 289.576 254.659 1.00 0.00 C +ATOM 258 CA GLU A 258 195.768 291.909 252.277 1.00 0.00 C +ATOM 259 CA GLU A 259 196.032 294.986 250.045 1.00 0.00 C +ATOM 260 CA ARG A 260 198.555 297.800 250.530 1.00 0.00 C +ATOM 261 CA GLU A 261 198.399 301.503 249.649 1.00 0.00 C +ATOM 262 CA GLY A 262 194.808 302.406 248.754 1.00 0.00 C +ATOM 263 CA GLU A 263 191.831 300.063 249.160 1.00 0.00 C +ATOM 264 CA GLY A 264 189.335 300.083 252.038 1.00 0.00 C +ATOM 265 CA ASP A 265 186.674 297.457 251.302 1.00 0.00 C +ATOM 266 CA GLY A 266 185.428 296.589 247.808 1.00 0.00 C +ATOM 267 CA PRO A 267 185.567 298.279 244.396 1.00 0.00 C +ATOM 268 CA SER A 268 186.350 301.997 244.680 1.00 0.00 C +ATOM 269 CA ARG A 269 185.307 304.106 247.677 1.00 0.00 C +ATOM 270 CA PRO A 270 187.510 307.144 248.336 1.00 0.00 C +ATOM 271 CA LYS A 271 186.546 310.653 247.210 1.00 0.00 C +ATOM 272 CA ARG A 272 186.385 314.376 246.414 1.00 0.00 C +ATOM 273 CA GLU A 273 187.901 315.674 243.168 1.00 0.00 C +ATOM 274 CA ARG A 274 189.832 316.019 239.903 1.00 0.00 C +ATOM 275 CA GLU A 275 193.116 317.421 238.572 1.00 0.00 C +ATOM 276 CA GLY A 276 194.220 320.389 240.690 1.00 0.00 C +ATOM 277 CA LYS A 277 194.773 320.375 244.460 1.00 0.00 C +ATOM 278 CA GLY A 278 196.889 317.947 246.495 1.00 0.00 C +ATOM 279 CA THR A 279 199.256 317.380 249.427 1.00 0.00 C +ATOM 280 CA PHE A 280 201.007 316.427 252.674 1.00 0.00 C +TER 281 PHE A 280 +END diff --git a/Plants/Q8S5S1/Q8S5S1.dcd b/Plants/Q8S5S1/Q8S5S1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..afab2438f3fd68e5e91b4fcf340729d3e53f3bbe --- /dev/null +++ b/Plants/Q8S5S1/Q8S5S1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:493c8d123cb7ce25c96d45907dd5d5630ac171b14ec03144ce62acea50b5cf9f +size 17000276 diff --git a/Plants/Q8S5S1/top.pdb b/Plants/Q8S5S1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..ab6478cf48a1a3c678fa7cd456b3070574359453 --- /dev/null +++ b/Plants/Q8S5S1/top.pdb @@ -0,0 +1,139 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 244.795 233.604 243.782 1.00 0.00 C +ATOM 2 CA GLY A 2 243.615 236.071 241.128 1.00 0.00 C +ATOM 3 CA ALA A 3 244.343 235.002 237.544 1.00 0.00 C +ATOM 4 CA ARG A 4 248.079 235.599 237.091 1.00 0.00 C +ATOM 5 CA GLN A 5 249.897 238.455 235.345 1.00 0.00 C +ATOM 6 CA SER A 6 252.762 240.675 234.169 1.00 0.00 C +ATOM 7 CA GLY A 7 256.018 239.248 235.539 1.00 0.00 C +ATOM 8 CA ASP A 8 259.169 237.652 234.111 1.00 0.00 C +ATOM 9 CA GLY A 9 261.195 234.516 233.346 1.00 0.00 C +ATOM 10 CA ASP A 10 262.804 233.161 236.522 1.00 0.00 C +ATOM 11 CA LEU A 11 264.215 229.948 238.007 1.00 0.00 C +ATOM 12 CA ALA A 12 265.986 227.403 240.221 1.00 0.00 C +ATOM 13 CA GLY A 13 269.712 227.095 239.484 1.00 0.00 C +ATOM 14 CA ASP A 14 271.681 228.189 236.412 1.00 0.00 C +ATOM 15 CA TRP A 15 270.978 229.455 232.887 1.00 0.00 C +ATOM 16 CA MET A 16 268.325 229.127 230.172 1.00 0.00 C +ATOM 17 CA VAL A 17 264.715 229.180 228.957 1.00 0.00 C +ATOM 18 CA GLY A 18 260.909 229.074 229.102 1.00 0.00 C +ATOM 19 CA CYS A 19 257.267 229.818 228.263 1.00 0.00 C +ATOM 20 CA ASP A 20 257.063 232.463 225.530 1.00 0.00 C +ATOM 21 CA PHE A 21 257.270 230.673 222.173 1.00 0.00 C +ATOM 22 CA GLY A 22 258.138 227.665 220.002 1.00 0.00 C +ATOM 23 CA GLY A 23 257.280 224.996 217.422 1.00 0.00 C +ATOM 24 CA HIS A 24 256.461 221.361 216.625 1.00 0.00 C +ATOM 25 CA GLU A 25 252.951 221.414 215.145 1.00 0.00 C +ATOM 26 CA HIS A 26 252.906 223.596 212.023 1.00 0.00 C +ATOM 27 CA VAL A 27 252.089 227.219 212.874 1.00 0.00 C +ATOM 28 CA GLU A 28 252.285 229.686 215.770 1.00 0.00 C +ATOM 29 CA ASP A 29 254.446 232.623 214.665 1.00 0.00 C +ATOM 30 CA ASP A 30 257.847 232.838 212.961 1.00 0.00 C +ATOM 31 CA GLU A 31 260.391 232.594 210.136 1.00 0.00 C +ATOM 32 CA THR A 32 259.211 232.220 206.533 1.00 0.00 C +ATOM 33 CA ASN A 33 261.946 232.849 203.956 1.00 0.00 C +ATOM 34 CA PRO A 34 265.417 234.410 204.137 1.00 0.00 C +ATOM 35 CA THR A 35 268.848 235.399 202.807 1.00 0.00 C +ATOM 36 CA VAL A 36 269.688 239.073 203.368 1.00 0.00 C +ATOM 37 CA LEU A 37 268.735 242.720 203.921 1.00 0.00 C +ATOM 38 CA THR A 38 266.736 245.024 201.638 1.00 0.00 C +ATOM 39 CA LEU A 39 264.570 247.648 203.353 1.00 0.00 C +ATOM 40 CA GLU A 40 261.949 245.799 205.409 1.00 0.00 C +ATOM 41 CA PRO A 41 258.181 246.341 205.243 1.00 0.00 C +ATOM 42 CA ASN A 42 255.795 249.049 206.463 1.00 0.00 C +ATOM 43 CA ASP A 43 254.228 250.517 209.610 1.00 0.00 C +ATOM 44 CA GLU A 44 253.979 253.356 212.139 1.00 0.00 C +ATOM 45 CA ARG A 45 253.777 254.606 215.733 1.00 0.00 C +ATOM 46 CA ARG A 46 255.578 251.957 217.796 1.00 0.00 C +ATOM 47 CA ARG A 47 257.222 248.825 219.211 1.00 0.00 C +ATOM 48 CA PRO A 48 260.545 247.328 218.102 1.00 0.00 C +ATOM 49 CA ALA A 49 264.127 248.593 218.401 1.00 0.00 C +ATOM 50 CA THR A 50 267.271 249.794 216.615 1.00 0.00 C +ATOM 51 CA ARG A 51 266.684 249.796 212.851 1.00 0.00 C +ATOM 52 CA SER A 52 266.206 251.691 209.580 1.00 0.00 C +ATOM 53 CA SER A 53 267.933 253.502 206.707 1.00 0.00 C +ATOM 54 CA GLY A 54 269.070 257.050 207.508 1.00 0.00 C +ATOM 55 CA GLY A 55 272.276 257.212 209.560 1.00 0.00 C +ATOM 56 CA THR A 56 275.807 258.091 210.688 1.00 0.00 C +ATOM 57 CA ALA A 57 277.266 258.249 214.204 1.00 0.00 C +ATOM 58 CA SER A 58 277.219 257.933 218.000 1.00 0.00 C +ATOM 59 CA VAL A 59 273.965 259.352 219.382 1.00 0.00 C +ATOM 60 CA ASP A 60 270.450 260.612 220.143 1.00 0.00 C +ATOM 61 CA GLY A 61 267.113 260.449 221.973 1.00 0.00 C +ATOM 62 CA GLY A 62 265.498 263.898 221.862 1.00 0.00 C +ATOM 63 CA ASP A 63 263.105 266.327 223.563 1.00 0.00 C +ATOM 64 CA GLY A 64 260.218 264.149 224.764 1.00 0.00 C +ATOM 65 CA ALA A 65 257.628 265.078 227.399 1.00 0.00 C +ATOM 66 CA PRO A 66 258.655 263.870 230.864 1.00 0.00 C +ATOM 67 CA VAL A 67 258.513 266.197 233.877 1.00 0.00 C +ATOM 68 CA THR A 68 258.642 269.951 234.517 1.00 0.00 C +ATOM 69 CA GLY A 69 257.536 273.591 234.733 1.00 0.00 C +ATOM 70 CA ASP A 70 254.826 275.857 236.159 1.00 0.00 C +ATOM 71 CA SER A 71 253.370 279.307 235.455 1.00 0.00 C +ATOM 72 CA GLY A 72 249.571 279.353 235.174 1.00 0.00 C +ATOM 73 CA GLU A 73 246.649 277.254 233.921 1.00 0.00 C +ATOM 74 CA ARG A 74 246.958 273.958 235.806 1.00 0.00 C +ATOM 75 CA ALA A 75 243.809 271.909 235.172 1.00 0.00 C +ATOM 76 CA ALA A 76 242.769 268.371 236.132 1.00 0.00 C +ATOM 77 CA GLY A 77 243.499 264.647 235.796 1.00 0.00 C +ATOM 78 CA LEU A 78 245.556 262.645 233.291 1.00 0.00 C +ATOM 79 CA LEU A 79 248.398 260.337 234.344 1.00 0.00 C +ATOM 80 CA HIS A 80 249.809 261.837 237.550 1.00 0.00 C +ATOM 81 CA THR A 81 251.645 259.368 239.797 1.00 0.00 C +ATOM 82 CA SER A 82 253.913 261.030 242.367 1.00 0.00 C +ATOM 83 CA ALA A 83 255.378 258.712 245.012 1.00 0.00 C +ATOM 84 CA HIS A 84 255.139 256.285 247.939 1.00 0.00 C +ATOM 85 CA LEU A 85 257.275 255.504 250.995 1.00 0.00 C +ATOM 86 CA THR A 86 256.033 253.393 253.914 1.00 0.00 C +ATOM 87 CA ALA A 87 253.633 250.605 254.906 1.00 0.00 C +ATOM 88 CA VAL A 88 250.039 251.818 255.267 1.00 0.00 C +ATOM 89 CA THR A 89 247.033 249.480 255.401 1.00 0.00 C +ATOM 90 CA ALA A 90 244.658 246.683 256.428 1.00 0.00 C +ATOM 91 CA THR A 91 242.901 244.412 258.931 1.00 0.00 C +ATOM 92 CA GLY A 92 244.281 241.092 260.191 1.00 0.00 C +ATOM 93 CA GLY A 93 247.973 241.713 260.894 1.00 0.00 C +ATOM 94 CA ASP A 94 249.078 245.325 261.391 1.00 0.00 C +ATOM 95 CA ASP A 95 250.812 246.207 264.667 1.00 0.00 C +ATOM 96 CA GLY A 96 254.036 247.236 266.418 1.00 0.00 C +ATOM 97 CA GLY A 97 254.225 246.781 270.196 1.00 0.00 C +ATOM 98 CA ASP A 98 251.726 246.549 273.063 1.00 0.00 C +ATOM 99 CA GLY A 99 248.942 249.134 273.350 1.00 0.00 C +ATOM 100 CA THR A 100 250.543 252.577 273.666 1.00 0.00 C +ATOM 101 CA THR A 101 252.593 254.140 276.471 1.00 0.00 C +ATOM 102 CA ARG A 102 251.937 254.965 280.132 1.00 0.00 C +ATOM 103 CA MET A 103 249.965 253.760 283.161 1.00 0.00 C +ATOM 104 CA GLU A 104 248.124 251.057 285.115 1.00 0.00 C +ATOM 105 CA LEU A 105 244.677 249.642 284.318 1.00 0.00 C +ATOM 106 CA GLY A 106 241.180 250.687 285.410 1.00 0.00 C +ATOM 107 CA ARG A 107 240.079 253.778 287.346 1.00 0.00 C +ATOM 108 CA ARG A 108 239.628 257.151 289.059 1.00 0.00 C +ATOM 109 CA ARG A 109 236.680 257.086 291.472 1.00 0.00 C +ATOM 110 CA ARG A 110 235.088 256.440 294.873 1.00 0.00 C +ATOM 111 CA ARG A 111 231.283 256.414 295.056 1.00 0.00 C +ATOM 112 CA GLY A 112 229.158 259.125 293.428 1.00 0.00 C +ATOM 113 CA GLY A 113 227.332 260.908 290.599 1.00 0.00 C +ATOM 114 CA ALA A 114 224.159 262.438 292.051 1.00 0.00 C +ATOM 115 CA ARG A 115 224.873 263.786 295.542 1.00 0.00 C +ATOM 116 CA GLY A 116 222.555 264.821 298.383 1.00 0.00 C +ATOM 117 CA GLY A 117 221.436 266.000 301.829 1.00 0.00 C +ATOM 118 CA GLY A 118 222.567 267.459 305.162 1.00 0.00 C +ATOM 119 CA ALA A 119 222.136 265.691 308.510 1.00 0.00 C +ATOM 120 CA THR A 120 221.292 261.976 308.476 1.00 0.00 C +ATOM 121 CA ARG A 121 223.013 258.930 309.985 1.00 0.00 C +ATOM 122 CA HIS A 122 225.664 257.069 311.991 1.00 0.00 C +ATOM 123 CA GLY A 123 224.327 255.032 314.919 1.00 0.00 C +ATOM 124 CA ARG A 124 223.070 255.186 318.513 1.00 0.00 C +ATOM 125 CA PRO A 125 221.280 254.757 321.848 1.00 0.00 C +ATOM 126 CA ARG A 126 217.481 254.815 322.135 1.00 0.00 C +ATOM 127 CA GLU A 127 215.577 254.961 325.432 1.00 0.00 C +ATOM 128 CA ARG A 128 213.172 254.631 328.369 1.00 0.00 C +ATOM 129 CA GLY A 129 214.736 252.599 331.187 1.00 0.00 C +ATOM 130 CA GLN A 130 217.182 254.668 333.250 1.00 0.00 C +ATOM 131 CA THR A 131 216.969 255.097 337.030 1.00 0.00 C +ATOM 132 CA LYS A 132 217.366 255.094 340.819 1.00 0.00 C +ATOM 133 CA GLU A 133 221.112 255.232 341.501 1.00 0.00 C +ATOM 134 CA GLU A 134 223.806 255.058 344.189 1.00 0.00 C +ATOM 135 CA ASP A 135 226.846 257.262 344.835 1.00 0.00 C +TER 136 ASP A 135 +END diff --git a/Plants/Q8S5Y9/Q8S5Y9.dcd b/Plants/Q8S5Y9/Q8S5Y9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..24214e46ab864f7ec826d91efa6853915c461be2 --- /dev/null +++ b/Plants/Q8S5Y9/Q8S5Y9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:4050f6156af25f58ae78d6a1dbbf018ae5e0536da3368434470362e25527fbdb +size 12920276 diff --git a/Plants/Q8S5Y9/top.pdb b/Plants/Q8S5Y9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..40cc7317ba71ff0383b4c936a55fdfe8f29b2004 --- /dev/null +++ b/Plants/Q8S5Y9/top.pdb @@ -0,0 +1,105 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 259.897 208.143 234.684 1.00 0.00 C +ATOM 2 CA VAL A 2 260.897 204.761 236.125 1.00 0.00 C +ATOM 3 CA VAL A 3 259.335 204.388 239.580 1.00 0.00 C +ATOM 4 CA GLU A 4 257.592 207.714 240.225 1.00 0.00 C +ATOM 5 CA VAL A 5 255.239 207.593 243.219 1.00 0.00 C +ATOM 6 CA GLU A 6 255.423 210.941 245.027 1.00 0.00 C +ATOM 7 CA GLU A 7 257.905 213.830 245.120 1.00 0.00 C +ATOM 8 CA GLY A 8 260.754 216.183 246.051 1.00 0.00 C +ATOM 9 CA GLY A 9 262.206 219.497 247.244 1.00 0.00 C +ATOM 10 CA GLY A 10 265.468 221.143 246.164 1.00 0.00 C +ATOM 11 CA TRP A 11 267.777 220.946 243.140 1.00 0.00 C +ATOM 12 CA GLY A 12 270.978 220.399 241.149 1.00 0.00 C +ATOM 13 CA TRP A 13 273.714 223.048 241.266 1.00 0.00 C +ATOM 14 CA GLY A 14 275.130 223.211 244.799 1.00 0.00 C +ATOM 15 CA VAL A 15 276.293 226.794 245.372 1.00 0.00 C +ATOM 16 CA THR A 16 275.163 230.034 243.717 1.00 0.00 C +ATOM 17 CA SER A 17 275.561 232.942 246.146 1.00 0.00 C +ATOM 18 CA ALA A 18 273.835 236.338 246.225 1.00 0.00 C +ATOM 19 CA ILE A 19 273.333 238.916 243.465 1.00 0.00 C +ATOM 20 CA THR A 20 273.681 240.640 240.085 1.00 0.00 C +ATOM 21 CA GLY A 21 274.999 240.189 236.539 1.00 0.00 C +ATOM 22 CA ASP A 22 277.295 239.644 233.547 1.00 0.00 C +ATOM 23 CA GLU A 23 278.408 236.076 232.809 1.00 0.00 C +ATOM 24 CA GLY A 24 275.626 233.776 234.030 1.00 0.00 C +ATOM 25 CA GLN A 25 273.482 233.290 237.142 1.00 0.00 C +ATOM 26 CA LEU A 26 271.500 230.320 238.471 1.00 0.00 C +ATOM 27 CA GLU A 27 268.324 228.735 237.086 1.00 0.00 C +ATOM 28 CA ALA A 28 267.127 229.784 233.624 1.00 0.00 C +ATOM 29 CA PRO A 29 267.938 233.454 232.997 1.00 0.00 C +ATOM 30 CA GLU A 30 268.869 237.140 232.747 1.00 0.00 C +ATOM 31 CA GLY A 31 270.874 239.589 230.627 1.00 0.00 C +ATOM 32 CA GLN A 32 272.027 243.129 231.439 1.00 0.00 C +ATOM 33 CA PRO A 33 275.353 244.981 231.584 1.00 0.00 C +ATOM 34 CA THR A 34 275.554 248.727 232.254 1.00 0.00 C +ATOM 35 CA PRO A 35 272.276 250.489 231.437 1.00 0.00 C +ATOM 36 CA ARG A 36 270.691 251.842 234.627 1.00 0.00 C +ATOM 37 CA ARG A 37 267.529 253.621 235.790 1.00 0.00 C +ATOM 38 CA PRO A 38 266.740 255.609 238.943 1.00 0.00 C +ATOM 39 CA SER A 39 266.671 258.905 240.853 1.00 0.00 C +ATOM 40 CA GLU A 40 263.035 259.437 241.860 1.00 0.00 C +ATOM 41 CA PRO A 41 262.124 256.616 244.253 1.00 0.00 C +ATOM 42 CA ALA A 42 258.928 254.559 244.527 1.00 0.00 C +ATOM 43 CA ALA A 43 255.451 256.109 244.374 1.00 0.00 C +ATOM 44 CA ALA A 44 251.676 256.373 243.935 1.00 0.00 C +ATOM 45 CA ALA A 45 248.586 258.499 244.608 1.00 0.00 C +ATOM 46 CA THR A 46 245.762 257.522 246.971 1.00 0.00 C +ATOM 47 CA GLU A 47 243.268 260.193 248.050 1.00 0.00 C +ATOM 48 CA SER A 48 242.756 262.331 244.939 1.00 0.00 C +ATOM 49 CA ARG A 49 243.299 265.012 242.286 1.00 0.00 C +ATOM 50 CA THR A 50 241.660 268.448 242.436 1.00 0.00 C +ATOM 51 CA PRO A 51 244.459 271.018 242.155 1.00 0.00 C +ATOM 52 CA SER A 52 247.578 270.996 244.344 1.00 0.00 C +ATOM 53 CA PRO A 53 246.806 268.543 247.155 1.00 0.00 C +ATOM 54 CA CYS A 54 244.549 268.077 250.189 1.00 0.00 C +ATOM 55 CA GLU A 55 240.902 268.933 249.496 1.00 0.00 C +ATOM 56 CA PRO A 56 238.583 271.931 249.887 1.00 0.00 C +ATOM 57 CA PRO A 57 236.473 273.932 252.349 1.00 0.00 C +ATOM 58 CA CYS A 58 232.864 274.878 251.578 1.00 0.00 C +ATOM 59 CA ALA A 59 229.489 273.117 251.750 1.00 0.00 C +ATOM 60 CA ALA A 60 225.834 272.291 252.437 1.00 0.00 C +ATOM 61 CA ALA A 61 225.019 268.752 253.589 1.00 0.00 C +ATOM 62 CA ALA A 62 227.121 265.574 253.551 1.00 0.00 C +ATOM 63 CA THR A 63 230.775 265.917 252.529 1.00 0.00 C +ATOM 64 CA THR A 64 234.072 267.770 252.069 1.00 0.00 C +ATOM 65 CA ALA A 65 235.788 268.185 255.445 1.00 0.00 C +ATOM 66 CA SER A 66 237.335 264.791 256.219 1.00 0.00 C +ATOM 67 CA LEU A 67 240.760 263.349 257.060 1.00 0.00 C +ATOM 68 CA ALA A 68 243.200 265.369 259.177 1.00 0.00 C +ATOM 69 CA ALA A 69 242.750 265.456 262.960 1.00 0.00 C +ATOM 70 CA PRO A 70 244.155 268.196 265.203 1.00 0.00 C +ATOM 71 CA ARG A 71 242.022 271.317 265.679 1.00 0.00 C +ATOM 72 CA HIS A 72 241.913 273.418 262.503 1.00 0.00 C +ATOM 73 CA SER A 73 239.709 272.199 259.644 1.00 0.00 C +ATOM 74 CA CYS A 74 236.255 271.030 260.749 1.00 0.00 C +ATOM 75 CA HIS A 75 235.885 270.284 264.467 1.00 0.00 C +ATOM 76 CA ARG A 76 236.181 271.665 268.005 1.00 0.00 C +ATOM 77 CA ARG A 77 234.531 271.813 271.436 1.00 0.00 C +ATOM 78 CA GLN A 78 235.200 271.005 275.099 1.00 0.00 C +ATOM 79 CA ARG A 79 233.437 268.337 277.170 1.00 0.00 C +ATOM 80 CA ARG A 80 233.351 264.556 277.636 1.00 0.00 C +ATOM 81 CA PRO A 81 232.388 263.222 274.200 1.00 0.00 C +ATOM 82 CA THR A 82 232.748 259.738 272.699 1.00 0.00 C +ATOM 83 CA SER A 83 230.499 256.665 272.825 1.00 0.00 C +ATOM 84 CA PRO A 84 227.967 253.878 272.247 1.00 0.00 C +ATOM 85 CA PRO A 85 225.928 251.083 270.651 1.00 0.00 C +ATOM 86 CA PRO A 86 226.463 248.155 268.273 1.00 0.00 C +ATOM 87 CA LYS A 87 224.939 247.407 264.863 1.00 0.00 C +ATOM 88 CA LEU A 88 226.967 244.944 262.779 1.00 0.00 C +ATOM 89 CA SER A 89 230.201 243.905 264.504 1.00 0.00 C +ATOM 90 CA ARG A 90 232.778 246.485 265.609 1.00 0.00 C +ATOM 91 CA SER A 91 234.684 249.026 267.712 1.00 0.00 C +ATOM 92 CA ASN A 92 237.593 250.765 265.971 1.00 0.00 C +ATOM 93 CA GLY A 93 237.572 253.869 263.763 1.00 0.00 C +ATOM 94 CA GLY A 94 238.756 257.115 262.155 1.00 0.00 C +ATOM 95 CA GLY A 95 238.054 256.781 258.425 1.00 0.00 C +ATOM 96 CA ALA A 96 236.222 253.940 256.668 1.00 0.00 C +ATOM 97 CA GLY A 97 235.694 252.660 253.119 1.00 0.00 C +ATOM 98 CA SER A 98 232.528 253.487 251.169 1.00 0.00 C +ATOM 99 CA ALA A 99 232.054 255.493 247.965 1.00 0.00 C +ATOM 100 CA ALA A 100 234.694 257.558 246.152 1.00 0.00 C +ATOM 101 CA ALA A 101 236.269 259.267 243.133 1.00 0.00 C +TER 102 ALA A 101 +END diff --git a/Plants/Q8S6Q4/Q8S6Q4.dcd b/Plants/Q8S6Q4/Q8S6Q4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..58345172aca8c6bedd3e29cf3875fc411c9a026e --- /dev/null +++ b/Plants/Q8S6Q4/Q8S6Q4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:d6593a0717d381f3ec90428ce5a73f85400a0772206b1a654fbc3fbc0a2853d8 +size 5720276 diff --git a/Plants/Q8S6Q4/top.pdb b/Plants/Q8S6Q4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..7ceb509beaea1352fd0ea553a30d3ac6719be0fa --- /dev/null +++ b/Plants/Q8S6Q4/top.pdb @@ -0,0 +1,45 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 269.253 242.134 229.903 1.00 0.00 C +ATOM 2 CA ALA A 2 272.306 241.640 232.129 1.00 0.00 C +ATOM 3 CA ALA A 3 273.228 239.106 234.820 1.00 0.00 C +ATOM 4 CA ARG A 4 275.267 238.221 237.914 1.00 0.00 C +ATOM 5 CA GLY A 5 273.397 236.891 240.955 1.00 0.00 C +ATOM 6 CA VAL A 6 270.024 235.260 240.262 1.00 0.00 C +ATOM 7 CA GLN A 7 267.300 235.531 242.912 1.00 0.00 C +ATOM 8 CA ALA A 8 267.068 239.231 243.789 1.00 0.00 C +ATOM 9 CA PRO A 9 263.904 240.734 242.290 1.00 0.00 C +ATOM 10 CA GLU A 10 260.662 241.731 240.554 1.00 0.00 C +ATOM 11 CA ARG A 11 259.336 244.819 242.348 1.00 0.00 C +ATOM 12 CA PRO A 12 258.688 247.424 245.052 1.00 0.00 C +ATOM 13 CA ARG A 13 255.597 248.424 247.043 1.00 0.00 C +ATOM 14 CA GLU A 14 254.050 251.517 245.444 1.00 0.00 C +ATOM 15 CA GLU A 15 250.628 252.675 244.234 1.00 0.00 C +ATOM 16 CA ASP A 16 247.023 252.362 245.427 1.00 0.00 C +ATOM 17 CA GLN A 17 244.144 253.456 247.670 1.00 0.00 C +ATOM 18 CA ARG A 18 240.392 254.008 247.304 1.00 0.00 C +ATOM 19 CA GLY A 19 237.094 252.333 248.219 1.00 0.00 C +ATOM 20 CA LEU A 20 237.561 248.788 249.533 1.00 0.00 C +ATOM 21 CA ARG A 21 239.523 249.019 252.791 1.00 0.00 C +ATOM 22 CA GLY A 22 243.261 249.076 252.058 1.00 0.00 C +ATOM 23 CA HIS A 23 245.758 246.673 250.475 1.00 0.00 C +ATOM 24 CA GLY A 24 249.172 244.991 250.655 1.00 0.00 C +ATOM 25 CA GLY A 25 252.353 245.467 252.698 1.00 0.00 C +ATOM 26 CA ASN A 26 255.009 245.766 255.412 1.00 0.00 C +ATOM 27 CA HIS A 27 253.879 248.339 257.985 1.00 0.00 C +ATOM 28 CA CYS A 28 251.596 251.291 258.753 1.00 0.00 C +ATOM 29 CA ARG A 29 250.831 254.876 259.793 1.00 0.00 C +ATOM 30 CA PRO A 30 247.355 255.846 258.572 1.00 0.00 C +ATOM 31 CA GLU A 31 243.944 257.508 258.916 1.00 0.00 C +ATOM 32 CA ALA A 32 240.623 258.514 260.490 1.00 0.00 C +ATOM 33 CA VAL A 33 237.383 256.708 261.360 1.00 0.00 C +ATOM 34 CA ASP A 34 235.240 253.832 260.073 1.00 0.00 C +ATOM 35 CA MET A 35 232.124 255.523 258.679 1.00 0.00 C +ATOM 36 CA GLU A 36 232.987 258.799 256.935 1.00 0.00 C +ATOM 37 CA GLY A 37 230.732 261.018 254.812 1.00 0.00 C +ATOM 38 CA SER A 38 230.199 264.290 256.689 1.00 0.00 C +ATOM 39 CA PRO A 39 230.955 265.436 260.243 1.00 0.00 C +ATOM 40 CA ALA A 40 234.049 263.877 261.826 1.00 0.00 C +ATOM 41 CA ASN A 41 236.108 266.866 262.985 1.00 0.00 C +TER 42 ASN A 41 +END diff --git a/Plants/Q8S6V7/Q8S6V7.dcd b/Plants/Q8S6V7/Q8S6V7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..2d8dc85b68907890257a4fa51e26c0ce5de641c9 --- /dev/null +++ b/Plants/Q8S6V7/Q8S6V7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e6e111a8f87ad7597258ce79415fbf92f647c993bc05040d5fcd315d34391816 +size 19160276 diff --git a/Plants/Q8S6V7/top.pdb b/Plants/Q8S6V7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..4ff686b86be939c064501d36a571eaa562ec85e5 --- /dev/null +++ b/Plants/Q8S6V7/top.pdb @@ -0,0 +1,157 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 287.196 288.855 244.301 1.00 0.00 C +ATOM 2 CA ALA A 2 287.072 286.193 241.579 1.00 0.00 C +ATOM 3 CA ALA A 3 288.314 283.575 239.105 1.00 0.00 C +ATOM 4 CA ARG A 4 285.910 280.702 238.409 1.00 0.00 C +ATOM 5 CA GLY A 5 282.796 279.674 236.470 1.00 0.00 C +ATOM 6 CA SER A 6 279.530 280.887 234.926 1.00 0.00 C +ATOM 7 CA GLY A 7 277.965 277.803 233.328 1.00 0.00 C +ATOM 8 CA ARG A 8 280.806 275.564 232.130 1.00 0.00 C +ATOM 9 CA ARG A 9 283.328 276.932 229.623 1.00 0.00 C +ATOM 10 CA ALA A 10 283.963 274.640 226.647 1.00 0.00 C +ATOM 11 CA GLY A 11 281.052 273.095 224.734 1.00 0.00 C +ATOM 12 CA LEU A 12 282.161 269.627 223.612 1.00 0.00 C +ATOM 13 CA GLY A 13 284.216 266.471 224.192 1.00 0.00 C +ATOM 14 CA VAL A 14 285.644 263.388 222.469 1.00 0.00 C +ATOM 15 CA ALA A 15 283.753 262.827 219.209 1.00 0.00 C +ATOM 16 CA ARG A 16 280.412 261.262 220.159 1.00 0.00 C +ATOM 17 CA GLY A 17 279.737 258.529 222.726 1.00 0.00 C +ATOM 18 CA SER A 18 279.674 255.398 224.897 1.00 0.00 C +ATOM 19 CA ALA A 19 281.484 252.833 227.056 1.00 0.00 C +ATOM 20 CA ARG A 20 281.164 252.592 230.845 1.00 0.00 C +ATOM 21 CA GLY A 21 279.411 255.105 233.110 1.00 0.00 C +ATOM 22 CA ASP A 22 277.304 257.263 235.437 1.00 0.00 C +ATOM 23 CA GLY A 23 276.361 256.140 238.954 1.00 0.00 C +ATOM 24 CA MET A 24 272.571 256.377 239.257 1.00 0.00 C +ATOM 25 CA ALA A 25 271.347 252.946 240.373 1.00 0.00 C +ATOM 26 CA ARG A 26 269.660 249.716 241.483 1.00 0.00 C +ATOM 27 CA ARG A 27 269.909 246.879 244.014 1.00 0.00 C +ATOM 28 CA GLY A 28 267.607 244.156 245.356 1.00 0.00 C +ATOM 29 CA ALA A 29 269.897 241.746 247.218 1.00 0.00 C +ATOM 30 CA GLY A 30 273.380 243.177 247.793 1.00 0.00 C +ATOM 31 CA LEU A 31 274.471 245.452 250.648 1.00 0.00 C +ATOM 32 CA GLY A 32 276.464 248.646 251.233 1.00 0.00 C +ATOM 33 CA ALA A 33 274.782 251.271 249.042 1.00 0.00 C +ATOM 34 CA ARG A 34 275.915 254.813 248.215 1.00 0.00 C +ATOM 35 CA GLN A 35 278.454 257.654 248.164 1.00 0.00 C +ATOM 36 CA TRP A 36 280.686 260.040 250.123 1.00 0.00 C +ATOM 37 CA ASP A 37 280.836 263.824 249.709 1.00 0.00 C +ATOM 38 CA GLY A 38 280.842 267.537 250.565 1.00 0.00 C +ATOM 39 CA ASP A 39 278.719 269.086 253.324 1.00 0.00 C +ATOM 40 CA GLY A 40 275.795 271.430 254.010 1.00 0.00 C +ATOM 41 CA ASP A 41 277.077 274.992 253.582 1.00 0.00 C +ATOM 42 CA SER A 42 274.590 277.796 254.269 1.00 0.00 C +ATOM 43 CA GLY A 43 271.644 279.490 252.547 1.00 0.00 C +ATOM 44 CA ALA A 44 268.388 279.890 250.609 1.00 0.00 C +ATOM 45 CA GLY A 45 268.075 277.194 247.936 1.00 0.00 C +ATOM 46 CA SER A 46 268.169 273.470 248.738 1.00 0.00 C +ATOM 47 CA ARG A 47 268.801 269.787 247.996 1.00 0.00 C +ATOM 48 CA ARG A 48 267.334 268.520 244.716 1.00 0.00 C +ATOM 49 CA ARG A 49 264.236 266.584 243.637 1.00 0.00 C +ATOM 50 CA TRP A 50 260.497 266.983 243.020 1.00 0.00 C +ATOM 51 CA ASN A 51 258.595 263.977 241.654 1.00 0.00 C +ATOM 52 CA ALA A 52 256.910 260.707 242.643 1.00 0.00 C +ATOM 53 CA ARG A 53 255.694 258.181 245.224 1.00 0.00 C +ATOM 54 CA GLY A 54 253.615 255.299 246.599 1.00 0.00 C +ATOM 55 CA ASP A 55 251.082 254.977 249.427 1.00 0.00 C +ATOM 56 CA GLY A 56 247.778 253.221 248.714 1.00 0.00 C +ATOM 57 CA THR A 57 244.092 252.707 247.896 1.00 0.00 C +ATOM 58 CA GLY A 58 240.558 253.061 246.518 1.00 0.00 C +ATOM 59 CA GLY A 59 238.088 251.410 244.132 1.00 0.00 C +ATOM 60 CA ASP A 60 239.023 247.901 242.981 1.00 0.00 C +ATOM 61 CA GLY A 61 242.648 247.445 241.902 1.00 0.00 C +ATOM 62 CA ALA A 62 246.321 247.244 242.896 1.00 0.00 C +ATOM 63 CA ARG A 63 249.631 245.363 243.037 1.00 0.00 C +ATOM 64 CA ARG A 64 250.360 243.910 246.483 1.00 0.00 C +ATOM 65 CA ARG A 65 249.371 244.601 250.097 1.00 0.00 C +ATOM 66 CA GLY A 66 250.961 244.413 253.554 1.00 0.00 C +ATOM 67 CA ALA A 67 248.681 242.060 255.500 1.00 0.00 C +ATOM 68 CA ALA A 68 249.880 238.446 255.354 1.00 0.00 C +ATOM 69 CA GLY A 69 248.260 236.197 252.739 1.00 0.00 C +ATOM 70 CA TRP A 70 245.704 233.957 251.018 1.00 0.00 C +ATOM 71 CA ARG A 71 242.742 232.647 249.012 1.00 0.00 C +ATOM 72 CA ARG A 72 240.846 230.351 251.390 1.00 0.00 C +ATOM 73 CA GLY A 73 242.083 229.991 254.975 1.00 0.00 C +ATOM 74 CA ALA A 74 241.747 226.307 255.885 1.00 0.00 C +ATOM 75 CA ALA A 75 240.056 223.225 257.355 1.00 0.00 C +ATOM 76 CA ALA A 76 239.727 219.480 257.971 1.00 0.00 C +ATOM 77 CA ALA A 77 239.720 216.221 259.946 1.00 0.00 C +ATOM 78 CA LYS A 78 238.032 212.819 260.245 1.00 0.00 C +ATOM 79 CA ARG A 79 236.410 209.379 260.478 1.00 0.00 C +ATOM 80 CA ARG A 80 233.291 207.533 261.652 1.00 0.00 C +ATOM 81 CA ARG A 81 231.175 208.159 264.758 1.00 0.00 C +ATOM 82 CA THR A 82 230.860 211.915 265.315 1.00 0.00 C +ATOM 83 CA ALA A 83 231.919 214.725 262.970 1.00 0.00 C +ATOM 84 CA ALA A 84 234.073 217.837 262.534 1.00 0.00 C +ATOM 85 CA ARG A 85 233.808 221.591 261.938 1.00 0.00 C +ATOM 86 CA GLY A 86 234.370 225.326 261.437 1.00 0.00 C +ATOM 87 CA VAL A 87 234.715 229.022 260.581 1.00 0.00 C +ATOM 88 CA ARG A 88 234.110 230.444 257.099 1.00 0.00 C +ATOM 89 CA ARG A 89 230.700 232.143 257.102 1.00 0.00 C +ATOM 90 CA ALA A 90 227.967 234.078 255.283 1.00 0.00 C +ATOM 91 CA ARG A 91 229.425 236.353 252.597 1.00 0.00 C +ATOM 92 CA GLN A 92 227.609 238.374 249.926 1.00 0.00 C +ATOM 93 CA GLY A 93 226.502 242.015 249.756 1.00 0.00 C +ATOM 94 CA ARG A 94 224.581 244.952 251.240 1.00 0.00 C +ATOM 95 CA TRP A 95 221.126 246.027 252.434 1.00 0.00 C +ATOM 96 CA ASP A 96 219.313 249.273 251.603 1.00 0.00 C +ATOM 97 CA GLU A 97 217.413 248.973 248.314 1.00 0.00 C +ATOM 98 CA ARG A 98 214.569 249.561 245.848 1.00 0.00 C +ATOM 99 CA ALA A 99 214.920 251.580 242.636 1.00 0.00 C +ATOM 100 CA ALA A 100 213.250 254.994 242.378 1.00 0.00 C +ATOM 101 CA THR A 101 213.524 256.663 245.792 1.00 0.00 C +ATOM 102 CA GLU A 102 215.595 259.584 247.095 1.00 0.00 C +ATOM 103 CA ARG A 103 217.788 261.286 249.704 1.00 0.00 C +ATOM 104 CA GLN A 104 220.663 259.557 251.509 1.00 0.00 C +ATOM 105 CA ARG A 105 221.684 260.728 254.988 1.00 0.00 C +ATOM 106 CA ALA A 106 223.781 263.367 256.764 1.00 0.00 C +ATOM 107 CA ALA A 107 224.875 266.254 254.531 1.00 0.00 C +ATOM 108 CA MET A 108 227.987 267.608 252.800 1.00 0.00 C +ATOM 109 CA GLY A 109 229.979 268.452 249.664 1.00 0.00 C +ATOM 110 CA ARG A 110 233.786 268.344 249.574 1.00 0.00 C +ATOM 111 CA ALA A 111 235.357 264.941 248.886 1.00 0.00 C +ATOM 112 CA ARG A 112 238.493 263.895 246.992 1.00 0.00 C +ATOM 113 CA GLY A 113 241.723 263.790 249.009 1.00 0.00 C +ATOM 114 CA GLY A 114 243.031 260.479 250.367 1.00 0.00 C +ATOM 115 CA ALA A 115 246.433 258.803 250.730 1.00 0.00 C +ATOM 116 CA GLY A 116 246.847 256.796 253.942 1.00 0.00 C +ATOM 117 CA ALA A 117 247.332 253.405 255.609 1.00 0.00 C +ATOM 118 CA ARG A 118 247.548 249.818 254.342 1.00 0.00 C +ATOM 119 CA GLY A 119 245.085 246.938 254.731 1.00 0.00 C +ATOM 120 CA ALA A 120 242.449 245.806 257.238 1.00 0.00 C +ATOM 121 CA ARG A 121 242.042 242.021 257.397 1.00 0.00 C +ATOM 122 CA GLN A 122 243.655 238.573 257.545 1.00 0.00 C +ATOM 123 CA ARG A 123 244.562 235.148 258.946 1.00 0.00 C +ATOM 124 CA ASP A 124 247.777 234.977 260.983 1.00 0.00 C +ATOM 125 CA GLY A 125 251.548 234.599 260.588 1.00 0.00 C +ATOM 126 CA ALA A 126 254.399 233.558 262.890 1.00 0.00 C +ATOM 127 CA ARG A 127 253.774 230.993 265.637 1.00 0.00 C +ATOM 128 CA ARG A 128 253.983 230.779 269.435 1.00 0.00 C +ATOM 129 CA GLY A 129 251.933 231.797 272.481 1.00 0.00 C +ATOM 130 CA SER A 130 248.172 231.392 272.025 1.00 0.00 C +ATOM 131 CA GLY A 131 246.169 228.783 270.103 1.00 0.00 C +ATOM 132 CA ASP A 132 244.395 229.651 266.845 1.00 0.00 C +ATOM 133 CA GLY A 133 244.669 229.634 263.045 1.00 0.00 C +ATOM 134 CA ASP A 134 241.442 229.715 261.020 1.00 0.00 C +ATOM 135 CA GLY A 135 239.402 232.919 261.315 1.00 0.00 C +ATOM 136 CA ARG A 136 237.902 235.714 259.204 1.00 0.00 C +ATOM 137 CA ARG A 137 237.393 238.603 261.636 1.00 0.00 C +ATOM 138 CA ARG A 138 235.411 240.938 263.902 1.00 0.00 C +ATOM 139 CA ARG A 139 234.132 242.765 266.991 1.00 0.00 C +ATOM 140 CA GLY A 140 231.625 245.487 266.087 1.00 0.00 C +ATOM 141 CA ALA A 141 229.411 246.123 263.052 1.00 0.00 C +ATOM 142 CA GLN A 142 226.579 243.585 262.814 1.00 0.00 C +ATOM 143 CA GLY A 143 223.240 244.176 261.076 1.00 0.00 C +ATOM 144 CA GLN A 144 223.476 247.151 258.707 1.00 0.00 C +ATOM 145 CA LEU A 145 222.802 250.697 257.488 1.00 0.00 C +ATOM 146 CA GLY A 146 224.121 253.857 255.817 1.00 0.00 C +ATOM 147 CA ARG A 147 226.059 254.218 252.557 1.00 0.00 C +ATOM 148 CA ARG A 148 224.794 251.754 249.941 1.00 0.00 C +ATOM 149 CA GLY A 149 227.856 249.997 248.508 1.00 0.00 C +ATOM 150 CA PHE A 150 231.542 250.511 249.326 1.00 0.00 C +ATOM 151 CA ILE A 151 234.019 250.257 252.209 1.00 0.00 C +ATOM 152 CA PRO A 152 233.381 248.227 255.370 1.00 0.00 C +ATOM 153 CA ASN A 153 230.674 245.703 256.274 1.00 0.00 C +TER 154 ASN A 153 +END diff --git a/Plants/Q8S6V8/Q8S6V8.dcd b/Plants/Q8S6V8/Q8S6V8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..8f2ec7e2ef567c735752b29c1e1957a63cf0a353 --- /dev/null +++ b/Plants/Q8S6V8/Q8S6V8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:a1feeccf6654e8b010c8317c173c1dc29c0a74a47dfbbbe3babdd3b29e0e2c17 +size 17960276 diff --git a/Plants/Q8S6V8/top.pdb b/Plants/Q8S6V8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..2bbfee74ebfee37d89f749b33da0892f06fa8f33 --- /dev/null +++ b/Plants/Q8S6V8/top.pdb @@ -0,0 +1,147 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 220.900 247.678 175.338 1.00 0.00 C +ATOM 2 CA PRO A 2 224.556 247.266 174.349 1.00 0.00 C +ATOM 3 CA GLU A 3 227.479 246.972 176.775 1.00 0.00 C +ATOM 4 CA GLU A 4 230.398 246.206 179.100 1.00 0.00 C +ATOM 5 CA THR A 5 231.355 245.752 182.760 1.00 0.00 C +ATOM 6 CA ALA A 6 232.596 243.734 185.743 1.00 0.00 C +ATOM 7 CA THR A 7 232.621 246.126 188.708 1.00 0.00 C +ATOM 8 CA SER A 8 231.276 249.576 189.605 1.00 0.00 C +ATOM 9 CA ALA A 9 232.038 250.296 193.268 1.00 0.00 C +ATOM 10 CA GLY A 10 232.379 254.067 193.688 1.00 0.00 C +ATOM 11 CA ALA A 11 229.842 256.098 191.698 1.00 0.00 C +ATOM 12 CA TRP A 12 226.148 255.186 191.884 1.00 0.00 C +ATOM 13 CA ALA A 13 222.989 257.142 191.041 1.00 0.00 C +ATOM 14 CA ARG A 14 219.993 256.043 193.121 1.00 0.00 C +ATOM 15 CA ARG A 15 217.874 253.297 194.699 1.00 0.00 C +ATOM 16 CA LYS A 16 218.583 251.103 197.732 1.00 0.00 C +ATOM 17 CA GLY A 17 216.225 250.111 200.555 1.00 0.00 C +ATOM 18 CA LEU A 18 212.825 249.965 202.268 1.00 0.00 C +ATOM 19 CA PRO A 19 212.733 252.208 205.347 1.00 0.00 C +ATOM 20 CA LYS A 20 210.915 251.657 208.649 1.00 0.00 C +ATOM 21 CA GLU A 21 211.000 252.376 212.390 1.00 0.00 C +ATOM 22 CA LEU A 22 207.940 252.018 214.630 1.00 0.00 C +ATOM 23 CA ARG A 23 208.593 249.791 217.652 1.00 0.00 C +ATOM 24 CA ARG A 24 207.325 251.183 220.964 1.00 0.00 C +ATOM 25 CA GLY A 25 207.546 254.941 221.552 1.00 0.00 C +ATOM 26 CA GLY A 26 210.918 256.659 221.109 1.00 0.00 C +ATOM 27 CA GLY A 27 214.068 257.076 219.006 1.00 0.00 C +ATOM 28 CA ARG A 28 215.531 253.858 217.584 1.00 0.00 C +ATOM 29 CA ASP A 29 216.970 252.397 214.373 1.00 0.00 C +ATOM 30 CA ARG A 30 218.452 249.896 211.909 1.00 0.00 C +ATOM 31 CA GLY A 31 220.999 247.177 211.116 1.00 0.00 C +ATOM 32 CA GLN A 32 223.302 246.457 214.065 1.00 0.00 C +ATOM 33 CA ALA A 33 225.977 249.130 214.529 1.00 0.00 C +ATOM 34 CA GLY A 34 227.196 252.666 213.803 1.00 0.00 C +ATOM 35 CA VAL A 35 227.866 255.950 215.615 1.00 0.00 C +ATOM 36 CA GLU A 36 231.344 257.457 216.004 1.00 0.00 C +ATOM 37 CA GLY A 37 233.810 256.702 213.199 1.00 0.00 C +ATOM 38 CA ASP A 38 235.603 255.387 210.106 1.00 0.00 C +ATOM 39 CA ALA A 39 239.083 256.915 209.839 1.00 0.00 C +ATOM 40 CA ALA A 40 242.410 255.188 210.519 1.00 0.00 C +ATOM 41 CA THR A 41 245.408 257.447 209.870 1.00 0.00 C +ATOM 42 CA SER A 42 244.315 261.072 209.447 1.00 0.00 C +ATOM 43 CA ARG A 43 242.235 264.009 210.697 1.00 0.00 C +ATOM 44 CA GLU A 44 239.260 262.649 212.650 1.00 0.00 C +ATOM 45 CA GLU A 45 238.398 262.505 216.359 1.00 0.00 C +ATOM 46 CA MET A 46 240.496 260.503 218.830 1.00 0.00 C +ATOM 47 CA VAL A 47 241.663 258.856 222.061 1.00 0.00 C +ATOM 48 CA THR A 48 241.028 255.404 223.544 1.00 0.00 C +ATOM 49 CA SER A 49 237.386 254.381 223.998 1.00 0.00 C +ATOM 50 CA VAL A 50 235.938 255.724 227.256 1.00 0.00 C +ATOM 51 CA GLY A 51 234.792 257.542 230.402 1.00 0.00 C +ATOM 52 CA VAL A 52 231.766 257.469 232.716 1.00 0.00 C +ATOM 53 CA PRO A 53 228.192 256.939 233.926 1.00 0.00 C +ATOM 54 CA VAL A 54 226.828 260.217 235.309 1.00 0.00 C +ATOM 55 CA MET A 55 223.685 261.241 233.415 1.00 0.00 C +ATOM 56 CA ASN A 56 223.821 264.851 232.205 1.00 0.00 C +ATOM 57 CA SER A 57 226.935 266.743 233.318 1.00 0.00 C +ATOM 58 CA SER A 58 229.203 268.058 236.083 1.00 0.00 C +ATOM 59 CA ARG A 59 230.445 265.528 238.647 1.00 0.00 C +ATOM 60 CA PRO A 60 227.441 264.662 240.825 1.00 0.00 C +ATOM 61 CA GLU A 61 224.802 263.186 243.143 1.00 0.00 C +ATOM 62 CA THR A 62 225.049 263.929 246.872 1.00 0.00 C +ATOM 63 CA GLU A 63 223.788 260.802 248.647 1.00 0.00 C +ATOM 64 CA GLN A 64 224.694 261.366 252.305 1.00 0.00 C +ATOM 65 CA TRP A 65 226.833 262.008 255.392 1.00 0.00 C +ATOM 66 CA ARG A 66 228.902 263.380 258.282 1.00 0.00 C +ATOM 67 CA GLN A 67 230.933 262.737 261.440 1.00 0.00 C +ATOM 68 CA ARG A 68 231.566 258.980 261.424 1.00 0.00 C +ATOM 69 CA HIS A 69 229.616 255.706 261.408 1.00 0.00 C +ATOM 70 CA CYS A 70 227.498 255.800 264.573 1.00 0.00 C +ATOM 71 CA CYS A 71 229.225 257.419 267.559 1.00 0.00 C +ATOM 72 CA ARG A 72 228.390 261.135 267.634 1.00 0.00 C +ATOM 73 CA ARG A 73 230.332 263.419 269.986 1.00 0.00 C +ATOM 74 CA GLY A 74 234.077 262.716 270.032 1.00 0.00 C +ATOM 75 CA CYS A 75 236.398 264.294 272.609 1.00 0.00 C +ATOM 76 CA THR A 76 239.372 262.458 274.126 1.00 0.00 C +ATOM 77 CA SER A 77 240.772 259.662 271.950 1.00 0.00 C +ATOM 78 CA GLY A 78 241.721 256.103 272.925 1.00 0.00 C +ATOM 79 CA GLY A 79 242.679 256.330 276.606 1.00 0.00 C +ATOM 80 CA LEU A 80 245.037 257.019 279.518 1.00 0.00 C +ATOM 81 CA ARG A 81 246.888 254.417 281.596 1.00 0.00 C +ATOM 82 CA GLY A 82 250.682 254.074 281.520 1.00 0.00 C +ATOM 83 CA LYS A 83 254.113 255.148 280.259 1.00 0.00 C +ATOM 84 CA GLN A 84 256.931 253.836 282.461 1.00 0.00 C +ATOM 85 CA ARG A 85 259.851 255.869 283.823 1.00 0.00 C +ATOM 86 CA ALA A 86 259.132 256.194 287.550 1.00 0.00 C +ATOM 87 CA GLY A 87 255.757 257.839 288.200 1.00 0.00 C +ATOM 88 CA ARG A 88 254.017 260.601 290.163 1.00 0.00 C +ATOM 89 CA ARG A 89 254.704 264.322 290.614 1.00 0.00 C +ATOM 90 CA ARG A 90 252.012 265.989 292.733 1.00 0.00 C +ATOM 91 CA GLY A 91 253.169 266.855 296.258 1.00 0.00 C +ATOM 92 CA GLY A 92 255.568 265.713 298.989 1.00 0.00 C +ATOM 93 CA GLY A 93 257.084 263.479 301.678 1.00 0.00 C +ATOM 94 CA CYS A 94 259.831 265.386 303.504 1.00 0.00 C +ATOM 95 CA ASP A 95 260.057 268.984 304.737 1.00 0.00 C +ATOM 96 CA ALA A 96 262.812 270.517 302.598 1.00 0.00 C +ATOM 97 CA GLY A 97 266.071 268.585 302.200 1.00 0.00 C +ATOM 98 CA GLY A 98 266.957 267.015 298.843 1.00 0.00 C +ATOM 99 CA GLY A 99 270.377 265.337 298.799 1.00 0.00 C +ATOM 100 CA ASP A 100 272.946 263.591 301.005 1.00 0.00 C +ATOM 101 CA GLY A 101 275.222 260.699 301.991 1.00 0.00 C +ATOM 102 CA THR A 102 278.927 260.138 302.680 1.00 0.00 C +ATOM 103 CA ALA A 103 280.715 256.775 302.628 1.00 0.00 C +ATOM 104 CA GLY A 104 284.471 256.134 302.669 1.00 0.00 C +ATOM 105 CA ARG A 105 287.501 254.089 303.745 1.00 0.00 C +ATOM 106 CA ARG A 106 288.369 251.312 301.285 1.00 0.00 C +ATOM 107 CA SER A 107 290.113 248.594 299.264 1.00 0.00 C +ATOM 108 CA GLY A 108 291.947 245.983 297.182 1.00 0.00 C +ATOM 109 CA GLU A 109 291.758 243.796 294.068 1.00 0.00 C +ATOM 110 CA GLU A 110 288.361 242.069 294.051 1.00 0.00 C +ATOM 111 CA GLY A 111 285.446 240.577 295.997 1.00 0.00 C +ATOM 112 CA GLU A 112 283.168 238.254 294.013 1.00 0.00 C +ATOM 113 CA ALA A 113 283.228 234.748 292.524 1.00 0.00 C +ATOM 114 CA ALA A 114 280.326 232.780 294.015 1.00 0.00 C +ATOM 115 CA GLY A 115 281.341 229.118 293.750 1.00 0.00 C +ATOM 116 CA GLY A 116 280.748 225.598 295.081 1.00 0.00 C +ATOM 117 CA GLY A 117 280.857 223.376 291.988 1.00 0.00 C +ATOM 118 CA ARG A 118 281.764 219.822 290.958 1.00 0.00 C +ATOM 119 CA ARG A 119 278.977 217.280 290.421 1.00 0.00 C +ATOM 120 CA GLY A 120 277.884 216.761 286.808 1.00 0.00 C +ATOM 121 CA GLU A 121 278.666 214.659 283.728 1.00 0.00 C +ATOM 122 CA LYS A 122 281.723 215.498 281.615 1.00 0.00 C +ATOM 123 CA ARG A 123 282.900 213.166 278.842 1.00 0.00 C +ATOM 124 CA ARG A 124 282.888 215.302 275.688 1.00 0.00 C +ATOM 125 CA ALA A 125 284.976 218.462 275.274 1.00 0.00 C +ATOM 126 CA THR A 126 288.118 218.964 273.179 1.00 0.00 C +ATOM 127 CA ALA A 127 290.848 218.494 270.563 1.00 0.00 C +ATOM 128 CA GLY A 128 294.392 218.200 269.195 1.00 0.00 C +ATOM 129 CA ARG A 129 295.785 219.704 265.984 1.00 0.00 C +ATOM 130 CA GLY A 130 296.897 221.695 262.932 1.00 0.00 C +ATOM 131 CA ASP A 131 298.133 224.814 261.126 1.00 0.00 C +ATOM 132 CA THR A 132 295.296 227.358 261.135 1.00 0.00 C +ATOM 133 CA THR A 133 293.755 230.641 262.303 1.00 0.00 C +ATOM 134 CA THR A 134 294.226 234.120 260.825 1.00 0.00 C +ATOM 135 CA GLY A 135 296.414 236.757 259.158 1.00 0.00 C +ATOM 136 CA ARG A 136 295.525 239.277 256.441 1.00 0.00 C +ATOM 137 CA LEU A 137 295.827 238.631 252.699 1.00 0.00 C +ATOM 138 CA GLY A 138 294.582 236.332 249.927 1.00 0.00 C +ATOM 139 CA MET A 139 292.795 233.501 248.109 1.00 0.00 C +ATOM 140 CA ARG A 140 289.076 234.067 248.713 1.00 0.00 C +ATOM 141 CA LEU A 141 285.553 232.623 248.598 1.00 0.00 C +ATOM 142 CA LYS A 142 281.832 232.909 247.828 1.00 0.00 C +ATOM 143 CA ARG A 143 279.140 235.222 249.213 1.00 0.00 C +TER 144 ARG A 143 +END diff --git a/Plants/Q8S6W2/Q8S6W2.dcd b/Plants/Q8S6W2/Q8S6W2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..4120b98bf079d166c6d2ed1421a98dce54e6b93b --- /dev/null +++ b/Plants/Q8S6W2/Q8S6W2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:b76cd6d3151f3010cd1ecbc0983339fca1e1f3d5fec0c824839ee8197403563f +size 16160276 diff --git a/Plants/Q8S6W2/top.pdb b/Plants/Q8S6W2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..c0d84bf9b61814bee35ef3d1a1bbfbca8b440ebe --- /dev/null +++ b/Plants/Q8S6W2/top.pdb @@ -0,0 +1,132 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 241.489 250.387 290.986 1.00 0.00 C +ATOM 2 CA ALA A 2 240.015 248.106 288.314 1.00 0.00 C +ATOM 3 CA ASP A 3 242.540 246.016 286.370 1.00 0.00 C +ATOM 4 CA GLY A 4 244.968 246.353 283.454 1.00 0.00 C +ATOM 5 CA ASN A 5 247.147 249.465 283.747 1.00 0.00 C +ATOM 6 CA ASP A 6 247.744 251.036 280.328 1.00 0.00 C +ATOM 7 CA ASP A 7 249.283 248.281 278.192 1.00 0.00 C +ATOM 8 CA VAL A 8 252.056 246.601 276.191 1.00 0.00 C +ATOM 9 CA SER A 9 254.071 243.368 276.169 1.00 0.00 C +ATOM 10 CA ASP A 10 254.568 239.987 274.483 1.00 0.00 C +ATOM 11 CA ASP A 11 255.618 238.600 271.094 1.00 0.00 C +ATOM 12 CA VAL A 12 255.000 241.030 268.225 1.00 0.00 C +ATOM 13 CA ILE A 13 255.216 243.991 265.838 1.00 0.00 C +ATOM 14 CA THR A 14 255.760 247.663 266.699 1.00 0.00 C +ATOM 15 CA GLY A 15 257.643 250.975 266.655 1.00 0.00 C +ATOM 16 CA ASP A 16 256.235 254.386 267.603 1.00 0.00 C +ATOM 17 CA GLY A 17 254.798 257.912 267.469 1.00 0.00 C +ATOM 18 CA SER A 18 252.457 258.228 270.458 1.00 0.00 C +ATOM 19 CA SER A 19 251.376 256.468 273.660 1.00 0.00 C +ATOM 20 CA GLY A 20 249.390 253.524 275.040 1.00 0.00 C +ATOM 21 CA ALA A 21 245.786 254.495 275.803 1.00 0.00 C +ATOM 22 CA CYS A 22 243.833 257.045 277.853 1.00 0.00 C +ATOM 23 CA SER A 23 241.160 258.453 280.174 1.00 0.00 C +ATOM 24 CA PRO A 24 239.399 261.825 280.395 1.00 0.00 C +ATOM 25 CA ALA A 25 237.918 262.446 276.940 1.00 0.00 C +ATOM 26 CA ASN A 26 235.305 260.031 275.577 1.00 0.00 C +ATOM 27 CA ASP A 27 231.838 258.629 274.852 1.00 0.00 C +ATOM 28 CA GLY A 28 230.608 255.104 275.611 1.00 0.00 C +ATOM 29 CA ALA A 29 230.029 252.971 278.714 1.00 0.00 C +ATOM 30 CA THR A 30 228.149 250.878 281.284 1.00 0.00 C +ATOM 31 CA THR A 31 224.664 249.525 280.551 1.00 0.00 C +ATOM 32 CA GLN A 32 224.159 246.504 282.817 1.00 0.00 C +ATOM 33 CA THR A 33 224.321 244.183 285.835 1.00 0.00 C +ATOM 34 CA GLU A 34 223.296 240.612 284.990 1.00 0.00 C +ATOM 35 CA ASP A 35 222.071 238.730 281.912 1.00 0.00 C +ATOM 36 CA THR A 36 219.871 239.107 278.825 1.00 0.00 C +ATOM 37 CA ASN A 37 221.501 240.724 275.785 1.00 0.00 C +ATOM 38 CA GLY A 38 218.964 242.801 273.843 1.00 0.00 C +ATOM 39 CA ALA A 39 218.230 246.275 275.223 1.00 0.00 C +ATOM 40 CA PRO A 40 216.553 249.505 274.095 1.00 0.00 C +ATOM 41 CA ALA A 41 216.784 252.963 275.677 1.00 0.00 C +ATOM 42 CA VAL A 42 220.228 254.556 276.023 1.00 0.00 C +ATOM 43 CA PHE A 43 222.297 256.665 273.617 1.00 0.00 C +ATOM 44 CA GLY A 44 222.521 260.458 273.333 1.00 0.00 C +ATOM 45 CA GLY A 45 224.987 263.237 274.180 1.00 0.00 C +ATOM 46 CA GLY A 46 224.328 266.873 273.250 1.00 0.00 C +ATOM 47 CA GLU A 47 224.326 270.677 273.449 1.00 0.00 C +ATOM 48 CA ALA A 48 224.446 271.889 269.839 1.00 0.00 C +ATOM 49 CA VAL A 49 225.717 270.745 266.435 1.00 0.00 C +ATOM 50 CA ASP A 50 228.493 268.568 264.997 1.00 0.00 C +ATOM 51 CA GLY A 51 231.291 266.193 263.975 1.00 0.00 C +ATOM 52 CA ASP A 52 234.321 267.875 262.392 1.00 0.00 C +ATOM 53 CA GLY A 53 236.421 269.586 259.712 1.00 0.00 C +ATOM 54 CA ASP A 54 239.865 270.961 258.840 1.00 0.00 C +ATOM 55 CA ASP A 55 242.147 272.499 261.475 1.00 0.00 C +ATOM 56 CA LEU A 56 242.815 269.855 264.136 1.00 0.00 C +ATOM 57 CA ALA A 57 243.729 266.675 262.248 1.00 0.00 C +ATOM 58 CA ILE A 58 243.968 262.879 262.480 1.00 0.00 C +ATOM 59 CA PRO A 59 241.558 260.240 261.160 1.00 0.00 C +ATOM 60 CA MET A 60 241.905 256.636 262.346 1.00 0.00 C +ATOM 61 CA VAL A 61 240.954 253.082 261.356 1.00 0.00 C +ATOM 62 CA ALA A 62 238.183 251.205 263.177 1.00 0.00 C +ATOM 63 CA THR A 63 238.311 247.708 264.683 1.00 0.00 C +ATOM 64 CA ALA A 64 240.819 244.880 265.158 1.00 0.00 C +ATOM 65 CA THR A 65 241.064 241.081 265.324 1.00 0.00 C +ATOM 66 CA ASP A 66 244.271 239.335 264.236 1.00 0.00 C +ATOM 67 CA ASP A 67 247.341 238.886 262.025 1.00 0.00 C +ATOM 68 CA GLY A 68 247.305 240.423 258.539 1.00 0.00 C +ATOM 69 CA GLY A 69 246.041 238.096 255.799 1.00 0.00 C +ATOM 70 CA CYS A 70 242.796 236.651 254.420 1.00 0.00 C +ATOM 71 CA ASN A 71 243.851 234.236 251.668 1.00 0.00 C +ATOM 72 CA GLY A 72 245.309 235.003 248.233 1.00 0.00 C +ATOM 73 CA GLY A 73 245.869 235.651 244.520 1.00 0.00 C +ATOM 74 CA PRO A 74 246.824 233.871 241.290 1.00 0.00 C +ATOM 75 CA ALA A 75 250.403 234.310 240.060 1.00 0.00 C +ATOM 76 CA ARG A 76 253.862 233.678 238.593 1.00 0.00 C +ATOM 77 CA LEU A 77 257.306 234.570 239.954 1.00 0.00 C +ATOM 78 CA ASN A 78 259.791 232.121 238.424 1.00 0.00 C +ATOM 79 CA ARG A 79 258.934 229.722 235.590 1.00 0.00 C +ATOM 80 CA ARG A 80 256.040 230.087 233.139 1.00 0.00 C +ATOM 81 CA GLN A 81 256.897 228.906 229.619 1.00 0.00 C +ATOM 82 CA ARG A 82 258.876 228.258 226.428 1.00 0.00 C +ATOM 83 CA ARG A 83 261.654 229.715 224.266 1.00 0.00 C +ATOM 84 CA ARG A 84 264.492 231.788 225.739 1.00 0.00 C +ATOM 85 CA ARG A 85 263.922 234.042 228.758 1.00 0.00 C +ATOM 86 CA LEU A 86 262.544 233.695 232.293 1.00 0.00 C +ATOM 87 CA GLY A 87 264.461 235.364 235.131 1.00 0.00 C +ATOM 88 CA LEU A 88 263.540 239.060 235.222 1.00 0.00 C +ATOM 89 CA ARG A 89 262.522 242.597 236.208 1.00 0.00 C +ATOM 90 CA GLY A 90 263.151 245.248 233.545 1.00 0.00 C +ATOM 91 CA GLY A 91 261.865 246.344 230.130 1.00 0.00 C +ATOM 92 CA SER A 92 262.400 246.027 226.371 1.00 0.00 C +ATOM 93 CA ALA A 93 263.786 245.441 222.871 1.00 0.00 C +ATOM 94 CA ARG A 94 261.484 245.947 219.878 1.00 0.00 C +ATOM 95 CA ARG A 95 261.862 249.644 219.035 1.00 0.00 C +ATOM 96 CA ASP A 96 260.721 251.655 216.007 1.00 0.00 C +ATOM 97 CA GLY A 97 261.779 250.559 212.514 1.00 0.00 C +ATOM 98 CA GLY A 98 265.481 251.346 212.075 1.00 0.00 C +ATOM 99 CA LEU A 99 268.660 253.062 210.865 1.00 0.00 C +ATOM 100 CA ARG A 100 267.846 254.418 207.399 1.00 0.00 C +ATOM 101 CA GLN A 101 269.882 256.444 204.896 1.00 0.00 C +ATOM 102 CA ARG A 102 270.404 259.065 202.181 1.00 0.00 C +ATOM 103 CA ARG A 103 271.981 262.380 201.161 1.00 0.00 C +ATOM 104 CA SER A 104 270.020 265.562 200.425 1.00 0.00 C +ATOM 105 CA ASP A 105 266.815 265.608 202.485 1.00 0.00 C +ATOM 106 CA LEU A 106 266.350 265.781 206.263 1.00 0.00 C +ATOM 107 CA GLU A 107 264.663 263.100 208.380 1.00 0.00 C +ATOM 108 CA GLY A 108 266.635 261.385 211.152 1.00 0.00 C +ATOM 109 CA ASP A 109 267.759 261.102 214.781 1.00 0.00 C +ATOM 110 CA ASP A 110 270.239 262.714 217.183 1.00 0.00 C +ATOM 111 CA GLY A 111 271.354 260.766 220.262 1.00 0.00 C +ATOM 112 CA GLY A 112 271.438 257.987 222.867 1.00 0.00 C +ATOM 113 CA ALA A 113 270.969 254.246 222.321 1.00 0.00 C +ATOM 114 CA ALA A 114 270.698 251.089 220.204 1.00 0.00 C +ATOM 115 CA LEU A 115 268.732 249.736 217.235 1.00 0.00 C +ATOM 116 CA GLY A 116 267.093 246.474 216.146 1.00 0.00 C +ATOM 117 CA PHE A 117 265.683 243.861 213.758 1.00 0.00 C +ATOM 118 CA GLU A 118 263.442 241.226 215.356 1.00 0.00 C +ATOM 119 CA ARG A 119 264.562 240.265 218.869 1.00 0.00 C +ATOM 120 CA GLN A 120 268.291 240.385 219.641 1.00 0.00 C +ATOM 121 CA PRO A 121 271.244 242.791 219.535 1.00 0.00 C +ATOM 122 CA ALA A 122 273.074 242.989 222.871 1.00 0.00 C +ATOM 123 CA ARG A 123 272.248 245.616 225.503 1.00 0.00 C +ATOM 124 CA GLY A 124 273.554 248.521 227.594 1.00 0.00 C +ATOM 125 CA GLY A 125 275.805 251.484 226.776 1.00 0.00 C +ATOM 126 CA ARG A 126 278.430 253.891 228.130 1.00 0.00 C +ATOM 127 CA GLN A 127 279.060 255.916 231.296 1.00 0.00 C +ATOM 128 CA ALA A 128 279.181 259.654 230.572 1.00 0.00 C +TER 129 ALA A 128 +END diff --git a/Plants/Q8S6W8/Q8S6W8.dcd b/Plants/Q8S6W8/Q8S6W8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..9567554993f205ce21103cd41128d42cad9d574c --- /dev/null +++ b/Plants/Q8S6W8/Q8S6W8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:24fee8a1a3f99e664981f943ef254ec50c5a158f37e7923c19e18a71a8602387 +size 101440276 diff --git a/Plants/Q8S6W8/top.pdb b/Plants/Q8S6W8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..8c8ef83fba496aac69aa58153ea6e800434a1de9 --- /dev/null +++ b/Plants/Q8S6W8/top.pdb @@ -0,0 +1,420 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 1030.000 1030.000 1030.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 475.215 507.031 663.545 1.00 0.00 C +ATOM 2 CA GLU A 2 477.609 509.535 665.132 1.00 0.00 C +ATOM 3 CA ALA A 3 478.407 512.799 663.336 1.00 0.00 C +ATOM 4 CA ASP A 4 478.247 515.504 666.013 1.00 0.00 C +ATOM 5 CA PRO A 5 478.354 518.711 668.068 1.00 0.00 C +ATOM 6 CA VAL A 6 479.724 522.251 668.398 1.00 0.00 C +ATOM 7 CA CYS A 7 477.848 523.859 671.297 1.00 0.00 C +ATOM 8 CA GLN A 8 477.115 523.446 675.013 1.00 0.00 C +ATOM 9 CA PRO A 9 473.749 521.809 675.722 1.00 0.00 C +ATOM 10 CA ARG A 10 473.631 521.539 679.521 1.00 0.00 C +ATOM 11 CA ARG A 11 475.415 519.039 681.775 1.00 0.00 C +ATOM 12 CA VAL A 12 475.610 518.004 685.437 1.00 0.00 C +ATOM 13 CA ALA A 13 478.394 518.002 688.038 1.00 0.00 C +ATOM 14 CA ASP A 14 480.654 516.366 690.632 1.00 0.00 C +ATOM 15 CA LYS A 15 481.449 513.631 693.163 1.00 0.00 C +ATOM 16 CA ARG A 16 480.161 510.062 693.507 1.00 0.00 C +ATOM 17 CA THR A 17 479.244 507.167 695.808 1.00 0.00 C +ATOM 18 CA PRO A 18 476.757 506.648 698.647 1.00 0.00 C +ATOM 19 CA LEU A 19 473.594 507.349 700.652 1.00 0.00 C +ATOM 20 CA GLY A 20 474.425 507.890 704.331 1.00 0.00 C +ATOM 21 CA THR A 21 478.228 508.099 704.417 1.00 0.00 C +ATOM 22 CA THR A 22 481.628 507.166 705.861 1.00 0.00 C +ATOM 23 CA ARG A 23 482.544 503.638 704.752 1.00 0.00 C +ATOM 24 CA VAL A 24 483.152 501.524 707.862 1.00 0.00 C +ATOM 25 CA ALA A 25 484.133 503.071 711.203 1.00 0.00 C +ATOM 26 CA HIS A 26 481.083 502.780 713.467 1.00 0.00 C +ATOM 27 CA VAL A 27 480.750 499.469 715.323 1.00 0.00 C +ATOM 28 CA GLU A 28 477.832 497.104 714.683 1.00 0.00 C +ATOM 29 CA THR A 29 475.370 498.450 712.106 1.00 0.00 C +ATOM 30 CA THR A 30 471.878 499.581 713.126 1.00 0.00 C +ATOM 31 CA ARG A 31 469.261 497.390 711.433 1.00 0.00 C +ATOM 32 CA LEU A 32 465.715 496.044 711.069 1.00 0.00 C +ATOM 33 CA PRO A 33 465.842 492.474 712.392 1.00 0.00 C +ATOM 34 CA SER A 34 467.026 489.268 710.707 1.00 0.00 C +ATOM 35 CA GLY A 35 469.601 486.547 711.404 1.00 0.00 C +ATOM 36 CA HIS A 36 470.091 483.827 714.026 1.00 0.00 C +ATOM 37 CA THR A 37 473.452 482.813 715.506 1.00 0.00 C +ATOM 38 CA ASN A 38 474.059 479.268 714.248 1.00 0.00 C +ATOM 39 CA THR A 39 477.528 478.646 712.800 1.00 0.00 C +ATOM 40 CA ASP A 40 480.417 477.285 710.723 1.00 0.00 C +ATOM 41 CA THR A 41 483.542 476.288 708.783 1.00 0.00 C +ATOM 42 CA THR A 42 485.220 472.874 708.577 1.00 0.00 C +ATOM 43 CA ARG A 43 482.874 470.276 707.073 1.00 0.00 C +ATOM 44 CA SER A 44 483.359 470.247 703.294 1.00 0.00 C +ATOM 45 CA PRO A 45 484.147 466.774 701.939 1.00 0.00 C +ATOM 46 CA PRO A 46 484.608 466.083 698.221 1.00 0.00 C +ATOM 47 CA ALA A 47 482.663 464.333 695.451 1.00 0.00 C +ATOM 48 CA HIS A 48 483.615 461.034 693.801 1.00 0.00 C +ATOM 49 CA VAL A 49 487.174 460.318 694.956 1.00 0.00 C +ATOM 50 CA ASN A 50 487.373 458.361 698.219 1.00 0.00 C +ATOM 51 CA ASP A 51 487.643 454.575 698.546 1.00 0.00 C +ATOM 52 CA TYR A 52 490.873 452.876 697.451 1.00 0.00 C +ATOM 53 CA ARG A 53 494.525 452.335 696.511 1.00 0.00 C +ATOM 54 CA HIS A 54 496.727 455.435 696.258 1.00 0.00 C +ATOM 55 CA ARG A 55 500.338 454.303 695.816 1.00 0.00 C +ATOM 56 CA TYR A 56 503.725 454.039 697.539 1.00 0.00 C +ATOM 57 CA THR A 57 504.024 453.621 701.314 1.00 0.00 C +ATOM 58 CA GLY A 58 506.368 452.527 704.112 1.00 0.00 C +ATOM 59 CA THR A 59 509.781 451.253 702.997 1.00 0.00 C +ATOM 60 CA GLY A 60 513.463 450.298 702.790 1.00 0.00 C +ATOM 61 CA VAL A 61 516.662 449.950 700.750 1.00 0.00 C +ATOM 62 CA ASP A 62 516.288 446.751 698.714 1.00 0.00 C +ATOM 63 CA ASP A 63 513.772 443.891 698.703 1.00 0.00 C +ATOM 64 CA ARG A 64 512.186 441.079 696.680 1.00 0.00 C +ATOM 65 CA THR A 65 511.536 439.036 693.530 1.00 0.00 C +ATOM 66 CA THR A 66 512.181 439.001 689.775 1.00 0.00 C +ATOM 67 CA GLY A 67 514.254 440.283 686.847 1.00 0.00 C +ATOM 68 CA SER A 68 513.996 442.250 683.594 1.00 0.00 C +ATOM 69 CA GLY A 69 515.523 441.185 680.270 1.00 0.00 C +ATOM 70 CA ARG A 70 513.146 440.014 677.532 1.00 0.00 C +ATOM 71 CA HIS A 71 509.409 439.281 677.664 1.00 0.00 C +ATOM 72 CA ARG A 72 505.642 439.821 677.843 1.00 0.00 C +ATOM 73 CA LYS A 73 502.463 440.397 675.823 1.00 0.00 C +ATOM 74 CA ASP A 74 498.806 439.685 676.617 1.00 0.00 C +ATOM 75 CA GLU A 75 495.888 440.155 679.022 1.00 0.00 C +ATOM 76 CA ASP A 76 493.391 440.094 681.900 1.00 0.00 C +ATOM 77 CA GLY A 77 489.831 441.242 681.178 1.00 0.00 C +ATOM 78 CA ALA A 78 486.762 441.149 678.922 1.00 0.00 C +ATOM 79 CA ALA A 79 486.270 443.166 675.728 1.00 0.00 C +ATOM 80 CA ARG A 80 483.182 443.732 673.570 1.00 0.00 C +ATOM 81 CA GLU A 81 481.227 446.978 673.169 1.00 0.00 C +ATOM 82 CA ARG A 82 480.830 450.460 671.673 1.00 0.00 C +ATOM 83 CA GLU A 83 481.351 454.094 670.657 1.00 0.00 C +ATOM 84 CA PRO A 84 480.801 456.941 673.128 1.00 0.00 C +ATOM 85 CA TYR A 85 481.182 457.637 676.855 1.00 0.00 C +ATOM 86 CA HIS A 86 480.484 455.664 680.038 1.00 0.00 C +ATOM 87 CA HIS A 87 478.310 452.734 681.137 1.00 0.00 C +ATOM 88 CA ALA A 88 475.596 451.056 679.055 1.00 0.00 C +ATOM 89 CA THR A 89 473.659 448.272 677.319 1.00 0.00 C +ATOM 90 CA ARG A 90 474.554 446.964 673.854 1.00 0.00 C +ATOM 91 CA ARG A 91 474.300 446.259 670.119 1.00 0.00 C +ATOM 92 CA GLY A 92 472.690 447.069 666.762 1.00 0.00 C +ATOM 93 CA SER A 93 475.097 449.205 664.721 1.00 0.00 C +ATOM 94 CA ASP A 94 474.813 452.433 662.717 1.00 0.00 C +ATOM 95 CA ASN A 95 473.395 454.801 660.091 1.00 0.00 C +ATOM 96 CA ASP A 96 473.034 458.533 660.768 1.00 0.00 C +ATOM 97 CA GLU A 97 469.279 459.164 660.644 1.00 0.00 C +ATOM 98 CA ARG A 98 468.289 461.938 658.228 1.00 0.00 C +ATOM 99 CA ALA A 99 469.062 465.661 657.982 1.00 0.00 C +ATOM 100 CA ARG A 100 467.567 468.577 659.927 1.00 0.00 C +ATOM 101 CA ARG A 101 468.562 472.004 661.261 1.00 0.00 C +ATOM 102 CA ARG A 102 469.197 474.782 658.732 1.00 0.00 C +ATOM 103 CA GLN A 103 470.492 477.138 656.032 1.00 0.00 C +ATOM 104 CA THR A 104 470.319 477.958 652.316 1.00 0.00 C +ATOM 105 CA GLY A 105 471.999 478.942 649.041 1.00 0.00 C +ATOM 106 CA THR A 106 474.441 481.081 647.047 1.00 0.00 C +ATOM 107 CA THR A 107 476.753 484.105 647.200 1.00 0.00 C +ATOM 108 CA GLU A 108 479.230 483.736 644.328 1.00 0.00 C +ATOM 109 CA MET A 109 480.662 480.228 644.725 1.00 0.00 C +ATOM 110 CA ASN A 110 481.992 478.958 641.388 1.00 0.00 C +ATOM 111 CA GLY A 111 485.067 479.374 639.176 1.00 0.00 C +ATOM 112 CA GLU A 112 485.734 479.718 635.441 1.00 0.00 C +ATOM 113 CA GLY A 113 489.507 479.478 634.969 1.00 0.00 C +ATOM 114 CA THR A 114 492.032 477.839 632.634 1.00 0.00 C +ATOM 115 CA ALA A 115 493.547 474.349 632.832 1.00 0.00 C +ATOM 116 CA SER A 116 495.870 473.590 629.909 1.00 0.00 C +ATOM 117 CA ALA A 117 494.638 472.629 626.434 1.00 0.00 C +ATOM 118 CA ALA A 118 494.197 475.336 623.789 1.00 0.00 C +ATOM 119 CA ILE A 119 492.384 477.533 621.259 1.00 0.00 C +ATOM 120 CA PHE A 120 488.872 478.223 619.951 1.00 0.00 C +ATOM 121 CA GLY A 121 486.486 477.710 617.025 1.00 0.00 C +ATOM 122 CA ARG A 122 484.471 474.543 616.373 1.00 0.00 C +ATOM 123 CA ARG A 123 485.751 471.076 615.451 1.00 0.00 C +ATOM 124 CA ARG A 124 483.966 468.324 613.513 1.00 0.00 C +ATOM 125 CA ASP A 125 483.232 466.129 610.486 1.00 0.00 C +ATOM 126 CA ALA A 126 483.299 462.694 608.839 1.00 0.00 C +ATOM 127 CA ALA A 127 481.783 459.285 609.613 1.00 0.00 C +ATOM 128 CA GLY A 128 479.313 457.170 607.628 1.00 0.00 C +ATOM 129 CA THR A 129 479.575 456.569 603.875 1.00 0.00 C +ATOM 130 CA GLY A 130 478.290 453.504 602.011 1.00 0.00 C +ATOM 131 CA LEU A 131 479.187 452.625 598.414 1.00 0.00 C +ATOM 132 CA ASP A 132 477.053 453.953 595.551 1.00 0.00 C +ATOM 133 CA ASP A 133 474.278 455.875 593.783 1.00 0.00 C +ATOM 134 CA ALA A 134 475.809 457.591 590.746 1.00 0.00 C +ATOM 135 CA GLU A 135 478.529 456.730 588.221 1.00 0.00 C +ATOM 136 CA PRO A 136 481.118 458.354 585.947 1.00 0.00 C +ATOM 137 CA ARG A 137 484.803 459.032 585.255 1.00 0.00 C +ATOM 138 CA THR A 138 487.024 460.339 588.061 1.00 0.00 C +ATOM 139 CA LYS A 139 486.501 463.906 589.293 1.00 0.00 C +ATOM 140 CA THR A 140 488.977 466.787 588.993 1.00 0.00 C +ATOM 141 CA ARG A 141 488.521 470.435 587.992 1.00 0.00 C +ATOM 142 CA THR A 142 485.295 471.294 586.154 1.00 0.00 C +ATOM 143 CA GLY A 143 481.973 469.635 585.304 1.00 0.00 C +ATOM 144 CA GLY A 144 479.130 472.172 585.283 1.00 0.00 C +ATOM 145 CA SER A 145 477.536 475.250 586.864 1.00 0.00 C +ATOM 146 CA LEU A 146 474.580 476.881 585.098 1.00 0.00 C +ATOM 147 CA ASP A 147 470.992 477.848 584.259 1.00 0.00 C +ATOM 148 CA GLU A 148 470.893 481.343 582.744 1.00 0.00 C +ATOM 149 CA ARG A 149 473.264 483.861 581.147 1.00 0.00 C +ATOM 150 CA GLY A 150 474.065 486.411 583.862 1.00 0.00 C +ATOM 151 CA ARG A 151 474.331 490.195 584.217 1.00 0.00 C +ATOM 152 CA ARG A 152 477.031 491.273 581.754 1.00 0.00 C +ATOM 153 CA THR A 153 480.567 490.031 581.068 1.00 0.00 C +ATOM 154 CA ARG A 154 483.949 490.848 579.517 1.00 0.00 C +ATOM 155 CA THR A 155 486.171 493.887 578.929 1.00 0.00 C +ATOM 156 CA ALA A 156 489.615 495.348 579.653 1.00 0.00 C +ATOM 157 CA ARG A 157 492.522 495.244 577.193 1.00 0.00 C +ATOM 158 CA ARG A 158 492.105 498.330 574.997 1.00 0.00 C +ATOM 159 CA ARG A 159 491.885 502.132 575.087 1.00 0.00 C +ATOM 160 CA ASP A 160 491.432 504.970 572.585 1.00 0.00 C +ATOM 161 CA GLU A 161 493.885 507.857 572.988 1.00 0.00 C +ATOM 162 CA ARG A 162 496.550 510.562 573.308 1.00 0.00 C +ATOM 163 CA HIS A 163 500.252 510.359 572.431 1.00 0.00 C +ATOM 164 CA ASP A 164 503.976 510.133 571.660 1.00 0.00 C +ATOM 165 CA ASP A 165 507.643 510.019 572.685 1.00 0.00 C +ATOM 166 CA ARG A 166 509.767 511.481 569.880 1.00 0.00 C +ATOM 167 CA GLU A 167 510.472 509.456 566.731 1.00 0.00 C +ATOM 168 CA ARG A 168 507.793 510.449 564.210 1.00 0.00 C +ATOM 169 CA ARG A 169 507.196 509.066 560.710 1.00 0.00 C +ATOM 170 CA GLU A 170 507.448 505.503 559.385 1.00 0.00 C +ATOM 171 CA ASP A 171 506.166 504.192 556.045 1.00 0.00 C +ATOM 172 CA ASP A 172 506.694 503.685 552.307 1.00 0.00 C +ATOM 173 CA ASP A 173 508.187 504.682 548.946 1.00 0.00 C +ATOM 174 CA ASP A 174 507.925 508.132 547.350 1.00 0.00 C +ATOM 175 CA ASP A 175 509.555 511.328 546.069 1.00 0.00 C +ATOM 176 CA ASP A 176 509.800 513.093 542.701 1.00 0.00 C +ATOM 177 CA ASP A 177 509.440 511.265 539.377 1.00 0.00 C +ATOM 178 CA ARG A 178 510.584 511.985 535.815 1.00 0.00 C +ATOM 179 CA ASP A 179 513.909 513.830 535.579 1.00 0.00 C +ATOM 180 CA ARG A 180 516.814 514.715 537.879 1.00 0.00 C +ATOM 181 CA ARG A 181 517.360 515.063 541.634 1.00 0.00 C +ATOM 182 CA GLY A 182 517.519 512.599 544.535 1.00 0.00 C +ATOM 183 CA GLY A 183 516.039 509.384 543.125 1.00 0.00 C +ATOM 184 CA ASP A 184 517.461 505.871 543.515 1.00 0.00 C +ATOM 185 CA GLU A 185 519.957 505.107 540.739 1.00 0.00 C +ATOM 186 CA ASP A 186 521.026 502.860 537.855 1.00 0.00 C +ATOM 187 CA SER A 187 520.793 503.731 534.153 1.00 0.00 C +ATOM 188 CA ARG A 188 520.444 507.409 533.222 1.00 0.00 C +ATOM 189 CA GLN A 189 519.512 511.103 533.169 1.00 0.00 C +ATOM 190 CA ARG A 190 519.753 514.141 530.882 1.00 0.00 C +ATOM 191 CA LEU A 191 516.622 515.941 529.668 1.00 0.00 C +ATOM 192 CA HIS A 192 516.912 516.120 525.873 1.00 0.00 C +ATOM 193 CA GLY A 193 515.248 516.877 522.530 1.00 0.00 C +ATOM 194 CA ASP A 194 514.218 516.624 518.871 1.00 0.00 C +ATOM 195 CA GLU A 195 513.815 516.315 515.095 1.00 0.00 C +ATOM 196 CA ASP A 196 512.718 514.823 511.765 1.00 0.00 C +ATOM 197 CA ASP A 197 514.460 512.293 509.511 1.00 0.00 C +ATOM 198 CA VAL A 198 513.398 512.480 505.857 1.00 0.00 C +ATOM 199 CA GLU A 199 511.904 509.330 504.320 1.00 0.00 C +ATOM 200 CA HIS A 200 510.549 508.530 500.851 1.00 0.00 C +ATOM 201 CA ALA A 201 510.965 508.808 497.074 1.00 0.00 C +ATOM 202 CA ALA A 202 511.011 511.650 494.536 1.00 0.00 C +ATOM 203 CA THR A 203 514.377 513.429 494.397 1.00 0.00 C +ATOM 204 CA MET A 204 517.840 511.864 494.115 1.00 0.00 C +ATOM 205 CA LEU A 205 518.960 508.481 492.766 1.00 0.00 C +ATOM 206 CA VAL A 206 516.602 506.741 490.332 1.00 0.00 C +ATOM 207 CA LYS A 207 512.804 506.438 490.326 1.00 0.00 C +ATOM 208 CA VAL A 208 509.342 507.328 489.007 1.00 0.00 C +ATOM 209 CA VAL A 209 506.505 506.724 486.537 1.00 0.00 C +ATOM 210 CA VAL A 210 506.917 508.772 483.351 1.00 0.00 C +ATOM 211 CA GLN A 211 507.170 507.742 479.692 1.00 0.00 C +ATOM 212 CA ARG A 212 507.009 504.145 478.447 1.00 0.00 C +ATOM 213 CA GLY A 213 503.815 503.913 476.382 1.00 0.00 C +ATOM 214 CA ASP A 214 504.333 501.309 473.650 1.00 0.00 C +ATOM 215 CA GLU A 215 507.324 501.127 471.297 1.00 0.00 C +ATOM 216 CA PRO A 216 506.796 497.923 469.303 1.00 0.00 C +ATOM 217 CA THR A 217 508.794 496.435 466.421 1.00 0.00 C +ATOM 218 CA ARG A 218 511.075 493.889 464.739 1.00 0.00 C +ATOM 219 CA ARG A 219 509.232 490.567 464.460 1.00 0.00 C +ATOM 220 CA LYS A 220 506.913 489.763 461.546 1.00 0.00 C +ATOM 221 CA GLU A 221 506.744 486.030 460.801 1.00 0.00 C +ATOM 222 CA ARG A 222 506.612 482.302 460.026 1.00 0.00 C +ATOM 223 CA PRO A 223 505.945 481.923 456.294 1.00 0.00 C +ATOM 224 CA LYS A 224 502.530 480.322 455.759 1.00 0.00 C +ATOM 225 CA GLY A 225 503.171 477.399 453.401 1.00 0.00 C +ATOM 226 CA ARG A 226 502.754 474.235 455.483 1.00 0.00 C +ATOM 227 CA ARG A 227 503.410 471.814 458.350 1.00 0.00 C +ATOM 228 CA ARG A 228 504.745 471.630 461.914 1.00 0.00 C +ATOM 229 CA GLN A 229 507.515 473.902 463.209 1.00 0.00 C +ATOM 230 CA ARG A 230 510.141 473.121 465.857 1.00 0.00 C +ATOM 231 CA GLY A 231 509.514 473.349 469.608 1.00 0.00 C +ATOM 232 CA TRP A 232 506.206 474.287 471.248 1.00 0.00 C +ATOM 233 CA ARG A 233 503.876 475.759 468.617 1.00 0.00 C +ATOM 234 CA GLY A 234 501.298 476.221 465.849 1.00 0.00 C +ATOM 235 CA ARG A 235 501.691 479.638 464.211 1.00 0.00 C +ATOM 236 CA ARG A 236 498.693 481.985 464.358 1.00 0.00 C +ATOM 237 CA GLY A 237 498.526 483.818 461.023 1.00 0.00 C +ATOM 238 CA ASP A 238 496.348 482.871 458.044 1.00 0.00 C +ATOM 239 CA GLY A 239 493.824 483.425 455.244 1.00 0.00 C +ATOM 240 CA VAL A 240 492.358 486.914 455.683 1.00 0.00 C +ATOM 241 CA PRO A 241 489.840 489.172 453.930 1.00 0.00 C +ATOM 242 CA ALA A 242 489.937 489.307 450.123 1.00 0.00 C +ATOM 243 CA LYS A 243 493.211 487.784 448.910 1.00 0.00 C +ATOM 244 CA PRO A 244 496.502 489.369 447.825 1.00 0.00 C +ATOM 245 CA ARG A 245 499.765 490.960 446.669 1.00 0.00 C +ATOM 246 CA SER A 246 500.711 490.330 443.033 1.00 0.00 C +ATOM 247 CA SER A 247 500.963 493.661 441.202 1.00 0.00 C +ATOM 248 CA ARG A 248 504.626 494.559 440.659 1.00 0.00 C +ATOM 249 CA GLY A 249 506.466 497.497 442.238 1.00 0.00 C +ATOM 250 CA GLY A 250 506.897 500.888 443.923 1.00 0.00 C +ATOM 251 CA GLY A 251 506.723 504.580 444.848 1.00 0.00 C +ATOM 252 CA ARG A 252 510.095 506.347 444.695 1.00 0.00 C +ATOM 253 CA ARG A 253 510.475 508.532 447.793 1.00 0.00 C +ATOM 254 CA CYS A 254 510.187 512.275 447.147 1.00 0.00 C +ATOM 255 CA ASP A 255 510.850 515.010 449.715 1.00 0.00 C +ATOM 256 CA VAL A 256 510.266 518.721 450.353 1.00 0.00 C +ATOM 257 CA ASN A 257 510.855 521.994 452.213 1.00 0.00 C +ATOM 258 CA GLY A 258 513.049 523.594 454.887 1.00 0.00 C +ATOM 259 CA GLY A 259 515.438 521.037 456.394 1.00 0.00 C +ATOM 260 CA ASP A 260 519.230 521.385 456.514 1.00 0.00 C +ATOM 261 CA GLY A 261 520.902 523.751 458.988 1.00 0.00 C +ATOM 262 CA ASP A 262 523.817 525.349 457.127 1.00 0.00 C +ATOM 263 CA VAL A 263 525.255 523.777 453.969 1.00 0.00 C +ATOM 264 CA GLY A 264 528.953 522.919 454.298 1.00 0.00 C +ATOM 265 CA ARG A 265 531.426 522.313 451.463 1.00 0.00 C +ATOM 266 CA ARG A 266 530.706 524.184 448.224 1.00 0.00 C +ATOM 267 CA THR A 267 528.710 526.089 445.596 1.00 0.00 C +ATOM 268 CA GLY A 268 528.432 524.554 442.120 1.00 0.00 C +ATOM 269 CA ASP A 269 529.296 523.250 438.646 1.00 0.00 C +ATOM 270 CA GLU A 270 531.084 524.602 435.566 1.00 0.00 C +ATOM 271 CA GLN A 271 532.547 527.017 433.008 1.00 0.00 C +ATOM 272 CA GLN A 272 532.378 526.333 429.264 1.00 0.00 C +ATOM 273 CA PRO A 273 534.801 524.992 426.647 1.00 0.00 C +ATOM 274 CA ALA A 274 536.157 527.287 423.925 1.00 0.00 C +ATOM 275 CA GLY A 275 535.668 531.064 423.816 1.00 0.00 C +ATOM 276 CA ASP A 276 534.478 534.266 422.128 1.00 0.00 C +ATOM 277 CA GLY A 277 531.280 533.704 420.134 1.00 0.00 C +ATOM 278 CA GLU A 278 529.899 530.378 418.891 1.00 0.00 C +ATOM 279 CA VAL A 279 526.336 529.077 418.536 1.00 0.00 C +ATOM 280 CA VAL A 280 523.488 528.066 416.215 1.00 0.00 C +ATOM 281 CA ALA A 281 521.522 529.870 413.496 1.00 0.00 C +ATOM 282 CA THR A 282 523.030 530.407 410.039 1.00 0.00 C +ATOM 283 CA PRO A 283 523.149 530.997 406.276 1.00 0.00 C +ATOM 284 CA LEU A 284 525.168 532.143 403.256 1.00 0.00 C +ATOM 285 CA ASP A 285 527.492 535.162 403.239 1.00 0.00 C +ATOM 286 CA THR A 286 529.483 536.589 400.322 1.00 0.00 C +ATOM 287 CA GLY A 287 533.200 537.028 399.606 1.00 0.00 C +ATOM 288 CA GLU A 288 535.673 534.448 398.285 1.00 0.00 C +ATOM 289 CA ASP A 289 535.163 533.716 394.581 1.00 0.00 C +ATOM 290 CA ALA A 290 534.651 532.425 391.033 1.00 0.00 C +ATOM 291 CA SER A 291 532.204 534.314 388.806 1.00 0.00 C +ATOM 292 CA PRO A 292 530.666 534.601 385.333 1.00 0.00 C +ATOM 293 CA VAL A 293 528.426 536.214 382.706 1.00 0.00 C +ATOM 294 CA LEU A 294 526.794 539.283 384.267 1.00 0.00 C +ATOM 295 CA SER A 295 524.136 542.012 384.227 1.00 0.00 C +ATOM 296 CA PRO A 296 523.041 544.922 382.025 1.00 0.00 C +ATOM 297 CA ARG A 297 522.997 548.724 381.785 1.00 0.00 C +ATOM 298 CA ASN A 298 524.965 551.986 381.765 1.00 0.00 C +ATOM 299 CA GLY A 299 526.768 552.474 385.086 1.00 0.00 C +ATOM 300 CA GLY A 300 527.935 556.056 385.654 1.00 0.00 C +ATOM 301 CA LEU A 301 529.146 559.648 385.266 1.00 0.00 C +ATOM 302 CA THR A 302 526.105 561.904 384.843 1.00 0.00 C +ATOM 303 CA GLU A 303 524.209 562.418 381.579 1.00 0.00 C +ATOM 304 CA GLY A 304 524.662 562.215 377.801 1.00 0.00 C +ATOM 305 CA GLU A 305 524.231 565.616 376.138 1.00 0.00 C +ATOM 306 CA GLU A 306 521.948 566.479 373.212 1.00 0.00 C +ATOM 307 CA VAL A 307 518.153 566.721 372.990 1.00 0.00 C +ATOM 308 CA ALA A 308 516.021 569.396 371.312 1.00 0.00 C +ATOM 309 CA ALA A 309 518.190 571.957 369.507 1.00 0.00 C +ATOM 310 CA ARG A 310 521.074 574.426 369.193 1.00 0.00 C +ATOM 311 CA PRO A 311 524.590 573.938 370.578 1.00 0.00 C +ATOM 312 CA ARG A 312 528.184 575.031 369.943 1.00 0.00 C +ATOM 313 CA GLU A 313 530.963 577.478 369.043 1.00 0.00 C +ATOM 314 CA LYS A 314 530.860 578.016 365.273 1.00 0.00 C +ATOM 315 CA THR A 315 530.521 579.430 361.751 1.00 0.00 C +ATOM 316 CA ALA A 316 528.702 582.597 360.668 1.00 0.00 C +ATOM 317 CA ARG A 317 529.420 586.067 362.070 1.00 0.00 C +ATOM 318 CA PRO A 318 532.961 586.396 363.436 1.00 0.00 C +ATOM 319 CA ASP A 319 534.611 589.647 364.544 1.00 0.00 C +ATOM 320 CA GLY A 320 533.459 591.041 367.898 1.00 0.00 C +ATOM 321 CA ALA A 321 533.369 594.601 369.252 1.00 0.00 C +ATOM 322 CA ARG A 322 534.284 597.889 370.946 1.00 0.00 C +ATOM 323 CA ALA A 323 535.269 601.559 371.224 1.00 0.00 C +ATOM 324 CA ARG A 324 537.318 604.649 372.102 1.00 0.00 C +ATOM 325 CA ARG A 325 539.206 606.402 374.909 1.00 0.00 C +ATOM 326 CA GLU A 326 538.434 608.342 378.096 1.00 0.00 C +ATOM 327 CA ARG A 327 535.114 609.467 379.589 1.00 0.00 C +ATOM 328 CA ARG A 328 533.065 610.829 376.680 1.00 0.00 C +ATOM 329 CA LEU A 329 530.441 612.211 374.287 1.00 0.00 C +ATOM 330 CA GLU A 330 528.080 612.332 371.300 1.00 0.00 C +ATOM 331 CA ALA A 331 525.662 613.734 368.710 1.00 0.00 C +ATOM 332 CA ALA A 332 524.733 612.861 365.120 1.00 0.00 C +ATOM 333 CA GLY A 333 526.093 612.099 361.643 1.00 0.00 C +ATOM 334 CA ALA A 334 529.437 613.525 360.501 1.00 0.00 C +ATOM 335 CA GLU A 335 532.232 611.339 359.112 1.00 0.00 C +ATOM 336 CA LYS A 336 535.170 608.950 359.534 1.00 0.00 C +ATOM 337 CA ARG A 337 536.924 605.679 358.677 1.00 0.00 C +ATOM 338 CA GLU A 338 540.097 603.989 359.940 1.00 0.00 C +ATOM 339 CA GLY A 339 540.678 601.572 362.827 1.00 0.00 C +ATOM 340 CA ARG A 340 541.857 598.354 361.163 1.00 0.00 C +ATOM 341 CA ARG A 341 542.181 594.561 360.996 1.00 0.00 C +ATOM 342 CA ARG A 342 543.251 591.684 358.740 1.00 0.00 C +ATOM 343 CA GLY A 343 546.278 591.315 356.455 1.00 0.00 C +ATOM 344 CA GLY A 344 549.662 592.424 355.102 1.00 0.00 C +ATOM 345 CA SER A 345 552.437 591.218 357.417 1.00 0.00 C +ATOM 346 CA SER A 346 553.158 590.802 361.135 1.00 0.00 C +ATOM 347 CA GLY A 347 555.524 589.445 363.795 1.00 0.00 C +ATOM 348 CA GLY A 348 559.094 588.680 362.704 1.00 0.00 C +ATOM 349 CA LEU A 349 561.533 588.107 365.574 1.00 0.00 C +ATOM 350 CA ARG A 350 559.455 588.498 368.744 1.00 0.00 C +ATOM 351 CA GLY A 351 556.408 588.569 371.030 1.00 0.00 C +ATOM 352 CA LYS A 352 552.968 587.574 372.333 1.00 0.00 C +ATOM 353 CA ARG A 353 550.040 589.829 373.260 1.00 0.00 C +ATOM 354 CA ARG A 354 549.452 589.971 377.022 1.00 0.00 C +ATOM 355 CA ALA A 355 549.288 593.090 379.203 1.00 0.00 C +ATOM 356 CA SER A 356 551.316 595.727 381.061 1.00 0.00 C +ATOM 357 CA ARG A 357 550.837 595.643 384.840 1.00 0.00 C +ATOM 358 CA GLY A 358 549.704 593.173 387.510 1.00 0.00 C +ATOM 359 CA GLY A 359 552.319 590.467 388.106 1.00 0.00 C +ATOM 360 CA GLY A 360 552.404 586.861 386.880 1.00 0.00 C +ATOM 361 CA GLY A 361 549.402 586.047 384.679 1.00 0.00 C +ATOM 362 CA GLY A 362 549.255 582.247 384.446 1.00 0.00 C +ATOM 363 CA GLY A 363 551.163 578.950 384.513 1.00 0.00 C +ATOM 364 CA ASP A 364 550.865 576.386 381.711 1.00 0.00 C +ATOM 365 CA ALA A 365 548.538 573.512 380.795 1.00 0.00 C +ATOM 366 CA GLY A 366 548.355 570.626 378.315 1.00 0.00 C +ATOM 367 CA GLY A 367 548.440 572.172 374.834 1.00 0.00 C +ATOM 368 CA GLY A 368 545.707 574.826 374.759 1.00 0.00 C +ATOM 369 CA ASP A 369 544.201 575.598 371.346 1.00 0.00 C +ATOM 370 CA GLY A 370 543.869 572.711 368.881 1.00 0.00 C +ATOM 371 CA ALA A 371 542.682 570.434 366.067 1.00 0.00 C +ATOM 372 CA ALA A 372 543.638 566.877 367.042 1.00 0.00 C +ATOM 373 CA GLY A 373 547.395 566.904 367.673 1.00 0.00 C +ATOM 374 CA ARG A 374 550.617 566.903 369.707 1.00 0.00 C +ATOM 375 CA ARG A 375 554.419 566.686 369.820 1.00 0.00 C +ATOM 376 CA THR A 376 557.746 566.365 367.991 1.00 0.00 C +ATOM 377 CA VAL A 377 559.734 563.132 367.660 1.00 0.00 C +ATOM 378 CA GLU A 378 559.803 559.377 367.019 1.00 0.00 C +ATOM 379 CA ALA A 379 561.821 557.234 364.600 1.00 0.00 C +ATOM 380 CA ALA A 380 564.839 554.960 365.090 1.00 0.00 C +ATOM 381 CA GLN A 381 568.564 555.028 364.295 1.00 0.00 C +ATOM 382 CA ALA A 382 570.855 552.338 365.722 1.00 0.00 C +ATOM 383 CA ALA A 383 573.830 550.347 364.418 1.00 0.00 C +ATOM 384 CA GLY A 384 575.364 548.640 367.459 1.00 0.00 C +ATOM 385 CA GLY A 385 576.159 550.311 370.789 1.00 0.00 C +ATOM 386 CA GLY A 386 579.364 548.742 372.125 1.00 0.00 C +ATOM 387 CA ARG A 387 579.955 548.904 375.885 1.00 0.00 C +ATOM 388 CA GLN A 388 583.095 549.636 377.915 1.00 0.00 C +ATOM 389 CA ARG A 389 585.084 552.861 377.523 1.00 0.00 C +ATOM 390 CA GLY A 390 588.292 553.299 375.513 1.00 0.00 C +ATOM 391 CA ARG A 391 588.937 552.364 371.876 1.00 0.00 C +ATOM 392 CA GLU A 392 590.043 549.052 370.354 1.00 0.00 C +ATOM 393 CA ARG A 393 593.472 549.637 368.800 1.00 0.00 C +ATOM 394 CA ARG A 394 596.471 549.783 371.145 1.00 0.00 C +ATOM 395 CA ALA A 395 597.603 546.249 372.009 1.00 0.00 C +ATOM 396 CA THR A 396 601.222 546.425 373.187 1.00 0.00 C +ATOM 397 CA GLY A 397 602.485 549.419 375.177 1.00 0.00 C +ATOM 398 CA ARG A 398 605.887 550.825 376.160 1.00 0.00 C +ATOM 399 CA TRP A 399 608.461 553.419 377.238 1.00 0.00 C +ATOM 400 CA ILE A 400 612.038 554.161 376.158 1.00 0.00 C +ATOM 401 CA GLY A 401 613.157 556.867 373.720 1.00 0.00 C +ATOM 402 CA THR A 402 611.497 559.800 371.944 1.00 0.00 C +ATOM 403 CA THR A 403 608.075 559.893 370.271 1.00 0.00 C +ATOM 404 CA GLY A 404 606.329 561.777 367.458 1.00 0.00 C +ATOM 405 CA ARG A 405 607.114 562.263 363.761 1.00 0.00 C +ATOM 406 CA LEU A 406 606.133 563.619 360.338 1.00 0.00 C +ATOM 407 CA GLY A 407 607.387 566.431 358.094 1.00 0.00 C +ATOM 408 CA ARG A 408 610.910 566.856 356.708 1.00 0.00 C +ATOM 409 CA GLY A 409 612.121 570.425 356.148 1.00 0.00 C +ATOM 410 CA LEU A 410 611.860 574.218 355.913 1.00 0.00 C +ATOM 411 CA LYS A 411 610.134 577.592 356.305 1.00 0.00 C +ATOM 412 CA ARG A 412 612.510 580.527 356.813 1.00 0.00 C +ATOM 413 CA GLU A 413 615.236 582.807 355.442 1.00 0.00 C +ATOM 414 CA ASN A 414 615.499 585.170 352.464 1.00 0.00 C +ATOM 415 CA GLY A 415 614.621 583.467 349.170 1.00 0.00 C +ATOM 416 CA GLY A 416 614.622 580.612 346.648 1.00 0.00 C +TER 417 GLY A 416 +END diff --git a/Plants/Q8S6Z0/Q8S6Z0.dcd b/Plants/Q8S6Z0/Q8S6Z0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..8fe3e3e3dc74be301dee8a4fd6ac2f4453b2df04 --- /dev/null +++ b/Plants/Q8S6Z0/Q8S6Z0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:424f05e25ede6a8a8ecac7faaaf8a8ba291794c7b297a5bbe9339fbba46ad11d +size 7520276 diff --git a/Plants/Q8S6Z0/top.pdb b/Plants/Q8S6Z0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..bc14c7b21b5f8bea50c44bb53b4a0c145e69b23a --- /dev/null +++ b/Plants/Q8S6Z0/top.pdb @@ -0,0 +1,60 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 219.371 240.501 256.965 1.00 0.00 C +ATOM 2 CA THR A 2 222.294 238.346 255.812 1.00 0.00 C +ATOM 3 CA MET A 3 223.286 235.046 257.437 1.00 0.00 C +ATOM 4 CA GLN A 4 224.475 231.784 259.007 1.00 0.00 C +ATOM 5 CA VAL A 5 227.354 231.592 261.495 1.00 0.00 C +ATOM 6 CA GLU A 6 230.472 231.544 259.306 1.00 0.00 C +ATOM 7 CA ARG A 7 233.833 231.999 257.571 1.00 0.00 C +ATOM 8 CA SER A 8 233.800 230.801 253.955 1.00 0.00 C +ATOM 9 CA ALA A 9 237.372 229.795 253.094 1.00 0.00 C +ATOM 10 CA ALA A 10 240.823 230.956 251.971 1.00 0.00 C +ATOM 11 CA PRO A 11 244.167 232.411 253.073 1.00 0.00 C +ATOM 12 CA VAL A 12 243.717 233.881 256.559 1.00 0.00 C +ATOM 13 CA ASP A 13 242.962 231.525 259.457 1.00 0.00 C +ATOM 14 CA SER A 14 242.662 233.204 262.864 1.00 0.00 C +ATOM 15 CA ALA A 15 241.361 232.021 266.245 1.00 0.00 C +ATOM 16 CA ALA A 16 237.673 232.912 266.585 1.00 0.00 C +ATOM 17 CA ALA A 17 234.164 233.719 265.339 1.00 0.00 C +ATOM 18 CA GLN A 18 230.804 232.993 266.982 1.00 0.00 C +ATOM 19 CA PRO A 19 228.501 235.241 269.021 1.00 0.00 C +ATOM 20 CA MET A 20 228.814 239.024 268.687 1.00 0.00 C +ATOM 21 CA GLU A 21 229.676 242.689 268.102 1.00 0.00 C +ATOM 22 CA GLU A 22 229.418 246.262 266.806 1.00 0.00 C +ATOM 23 CA VAL A 23 232.408 248.048 265.262 1.00 0.00 C +ATOM 24 CA GLY A 24 235.370 248.321 262.881 1.00 0.00 C +ATOM 25 CA ARG A 25 238.332 250.502 261.889 1.00 0.00 C +ATOM 26 CA GLN A 26 242.027 250.495 262.818 1.00 0.00 C +ATOM 27 CA LEU A 27 243.799 253.742 261.907 1.00 0.00 C +ATOM 28 CA PRO A 28 246.892 255.964 261.773 1.00 0.00 C +ATOM 29 CA ALA A 29 250.474 257.129 261.201 1.00 0.00 C +ATOM 30 CA THR A 30 254.116 258.064 261.818 1.00 0.00 C +ATOM 31 CA MET A 31 257.218 256.493 260.260 1.00 0.00 C +ATOM 32 CA GLN A 32 260.318 258.703 260.412 1.00 0.00 C +ATOM 33 CA GLU A 33 260.108 261.299 257.631 1.00 0.00 C +ATOM 34 CA GLY A 34 259.034 261.272 253.976 1.00 0.00 C +ATOM 35 CA VAL A 35 259.688 263.798 251.200 1.00 0.00 C +ATOM 36 CA GLY A 36 260.446 267.531 251.098 1.00 0.00 C +ATOM 37 CA GLY A 37 260.023 271.297 250.705 1.00 0.00 C +ATOM 38 CA PRO A 38 259.881 271.827 246.935 1.00 0.00 C +ATOM 39 CA ALA A 39 257.653 269.511 244.888 1.00 0.00 C +ATOM 40 CA GLY A 40 255.792 266.799 242.965 1.00 0.00 C +ATOM 41 CA GLY A 41 257.405 266.660 239.516 1.00 0.00 C +ATOM 42 CA GLY A 42 257.566 265.849 235.797 1.00 0.00 C +ATOM 43 CA GLN A 43 259.513 268.403 233.746 1.00 0.00 C +ATOM 44 CA ARG A 44 262.714 268.609 231.691 1.00 0.00 C +ATOM 45 CA GLY A 45 262.086 266.783 228.406 1.00 0.00 C +ATOM 46 CA GLY A 46 264.697 264.231 227.318 1.00 0.00 C +ATOM 47 CA VAL A 47 267.550 261.731 227.671 1.00 0.00 C +ATOM 48 CA ARG A 48 269.790 259.318 225.754 1.00 0.00 C +ATOM 49 CA ARG A 49 271.230 261.192 222.766 1.00 0.00 C +ATOM 50 CA GLY A 50 273.145 259.389 220.009 1.00 0.00 C +ATOM 51 CA GLY A 51 276.738 258.125 220.118 1.00 0.00 C +ATOM 52 CA PRO A 52 278.145 254.932 221.648 1.00 0.00 C +ATOM 53 CA ARG A 53 281.429 254.216 223.442 1.00 0.00 C +ATOM 54 CA GLY A 54 284.808 254.345 225.197 1.00 0.00 C +ATOM 55 CA GLY A 55 285.998 253.225 228.639 1.00 0.00 C +ATOM 56 CA ALA A 56 286.608 253.953 232.328 1.00 0.00 C +TER 57 ALA A 56 +END diff --git a/Plants/Q8S6Z3/Q8S6Z3.dcd b/Plants/Q8S6Z3/Q8S6Z3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..1f29d41e7312849f493d241dd8583a8bb52dbd85 --- /dev/null +++ b/Plants/Q8S6Z3/Q8S6Z3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:76038e470d6771959ef4f2d8c16ad493f127dd72920ee22ba95a242174453670 +size 38460276 diff --git a/Plants/Q8S6Z3/top.pdb b/Plants/Q8S6Z3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a0e5e2f438b92d5f9b7cf442fff2e8c298dc0dcf --- /dev/null +++ b/Plants/Q8S6Z3/top.pdb @@ -0,0 +1,211 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 266.494 298.243 314.970 1.00 0.00 C +ATOM 2 CA VAL A 2 265.590 300.447 311.997 1.00 0.00 C +ATOM 3 CA ALA A 3 262.601 302.620 311.068 1.00 0.00 C +ATOM 4 CA GLY A 4 259.411 303.976 312.650 1.00 0.00 C +ATOM 5 CA GLY A 5 256.313 304.476 310.490 1.00 0.00 C +ATOM 6 CA GLY A 6 253.381 306.876 310.096 1.00 0.00 C +ATOM 7 CA HIS A 7 253.714 309.625 307.479 1.00 0.00 C +ATOM 8 CA ARG A 8 255.541 312.628 306.010 1.00 0.00 C +ATOM 9 CA HIS A 9 258.255 313.555 303.501 1.00 0.00 C +ATOM 10 CA GLY A 10 257.681 313.100 299.762 1.00 0.00 C +ATOM 11 CA GLY A 11 255.520 310.636 297.817 1.00 0.00 C +ATOM 12 CA ALA A 12 252.586 308.207 297.771 1.00 0.00 C +ATOM 13 CA ALA A 13 250.264 305.765 299.549 1.00 0.00 C +ATOM 14 CA ALA A 14 249.857 304.108 302.956 1.00 0.00 C +ATOM 15 CA GLU A 15 252.948 302.594 304.590 1.00 0.00 C +ATOM 16 CA ARG A 16 255.857 304.979 303.982 1.00 0.00 C +ATOM 17 CA GLY A 17 259.152 303.845 302.441 1.00 0.00 C +ATOM 18 CA GLU A 18 260.442 300.768 300.603 1.00 0.00 C +ATOM 19 CA GLY A 19 262.699 298.343 302.485 1.00 0.00 C +ATOM 20 CA LYS A 20 264.159 295.577 304.661 1.00 0.00 C +ATOM 21 CA GLY A 21 262.493 292.171 305.035 1.00 0.00 C +ATOM 22 CA GLU A 22 259.178 292.364 303.168 1.00 0.00 C +ATOM 23 CA LYS A 23 257.435 291.728 299.841 1.00 0.00 C +ATOM 24 CA THR A 24 257.735 293.955 296.764 1.00 0.00 C +ATOM 25 CA ARG A 25 256.777 295.570 293.449 1.00 0.00 C +ATOM 26 CA TRP A 26 255.070 294.113 290.371 1.00 0.00 C +ATOM 27 CA SER A 27 252.637 291.663 288.759 1.00 0.00 C +ATOM 28 CA THR A 28 251.684 288.034 288.094 1.00 0.00 C +ATOM 29 CA ALA A 29 253.309 284.591 288.228 1.00 0.00 C +ATOM 30 CA HIS A 30 256.337 282.386 287.529 1.00 0.00 C +ATOM 31 CA PRO A 31 259.992 281.890 288.484 1.00 0.00 C +ATOM 32 CA ARG A 32 262.228 283.181 285.683 1.00 0.00 C +ATOM 33 CA SER A 33 263.100 282.390 282.059 1.00 0.00 C +ATOM 34 CA THR A 34 265.409 279.527 281.067 1.00 0.00 C +ATOM 35 CA ALA A 35 263.606 276.482 279.654 1.00 0.00 C +ATOM 36 CA THR A 36 265.296 273.788 277.557 1.00 0.00 C +ATOM 37 CA THR A 37 268.245 275.518 275.874 1.00 0.00 C +ATOM 38 CA LYS A 38 271.834 274.598 276.761 1.00 0.00 C +ATOM 39 CA LYS A 39 273.096 271.514 274.914 1.00 0.00 C +ATOM 40 CA ALA A 40 271.457 268.078 274.794 1.00 0.00 C +ATOM 41 CA ALA A 41 267.786 267.996 275.813 1.00 0.00 C +ATOM 42 CA GLY A 42 264.725 265.843 276.526 1.00 0.00 C +ATOM 43 CA ALA A 43 264.475 262.532 274.657 1.00 0.00 C +ATOM 44 CA LYS A 44 264.243 258.785 275.310 1.00 0.00 C +ATOM 45 CA GLU A 45 264.927 255.997 272.805 1.00 0.00 C +ATOM 46 CA GLY A 46 266.950 257.370 269.884 1.00 0.00 C +ATOM 47 CA GLY A 47 264.598 258.740 267.218 1.00 0.00 C +ATOM 48 CA GLY A 48 264.417 262.535 266.940 1.00 0.00 C +ATOM 49 CA ALA A 49 267.294 264.637 268.290 1.00 0.00 C +ATOM 50 CA ALA A 50 270.340 262.653 269.433 1.00 0.00 C +ATOM 51 CA ARG A 51 272.535 259.590 269.997 1.00 0.00 C +ATOM 52 CA VAL A 52 272.293 257.378 273.089 1.00 0.00 C +ATOM 53 CA ASP A 53 270.651 259.570 275.739 1.00 0.00 C +ATOM 54 CA GLY A 54 271.940 261.521 278.746 1.00 0.00 C +ATOM 55 CA VAL A 55 271.010 262.819 282.206 1.00 0.00 C +ATOM 56 CA ASP A 56 271.042 260.668 285.350 1.00 0.00 C +ATOM 57 CA GLY A 57 274.020 259.276 287.276 1.00 0.00 C +ATOM 58 CA VAL A 58 276.353 256.281 286.948 1.00 0.00 C +ATOM 59 CA PRO A 59 277.439 253.784 284.283 1.00 0.00 C +ATOM 60 CA ALA A 60 274.946 252.394 281.759 1.00 0.00 C +ATOM 61 CA VAL A 61 272.292 254.953 280.798 1.00 0.00 C +ATOM 62 CA ARG A 62 268.700 255.218 282.038 1.00 0.00 C +ATOM 63 CA GLY A 63 268.421 254.687 285.801 1.00 0.00 C +ATOM 64 CA LEU A 64 266.021 252.981 288.219 1.00 0.00 C +ATOM 65 CA GLY A 65 264.409 249.554 287.810 1.00 0.00 C +ATOM 66 CA GLU A 66 265.236 246.199 286.205 1.00 0.00 C +ATOM 67 CA GLY A 67 265.763 244.151 283.036 1.00 0.00 C +ATOM 68 CA VAL A 68 265.043 245.570 279.574 1.00 0.00 C +ATOM 69 CA ASP A 69 262.324 243.385 278.041 1.00 0.00 C +ATOM 70 CA GLY A 70 260.760 242.881 274.604 1.00 0.00 C +ATOM 71 CA VAL A 71 261.667 243.548 270.964 1.00 0.00 C +ATOM 72 CA ASP A 72 264.963 245.113 269.869 1.00 0.00 C +ATOM 73 CA GLY A 73 268.323 245.440 268.101 1.00 0.00 C +ATOM 74 CA GLY A 74 271.357 243.249 267.389 1.00 0.00 C +ATOM 75 CA ALA A 75 272.705 240.076 265.767 1.00 0.00 C +ATOM 76 CA ALA A 76 272.980 236.297 265.366 1.00 0.00 C +ATOM 77 CA LYS A 77 271.902 232.644 265.466 1.00 0.00 C +ATOM 78 CA PRO A 78 270.061 230.107 267.632 1.00 0.00 C +ATOM 79 CA GLU A 79 267.263 228.449 269.615 1.00 0.00 C +ATOM 80 CA GLU A 80 265.375 225.389 268.355 1.00 0.00 C +ATOM 81 CA ALA A 81 261.943 225.810 266.754 1.00 0.00 C +ATOM 82 CA THR A 82 260.285 228.608 268.739 1.00 0.00 C +ATOM 83 CA PRO A 83 259.321 231.197 266.116 1.00 0.00 C +ATOM 84 CA GLY A 84 260.926 230.680 262.700 1.00 0.00 C +ATOM 85 CA ARG A 85 259.045 231.466 259.481 1.00 0.00 C +ATOM 86 CA GLU A 86 256.311 233.291 257.555 1.00 0.00 C +ATOM 87 CA THR A 87 253.125 234.026 259.512 1.00 0.00 C +ATOM 88 CA VAL A 88 250.318 234.403 256.963 1.00 0.00 C +ATOM 89 CA PRO A 89 248.492 237.666 257.692 1.00 0.00 C +ATOM 90 CA ALA A 90 245.812 236.825 260.267 1.00 0.00 C +ATOM 91 CA SER A 91 242.254 236.975 258.912 1.00 0.00 C +ATOM 92 CA GLY A 92 241.269 233.811 257.032 1.00 0.00 C +ATOM 93 CA GLU A 93 239.960 234.081 253.464 1.00 0.00 C +ATOM 94 CA GLY A 94 238.441 234.588 250.007 1.00 0.00 C +ATOM 95 CA ARG A 95 236.202 237.670 250.066 1.00 0.00 C +ATOM 96 CA PRO A 96 233.484 240.154 249.088 1.00 0.00 C +ATOM 97 CA GLU A 97 234.972 242.460 246.446 1.00 0.00 C +ATOM 98 CA VAL A 98 238.468 243.844 247.056 1.00 0.00 C +ATOM 99 CA VAL A 99 241.330 243.831 249.572 1.00 0.00 C +ATOM 100 CA GLY A 100 241.752 240.179 250.569 1.00 0.00 C +ATOM 101 CA ASP A 101 245.501 239.506 250.509 1.00 0.00 C +ATOM 102 CA GLY A 102 248.026 237.091 248.989 1.00 0.00 C +ATOM 103 CA GLY A 103 251.601 236.202 248.018 1.00 0.00 C +ATOM 104 CA GLU A 104 251.963 237.183 244.354 1.00 0.00 C +ATOM 105 CA ARG A 105 252.977 240.047 242.056 1.00 0.00 C +ATOM 106 CA GLY A 106 250.809 243.110 242.717 1.00 0.00 C +ATOM 107 CA ARG A 107 250.923 246.918 242.775 1.00 0.00 C +ATOM 108 CA ARG A 108 253.756 249.206 241.655 1.00 0.00 C +ATOM 109 CA ARG A 109 256.854 248.538 243.768 1.00 0.00 C +ATOM 110 CA GLU A 110 258.973 246.104 241.743 1.00 0.00 C +ATOM 111 CA LEU A 111 261.564 243.546 240.623 1.00 0.00 C +ATOM 112 CA ASP A 112 260.064 240.186 239.634 1.00 0.00 C +ATOM 113 CA SER A 113 262.426 237.201 239.470 1.00 0.00 C +ATOM 114 CA GLY A 114 265.380 236.058 241.587 1.00 0.00 C +ATOM 115 CA GLY A 115 264.281 233.611 244.293 1.00 0.00 C +ATOM 116 CA GLU A 116 262.349 231.433 246.750 1.00 0.00 C +ATOM 117 CA THR A 117 264.967 229.175 248.350 1.00 0.00 C +ATOM 118 CA VAL A 118 268.111 227.221 247.450 1.00 0.00 C +ATOM 119 CA LEU A 119 269.650 228.183 244.100 1.00 0.00 C +ATOM 120 CA GLN A 120 267.420 227.063 241.222 1.00 0.00 C +ATOM 121 CA GLY A 121 264.482 226.419 238.883 1.00 0.00 C +ATOM 122 CA ARG A 122 264.550 228.597 235.758 1.00 0.00 C +ATOM 123 CA LYS A 123 263.394 226.985 232.505 1.00 0.00 C +ATOM 124 CA ARG A 124 260.846 225.938 229.873 1.00 0.00 C +ATOM 125 CA ALA A 125 257.473 227.231 228.661 1.00 0.00 C +ATOM 126 CA ARG A 126 254.900 224.593 229.630 1.00 0.00 C +ATOM 127 CA GLU A 127 251.830 222.369 229.252 1.00 0.00 C +ATOM 128 CA THR A 128 250.158 219.231 230.622 1.00 0.00 C +ATOM 129 CA ARG A 129 249.453 219.169 234.366 1.00 0.00 C +ATOM 130 CA GLY A 130 249.140 221.756 237.145 1.00 0.00 C +ATOM 131 CA GLY A 131 248.852 221.814 240.944 1.00 0.00 C +ATOM 132 CA THR A 132 251.672 219.775 242.495 1.00 0.00 C +ATOM 133 CA GLY A 133 255.457 219.739 242.063 1.00 0.00 C +ATOM 134 CA CYS A 134 258.246 221.189 239.910 1.00 0.00 C +ATOM 135 CA GLY A 135 256.417 222.789 236.976 1.00 0.00 C +ATOM 136 CA GLY A 136 257.071 226.541 236.855 1.00 0.00 C +ATOM 137 CA PHE A 137 256.011 230.060 237.860 1.00 0.00 C +ATOM 138 CA GLY A 138 253.345 232.566 236.798 1.00 0.00 C +ATOM 139 CA GLY A 139 252.761 233.763 233.228 1.00 0.00 C +ATOM 140 CA GLY A 140 255.064 236.482 231.881 1.00 0.00 C +ATOM 141 CA GLY A 141 258.412 238.301 231.837 1.00 0.00 C +ATOM 142 CA GLY A 142 261.668 238.937 233.710 1.00 0.00 C +ATOM 143 CA ALA A 143 263.390 242.145 232.588 1.00 0.00 C +ATOM 144 CA TRP A 144 263.491 245.544 234.307 1.00 0.00 C +ATOM 145 CA ARG A 145 266.632 247.318 233.080 1.00 0.00 C +ATOM 146 CA GLY A 146 267.269 248.412 229.487 1.00 0.00 C +ATOM 147 CA ARG A 147 265.276 246.408 226.932 1.00 0.00 C +ATOM 148 CA SER A 148 262.638 248.351 224.987 1.00 0.00 C +ATOM 149 CA GLY A 149 259.820 249.226 227.397 1.00 0.00 C +ATOM 150 CA GLY A 150 258.239 246.721 229.794 1.00 0.00 C +ATOM 151 CA ILE A 151 255.069 247.359 231.809 1.00 0.00 C +ATOM 152 CA GLY A 152 253.812 244.819 234.356 1.00 0.00 C +ATOM 153 CA TRP A 153 253.748 241.198 235.540 1.00 0.00 C +ATOM 154 CA ARG A 154 250.471 239.265 235.348 1.00 0.00 C +ATOM 155 CA LYS A 155 246.879 240.537 235.339 1.00 0.00 C +ATOM 156 CA GLY A 156 244.329 237.789 234.661 1.00 0.00 C +ATOM 157 CA MET A 157 241.894 235.000 233.761 1.00 0.00 C +ATOM 158 CA THR A 158 239.341 232.476 232.484 1.00 0.00 C +ATOM 159 CA GLY A 159 240.706 229.843 230.093 1.00 0.00 C +ATOM 160 CA GLY A 160 240.993 226.745 227.893 1.00 0.00 C +ATOM 161 CA PRO A 161 243.873 227.122 225.427 1.00 0.00 C +ATOM 162 CA HIS A 162 245.079 229.919 223.139 1.00 0.00 C +ATOM 163 CA PRO A 163 248.176 230.255 220.944 1.00 0.00 C +ATOM 164 CA SER A 164 251.180 231.789 222.716 1.00 0.00 C +ATOM 165 CA ALA A 165 252.699 235.282 222.677 1.00 0.00 C +ATOM 166 CA ARG A 166 250.599 238.251 221.539 1.00 0.00 C +ATOM 167 CA VAL A 167 247.490 237.729 219.399 1.00 0.00 C +ATOM 168 CA ALA A 168 244.188 239.579 218.963 1.00 0.00 C +ATOM 169 CA GLY A 169 242.968 243.179 218.697 1.00 0.00 C +ATOM 170 CA GLY A 170 239.620 243.512 216.909 1.00 0.00 C +ATOM 171 CA PRO A 171 235.953 244.490 216.574 1.00 0.00 C +ATOM 172 CA ALA A 172 232.926 242.536 215.335 1.00 0.00 C +ATOM 173 CA ARG A 173 233.020 239.144 217.067 1.00 0.00 C +ATOM 174 CA GLN A 174 232.110 235.996 215.124 1.00 0.00 C +ATOM 175 CA ARG A 175 228.339 235.782 214.620 1.00 0.00 C +ATOM 176 CA ARG A 176 227.162 236.783 211.137 1.00 0.00 C +ATOM 177 CA ALA A 177 226.770 236.616 207.351 1.00 0.00 C +ATOM 178 CA ARG A 178 227.296 233.428 205.332 1.00 0.00 C +ATOM 179 CA GLY A 179 224.746 231.047 203.802 1.00 0.00 C +ATOM 180 CA GLY A 180 221.279 232.569 204.224 1.00 0.00 C +ATOM 181 CA ARG A 181 218.794 231.886 207.031 1.00 0.00 C +ATOM 182 CA PRO A 182 217.985 234.406 209.771 1.00 0.00 C +ATOM 183 CA ASP A 183 215.207 233.276 212.121 1.00 0.00 C +ATOM 184 CA GLY A 184 212.014 235.174 212.969 1.00 0.00 C +ATOM 185 CA PRO A 185 208.346 235.348 211.954 1.00 0.00 C +ATOM 186 CA ARG A 186 206.993 236.434 208.562 1.00 0.00 C +ATOM 187 CA GLY A 187 204.828 239.309 207.311 1.00 0.00 C +ATOM 188 CA ARG A 188 204.692 241.274 204.050 1.00 0.00 C +ATOM 189 CA GLY A 189 206.475 240.736 200.726 1.00 0.00 C +ATOM 190 CA GLU A 190 209.772 242.193 199.494 1.00 0.00 C +ATOM 191 CA ARG A 191 212.569 241.097 197.150 1.00 0.00 C +ATOM 192 CA GLY A 192 212.759 241.787 193.408 1.00 0.00 C +ATOM 193 CA ARG A 193 210.446 242.593 190.490 1.00 0.00 C +ATOM 194 CA GLU A 194 210.509 242.019 186.724 1.00 0.00 C +ATOM 195 CA MET A 195 210.876 244.370 183.749 1.00 0.00 C +ATOM 196 CA GLY A 196 207.875 245.413 181.645 1.00 0.00 C +ATOM 197 CA ARG A 197 204.462 245.062 183.300 1.00 0.00 C +ATOM 198 CA ILE A 198 202.076 243.078 181.089 1.00 0.00 C +ATOM 199 CA ARG A 199 201.161 240.117 178.874 1.00 0.00 C +ATOM 200 CA PRO A 200 200.813 237.582 176.050 1.00 0.00 C +ATOM 201 CA LYS A 201 200.160 233.832 176.225 1.00 0.00 C +ATOM 202 CA ARG A 202 200.432 232.241 179.676 1.00 0.00 C +ATOM 203 CA GLY A 203 198.084 229.265 180.050 1.00 0.00 C +ATOM 204 CA LYS A 204 196.065 229.190 183.280 1.00 0.00 C +ATOM 205 CA GLY A 205 196.246 226.178 185.607 1.00 0.00 C +ATOM 206 CA ASP A 206 195.329 223.148 187.726 1.00 0.00 C +ATOM 207 CA PHE A 207 196.122 221.274 190.948 1.00 0.00 C +TER 208 PHE A 207 +END diff --git a/Plants/Q8S6Z6/Q8S6Z6.dcd b/Plants/Q8S6Z6/Q8S6Z6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..5d6c129925a12962ab13cff5b60f007e51c72245 --- /dev/null +++ b/Plants/Q8S6Z6/Q8S6Z6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e4622bdd85b2361d716ee7583a3fd16a06222b0040d7082fae877ac95e44355d +size 14600276 diff --git a/Plants/Q8S6Z6/top.pdb b/Plants/Q8S6Z6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..2b6d50c13e0220202392667e18b48b160a05c562 --- /dev/null +++ b/Plants/Q8S6Z6/top.pdb @@ -0,0 +1,119 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 268.355 272.599 196.365 1.00 0.00 C +ATOM 2 CA VAL A 2 269.269 275.164 199.031 1.00 0.00 C +ATOM 3 CA ALA A 3 266.162 275.416 201.222 1.00 0.00 C +ATOM 4 CA GLY A 4 266.560 277.010 204.659 1.00 0.00 C +ATOM 5 CA GLY A 5 269.912 275.870 206.067 1.00 0.00 C +ATOM 6 CA GLY A 6 270.584 272.551 207.812 1.00 0.00 C +ATOM 7 CA HIS A 7 271.112 271.257 211.357 1.00 0.00 C +ATOM 8 CA ARG A 8 268.293 270.314 213.739 1.00 0.00 C +ATOM 9 CA HIS A 9 268.058 271.294 217.413 1.00 0.00 C +ATOM 10 CA GLY A 10 267.041 268.599 219.906 1.00 0.00 C +ATOM 11 CA GLY A 11 265.080 266.853 222.668 1.00 0.00 C +ATOM 12 CA ALA A 12 264.035 267.907 226.176 1.00 0.00 C +ATOM 13 CA ALA A 13 261.273 270.516 225.898 1.00 0.00 C +ATOM 14 CA ALA A 14 261.473 273.409 223.427 1.00 0.00 C +ATOM 15 CA GLU A 15 259.765 274.562 220.222 1.00 0.00 C +ATOM 16 CA ARG A 16 256.847 272.304 219.274 1.00 0.00 C +ATOM 17 CA GLY A 17 254.786 270.604 216.557 1.00 0.00 C +ATOM 18 CA GLU A 18 256.878 267.603 215.492 1.00 0.00 C +ATOM 19 CA GLY A 19 259.004 264.618 214.450 1.00 0.00 C +ATOM 20 CA LYS A 20 262.700 264.372 213.556 1.00 0.00 C +ATOM 21 CA GLY A 21 262.885 261.872 210.687 1.00 0.00 C +ATOM 22 CA GLU A 22 264.670 258.729 209.482 1.00 0.00 C +ATOM 23 CA LYS A 23 266.016 255.530 211.055 1.00 0.00 C +ATOM 24 CA ARG A 24 267.055 255.044 214.688 1.00 0.00 C +ATOM 25 CA ARG A 25 265.390 254.104 217.984 1.00 0.00 C +ATOM 26 CA TRP A 26 264.983 251.787 220.981 1.00 0.00 C +ATOM 27 CA SER A 27 262.170 251.014 223.431 1.00 0.00 C +ATOM 28 CA THR A 28 263.577 249.851 226.775 1.00 0.00 C +ATOM 29 CA ALA A 29 266.006 247.169 227.969 1.00 0.00 C +ATOM 30 CA HIS A 30 269.160 247.728 230.032 1.00 0.00 C +ATOM 31 CA PRO A 31 272.454 246.384 231.396 1.00 0.00 C +ATOM 32 CA ARG A 32 274.412 244.649 228.626 1.00 0.00 C +ATOM 33 CA SER A 33 274.017 244.715 224.837 1.00 0.00 C +ATOM 34 CA THR A 34 275.501 243.435 221.570 1.00 0.00 C +ATOM 35 CA THR A 35 273.676 245.312 218.801 1.00 0.00 C +ATOM 36 CA THR A 36 273.642 249.092 218.327 1.00 0.00 C +ATOM 37 CA THR A 37 270.236 250.466 217.311 1.00 0.00 C +ATOM 38 CA LYS A 38 267.863 248.030 215.593 1.00 0.00 C +ATOM 39 CA LYS A 39 266.967 244.341 215.275 1.00 0.00 C +ATOM 40 CA ALA A 40 264.940 241.215 216.075 1.00 0.00 C +ATOM 41 CA ALA A 41 261.153 241.351 215.677 1.00 0.00 C +ATOM 42 CA GLY A 42 259.400 243.762 218.050 1.00 0.00 C +ATOM 43 CA ALA A 43 256.593 242.755 220.421 1.00 0.00 C +ATOM 44 CA GLU A 44 256.701 243.347 224.183 1.00 0.00 C +ATOM 45 CA GLU A 45 255.718 244.285 227.743 1.00 0.00 C +ATOM 46 CA GLY A 46 257.024 246.420 230.616 1.00 0.00 C +ATOM 47 CA GLY A 47 257.932 250.012 229.724 1.00 0.00 C +ATOM 48 CA GLY A 48 257.820 252.827 232.289 1.00 0.00 C +ATOM 49 CA ALA A 49 255.070 252.785 234.925 1.00 0.00 C +ATOM 50 CA ALA A 50 251.800 254.408 233.832 1.00 0.00 C +ATOM 51 CA ARG A 51 248.351 253.429 235.119 1.00 0.00 C +ATOM 52 CA VAL A 52 246.779 251.526 238.022 1.00 0.00 C +ATOM 53 CA ASP A 53 244.757 251.323 241.245 1.00 0.00 C +ATOM 54 CA GLY A 54 242.358 254.280 241.361 1.00 0.00 C +ATOM 55 CA VAL A 55 239.459 255.182 243.664 1.00 0.00 C +ATOM 56 CA ASP A 56 238.345 252.141 245.672 1.00 0.00 C +ATOM 57 CA GLY A 57 240.218 250.226 248.381 1.00 0.00 C +ATOM 58 CA VAL A 58 241.104 246.530 248.650 1.00 0.00 C +ATOM 59 CA PRO A 59 239.580 245.220 251.887 1.00 0.00 C +ATOM 60 CA ALA A 60 238.098 243.970 255.167 1.00 0.00 C +ATOM 61 CA VAL A 61 237.752 245.559 258.612 1.00 0.00 C +ATOM 62 CA ARG A 62 241.241 246.504 259.815 1.00 0.00 C +ATOM 63 CA GLY A 63 243.615 243.854 261.176 1.00 0.00 C +ATOM 64 CA LEU A 64 242.465 242.265 264.443 1.00 0.00 C +ATOM 65 CA GLY A 65 239.273 240.187 264.535 1.00 0.00 C +ATOM 66 CA GLU A 66 237.198 241.198 267.566 1.00 0.00 C +ATOM 67 CA GLY A 67 235.387 244.503 268.127 1.00 0.00 C +ATOM 68 CA VAL A 68 237.174 247.423 266.455 1.00 0.00 C +ATOM 69 CA ASP A 69 240.801 248.542 266.785 1.00 0.00 C +ATOM 70 CA GLY A 70 244.100 250.362 266.220 1.00 0.00 C +ATOM 71 CA VAL A 71 243.870 254.114 266.842 1.00 0.00 C +ATOM 72 CA ASP A 72 241.430 256.078 264.674 1.00 0.00 C +ATOM 73 CA GLY A 73 242.492 259.567 263.569 1.00 0.00 C +ATOM 74 CA GLY A 74 241.668 262.045 260.795 1.00 0.00 C +ATOM 75 CA ALA A 75 237.901 262.616 260.746 1.00 0.00 C +ATOM 76 CA ALA A 76 234.261 261.512 260.532 1.00 0.00 C +ATOM 77 CA LYS A 77 232.433 262.022 263.836 1.00 0.00 C +ATOM 78 CA PRO A 78 234.897 261.747 266.729 1.00 0.00 C +ATOM 79 CA GLU A 79 234.251 260.480 270.263 1.00 0.00 C +ATOM 80 CA GLU A 80 234.637 262.006 273.733 1.00 0.00 C +ATOM 81 CA ALA A 81 233.344 264.283 276.500 1.00 0.00 C +ATOM 82 CA THR A 82 233.392 264.239 280.310 1.00 0.00 C +ATOM 83 CA PRO A 83 231.677 261.185 281.809 1.00 0.00 C +ATOM 84 CA GLY A 84 231.569 257.378 281.898 1.00 0.00 C +ATOM 85 CA ARG A 85 231.670 254.095 283.829 1.00 0.00 C +ATOM 86 CA GLU A 86 233.102 250.953 282.221 1.00 0.00 C +ATOM 87 CA THR A 87 230.927 250.378 279.145 1.00 0.00 C +ATOM 88 CA ASP A 88 229.491 248.001 276.537 1.00 0.00 C +ATOM 89 CA GLY A 89 230.628 244.381 276.877 1.00 0.00 C +ATOM 90 CA MET A 90 232.861 241.506 275.752 1.00 0.00 C +ATOM 91 CA ARG A 91 234.391 238.821 277.979 1.00 0.00 C +ATOM 92 CA ARG A 92 236.811 237.564 280.641 1.00 0.00 C +ATOM 93 CA ILE A 93 237.992 234.031 281.438 1.00 0.00 C +ATOM 94 CA ARG A 94 236.055 231.295 279.627 1.00 0.00 C +ATOM 95 CA ARG A 95 232.962 232.700 277.900 1.00 0.00 C +ATOM 96 CA ARG A 96 229.906 234.715 278.958 1.00 0.00 C +ATOM 97 CA ARG A 97 228.374 235.067 282.428 1.00 0.00 C +ATOM 98 CA ARG A 98 227.305 232.955 285.413 1.00 0.00 C +ATOM 99 CA ARG A 99 229.291 231.142 288.112 1.00 0.00 C +ATOM 100 CA LEU A 100 231.931 229.906 290.566 1.00 0.00 C +ATOM 101 CA ALA A 101 235.370 231.126 291.662 1.00 0.00 C +ATOM 102 CA ARG A 102 236.281 234.205 289.611 1.00 0.00 C +ATOM 103 CA ALA A 103 237.204 237.853 290.210 1.00 0.00 C +ATOM 104 CA GLU A 104 239.762 238.413 292.978 1.00 0.00 C +ATOM 105 CA ARG A 105 243.097 236.714 292.270 1.00 0.00 C +ATOM 106 CA ARG A 106 246.400 234.903 292.847 1.00 0.00 C +ATOM 107 CA GLU A 107 250.104 235.557 293.455 1.00 0.00 C +ATOM 108 CA ARG A 108 252.275 232.715 292.140 1.00 0.00 C +ATOM 109 CA ARG A 109 252.400 230.155 294.959 1.00 0.00 C +ATOM 110 CA GLU A 110 252.206 227.409 297.594 1.00 0.00 C +ATOM 111 CA GLU A 111 250.732 224.545 299.628 1.00 0.00 C +ATOM 112 CA GLY A 112 250.089 221.812 302.204 1.00 0.00 C +ATOM 113 CA ASN A 113 248.204 218.518 302.534 1.00 0.00 C +ATOM 114 CA ASP A 114 246.972 215.215 303.978 1.00 0.00 C +ATOM 115 CA GLY A 115 247.310 214.615 307.725 1.00 0.00 C +TER 116 GLY A 115 +END diff --git a/Plants/Q8S706/Q8S706.dcd b/Plants/Q8S706/Q8S706.dcd new file mode 100644 index 0000000000000000000000000000000000000000..695d063251fc1d85b9342ca344d3c97700cd2427 --- /dev/null +++ b/Plants/Q8S706/Q8S706.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e7cb6323e9d816c9fb5c580415a90affa218a47867b95a45773241ad0537f223 +size 43680276 diff --git a/Plants/Q8S706/top.pdb b/Plants/Q8S706/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..6ab08fb564d234e00e9afb5717fd19cd1331d43c --- /dev/null +++ b/Plants/Q8S706/top.pdb @@ -0,0 +1,240 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 303.765 258.850 241.972 1.00 0.00 C +ATOM 2 CA VAL A 2 304.652 259.351 245.643 1.00 0.00 C +ATOM 3 CA TRP A 3 307.051 262.071 246.811 1.00 0.00 C +ATOM 4 CA GLY A 4 306.276 263.939 250.040 1.00 0.00 C +ATOM 5 CA GLY A 5 305.699 265.014 253.650 1.00 0.00 C +ATOM 6 CA PRO A 6 304.565 262.442 256.222 1.00 0.00 C +ATOM 7 CA ARG A 7 307.142 261.984 258.991 1.00 0.00 C +ATOM 8 CA GLU A 8 307.863 264.329 261.906 1.00 0.00 C +ATOM 9 CA LEU A 9 305.667 264.285 265.019 1.00 0.00 C +ATOM 10 CA LYS A 10 306.259 262.873 268.508 1.00 0.00 C +ATOM 11 CA ASP A 11 308.281 260.458 270.651 1.00 0.00 C +ATOM 12 CA GLY A 12 308.259 256.783 271.658 1.00 0.00 C +ATOM 13 CA GLY A 13 305.603 254.581 270.042 1.00 0.00 C +ATOM 14 CA GLY A 14 302.358 252.585 270.120 1.00 0.00 C +ATOM 15 CA ALA A 15 301.061 249.029 269.685 1.00 0.00 C +ATOM 16 CA ARG A 16 302.150 246.028 271.765 1.00 0.00 C +ATOM 17 CA ASP A 17 304.463 243.682 273.678 1.00 0.00 C +ATOM 18 CA TRP A 18 308.243 244.154 273.614 1.00 0.00 C +ATOM 19 CA ARG A 19 311.330 243.729 275.805 1.00 0.00 C +ATOM 20 CA GLY A 20 313.736 246.584 276.566 1.00 0.00 C +ATOM 21 CA GLY A 21 312.877 249.743 274.618 1.00 0.00 C +ATOM 22 CA PRO A 22 309.516 250.170 272.874 1.00 0.00 C +ATOM 23 CA TRP A 23 306.799 250.273 275.542 1.00 0.00 C +ATOM 24 CA ARG A 24 304.371 252.736 277.141 1.00 0.00 C +ATOM 25 CA ARG A 25 304.338 252.751 280.951 1.00 0.00 C +ATOM 26 CA THR A 26 302.621 255.841 282.372 1.00 0.00 C +ATOM 27 CA GLY A 27 299.173 256.972 283.534 1.00 0.00 C +ATOM 28 CA GLY A 28 297.970 260.582 283.719 1.00 0.00 C +ATOM 29 CA ARG A 29 297.918 264.392 283.697 1.00 0.00 C +ATOM 30 CA GLY A 30 294.428 265.915 283.561 1.00 0.00 C +ATOM 31 CA GLY A 31 291.123 265.984 281.667 1.00 0.00 C +ATOM 32 CA GLY A 32 289.982 265.093 278.142 1.00 0.00 C +ATOM 33 CA GLU A 33 289.456 262.358 275.543 1.00 0.00 C +ATOM 34 CA ALA A 34 288.330 261.160 272.106 1.00 0.00 C +ATOM 35 CA GLU A 35 284.709 260.357 271.233 1.00 0.00 C +ATOM 36 CA GLN A 36 282.590 257.911 273.244 1.00 0.00 C +ATOM 37 CA ARG A 37 280.388 259.975 275.570 1.00 0.00 C +ATOM 38 CA ARG A 38 278.456 263.248 275.312 1.00 0.00 C +ATOM 39 CA GLY A 39 275.235 263.960 273.405 1.00 0.00 C +ATOM 40 CA GLY A 40 274.987 266.475 270.553 1.00 0.00 C +ATOM 41 CA THR A 41 276.707 268.793 268.067 1.00 0.00 C +ATOM 42 CA PHE A 42 276.591 267.466 264.497 1.00 0.00 C +ATOM 43 CA ARG A 43 276.735 269.557 261.315 1.00 0.00 C +ATOM 44 CA GLY A 44 275.899 272.329 258.839 1.00 0.00 C +ATOM 45 CA THR A 45 273.297 272.524 256.063 1.00 0.00 C +ATOM 46 CA SER A 46 272.396 269.424 254.039 1.00 0.00 C +ATOM 47 CA GLU A 47 271.119 265.853 254.408 1.00 0.00 C +ATOM 48 CA GLN A 48 270.700 262.149 253.619 1.00 0.00 C +ATOM 49 CA PRO A 49 268.108 261.172 251.003 1.00 0.00 C +ATOM 50 CA ASN A 50 264.797 260.092 252.549 1.00 0.00 C +ATOM 51 CA GLY A 51 261.842 262.495 252.432 1.00 0.00 C +ATOM 52 CA SER A 52 259.366 261.422 255.121 1.00 0.00 C +ATOM 53 CA GLY A 53 255.989 259.940 254.166 1.00 0.00 C +ATOM 54 CA LEU A 54 253.874 256.775 254.325 1.00 0.00 C +ATOM 55 CA ILE A 55 251.612 254.475 252.298 1.00 0.00 C +ATOM 56 CA GLN A 56 248.069 254.367 253.693 1.00 0.00 C +ATOM 57 CA ASP A 57 247.900 254.539 257.495 1.00 0.00 C +ATOM 58 CA ASP A 58 244.591 254.063 259.324 1.00 0.00 C +ATOM 59 CA ALA A 59 241.809 251.783 258.067 1.00 0.00 C +ATOM 60 CA ASN A 60 238.404 250.508 259.206 1.00 0.00 C +ATOM 61 CA GLY A 61 234.739 251.506 258.909 1.00 0.00 C +ATOM 62 CA LYS A 62 233.238 254.878 259.854 1.00 0.00 C +ATOM 63 CA ASN A 63 231.509 258.271 259.754 1.00 0.00 C +ATOM 64 CA LEU A 64 229.800 261.593 259.004 1.00 0.00 C +ATOM 65 CA GLY A 65 231.832 264.176 260.933 1.00 0.00 C +ATOM 66 CA GLU A 66 230.829 264.936 264.529 1.00 0.00 C +ATOM 67 CA GLU A 67 233.841 265.815 266.690 1.00 0.00 C +ATOM 68 CA LEU A 68 235.871 264.008 269.360 1.00 0.00 C +ATOM 69 CA THR A 69 234.678 263.699 272.965 1.00 0.00 C +ATOM 70 CA GLY A 70 236.476 261.097 275.089 1.00 0.00 C +ATOM 71 CA VAL A 71 234.791 257.956 276.436 1.00 0.00 C +ATOM 72 CA ARG A 72 232.472 255.203 275.189 1.00 0.00 C +ATOM 73 CA LYS A 73 233.023 251.514 275.965 1.00 0.00 C +ATOM 74 CA ARG A 74 234.737 249.396 273.301 1.00 0.00 C +ATOM 75 CA TYR A 75 238.228 247.876 273.429 1.00 0.00 C +ATOM 76 CA ARG A 76 240.780 250.650 273.986 1.00 0.00 C +ATOM 77 CA ARG A 77 239.787 254.320 274.235 1.00 0.00 C +ATOM 78 CA ARG A 78 242.367 256.785 272.899 1.00 0.00 C +ATOM 79 CA GLY A 79 245.947 255.529 272.552 1.00 0.00 C +ATOM 80 CA TRP A 80 249.666 254.749 272.268 1.00 0.00 C +ATOM 81 CA SER A 81 251.058 254.997 268.731 1.00 0.00 C +ATOM 82 CA ARG A 82 253.371 252.115 267.801 1.00 0.00 C +ATOM 83 CA GLY A 83 254.412 248.521 267.082 1.00 0.00 C +ATOM 84 CA GLU A 84 252.260 245.535 266.098 1.00 0.00 C +ATOM 85 CA ALA A 85 253.890 242.820 263.980 1.00 0.00 C +ATOM 86 CA ASP A 86 255.309 241.982 260.544 1.00 0.00 C +ATOM 87 CA ALA A 87 255.032 239.802 257.432 1.00 0.00 C +ATOM 88 CA THR A 88 255.050 241.064 253.837 1.00 0.00 C +ATOM 89 CA ALA A 89 258.322 242.955 253.353 1.00 0.00 C +ATOM 90 CA GLY A 90 260.730 243.082 256.302 1.00 0.00 C +ATOM 91 CA ARG A 91 264.241 244.221 255.356 1.00 0.00 C +ATOM 92 CA HIS A 92 267.979 244.340 256.084 1.00 0.00 C +ATOM 93 CA SER A 93 269.553 242.168 253.379 1.00 0.00 C +ATOM 94 CA ALA A 94 269.027 238.412 253.745 1.00 0.00 C +ATOM 95 CA GLU A 95 266.335 235.865 252.862 1.00 0.00 C +ATOM 96 CA ARG A 96 265.451 232.617 251.076 1.00 0.00 C +ATOM 97 CA ALA A 97 262.671 230.816 249.195 1.00 0.00 C +ATOM 98 CA SER A 98 262.651 227.045 248.649 1.00 0.00 C +ATOM 99 CA PRO A 99 261.442 225.977 245.197 1.00 0.00 C +ATOM 100 CA THR A 100 258.298 223.896 245.749 1.00 0.00 C +ATOM 101 CA ARG A 101 254.703 222.763 245.200 1.00 0.00 C +ATOM 102 CA THR A 102 252.147 220.891 247.316 1.00 0.00 C +ATOM 103 CA THR A 103 250.602 222.402 250.454 1.00 0.00 C +ATOM 104 CA ALA A 104 250.234 226.193 250.384 1.00 0.00 C +ATOM 105 CA GLU A 105 249.672 227.431 246.825 1.00 0.00 C +ATOM 106 CA GLU A 106 246.644 229.478 245.749 1.00 0.00 C +ATOM 107 CA GLY A 107 247.761 233.084 245.235 1.00 0.00 C +ATOM 108 CA GLU A 108 246.753 236.756 245.369 1.00 0.00 C +ATOM 109 CA ASN A 109 243.659 238.272 246.995 1.00 0.00 C +ATOM 110 CA ASP A 110 242.140 240.346 249.807 1.00 0.00 C +ATOM 111 CA ASP A 111 240.008 240.913 252.912 1.00 0.00 C +ATOM 112 CA GLU A 112 237.176 240.279 255.381 1.00 0.00 C +ATOM 113 CA ARG A 113 234.043 240.765 257.495 1.00 0.00 C +ATOM 114 CA ARG A 114 234.229 241.222 261.273 1.00 0.00 C +ATOM 115 CA GLY A 115 235.594 242.310 264.659 1.00 0.00 C +ATOM 116 CA GLY A 116 238.418 240.781 266.709 1.00 0.00 C +ATOM 117 CA SER A 117 241.977 240.742 268.069 1.00 0.00 C +ATOM 118 CA GLY A 118 244.691 238.535 266.559 1.00 0.00 C +ATOM 119 CA VAL A 119 243.635 236.431 263.563 1.00 0.00 C +ATOM 120 CA MET A 120 241.300 233.514 264.308 1.00 0.00 C +ATOM 121 CA GLU A 121 238.439 232.991 266.770 1.00 0.00 C +ATOM 122 CA GLU A 122 236.202 230.065 265.798 1.00 0.00 C +ATOM 123 CA ARG A 123 236.111 226.508 267.161 1.00 0.00 C +ATOM 124 CA LYS A 124 233.324 224.590 265.410 1.00 0.00 C +ATOM 125 CA ARG A 125 231.861 221.765 267.507 1.00 0.00 C +ATOM 126 CA GLU A 126 231.890 218.517 265.514 1.00 0.00 C +ATOM 127 CA LEU A 127 231.896 214.906 266.729 1.00 0.00 C +ATOM 128 CA VAL A 128 233.270 213.999 270.165 1.00 0.00 C +ATOM 129 CA CYS A 129 234.743 216.540 272.591 1.00 0.00 C +ATOM 130 CA HIS A 130 232.367 219.226 273.877 1.00 0.00 C +ATOM 131 CA GLY A 131 228.723 220.329 273.739 1.00 0.00 C +ATOM 132 CA ALA A 132 226.849 223.447 272.605 1.00 0.00 C +ATOM 133 CA GLY A 133 226.384 227.052 273.747 1.00 0.00 C +ATOM 134 CA ALA A 134 226.366 230.656 274.981 1.00 0.00 C +ATOM 135 CA ARG A 135 228.520 233.505 276.308 1.00 0.00 C +ATOM 136 CA ARG A 136 228.748 237.297 276.594 1.00 0.00 C +ATOM 137 CA GLN A 137 227.742 240.811 275.517 1.00 0.00 C +ATOM 138 CA HIS A 138 230.652 242.339 273.589 1.00 0.00 C +ATOM 139 CA VAL A 139 233.013 241.499 270.720 1.00 0.00 C +ATOM 140 CA ALA A 140 235.277 238.700 271.966 1.00 0.00 C +ATOM 141 CA SER A 141 235.235 238.595 275.774 1.00 0.00 C +ATOM 142 CA ALA A 142 238.205 237.827 278.034 1.00 0.00 C +ATOM 143 CA ALA A 143 241.894 237.606 277.105 1.00 0.00 C +ATOM 144 CA GLN A 144 242.748 239.574 273.956 1.00 0.00 C +ATOM 145 CA GLY A 145 244.168 243.109 273.917 1.00 0.00 C +ATOM 146 CA LEU A 146 246.898 245.764 273.769 1.00 0.00 C +ATOM 147 CA MET A 147 247.248 248.824 271.527 1.00 0.00 C +ATOM 148 CA ALA A 148 244.928 249.719 268.640 1.00 0.00 C +ATOM 149 CA ALA A 149 242.772 252.735 267.761 1.00 0.00 C +ATOM 150 CA ALA A 150 245.038 255.143 265.868 1.00 0.00 C +ATOM 151 CA PHE A 151 247.077 257.944 264.281 1.00 0.00 C +ATOM 152 CA GLY A 152 246.172 259.916 261.149 1.00 0.00 C +ATOM 153 CA ARG A 153 245.319 261.097 257.629 1.00 0.00 C +ATOM 154 CA SER A 154 246.851 263.550 255.148 1.00 0.00 C +ATOM 155 CA ALA A 155 250.352 262.757 253.872 1.00 0.00 C +ATOM 156 CA THR A 156 250.546 264.039 250.289 1.00 0.00 C +ATOM 157 CA SER A 157 247.067 265.139 249.193 1.00 0.00 C +ATOM 158 CA ARG A 158 244.506 265.490 246.394 1.00 0.00 C +ATOM 159 CA ALA A 159 241.156 266.840 245.181 1.00 0.00 C +ATOM 160 CA SER A 160 241.608 270.142 243.333 1.00 0.00 C +ATOM 161 CA ALA A 161 240.236 273.122 245.271 1.00 0.00 C +ATOM 162 CA ARG A 162 240.578 276.916 245.218 1.00 0.00 C +ATOM 163 CA ALA A 163 237.382 278.280 243.655 1.00 0.00 C +ATOM 164 CA THR A 164 233.899 279.326 244.787 1.00 0.00 C +ATOM 165 CA ARG A 165 233.411 282.228 247.207 1.00 0.00 C +ATOM 166 CA GLY A 166 235.060 285.523 246.237 1.00 0.00 C +ATOM 167 CA CYS A 167 236.662 287.487 249.082 1.00 0.00 C +ATOM 168 CA GLY A 168 235.303 287.058 252.616 1.00 0.00 C +ATOM 169 CA ARG A 169 235.325 284.572 255.503 1.00 0.00 C +ATOM 170 CA ILE A 170 234.567 281.203 253.892 1.00 0.00 C +ATOM 171 CA SER A 171 235.470 277.810 255.370 1.00 0.00 C +ATOM 172 CA ASN A 172 238.290 278.327 257.880 1.00 0.00 C +ATOM 173 CA GLY A 173 241.611 279.925 256.912 1.00 0.00 C +ATOM 174 CA GLY A 174 242.787 283.534 257.237 1.00 0.00 C +ATOM 175 CA GLY A 175 246.575 283.655 257.625 1.00 0.00 C +ATOM 176 CA GLY A 176 248.169 280.687 259.405 1.00 0.00 C +ATOM 177 CA LYS A 177 248.665 277.739 257.042 1.00 0.00 C +ATOM 178 CA SER A 178 247.868 274.995 254.523 1.00 0.00 C +ATOM 179 CA ALA A 179 244.268 274.065 253.691 1.00 0.00 C +ATOM 180 CA PRO A 180 240.985 273.645 251.804 1.00 0.00 C +ATOM 181 CA ARG A 181 240.324 270.003 250.902 1.00 0.00 C +ATOM 182 CA ARG A 182 238.015 267.173 251.984 1.00 0.00 C +ATOM 183 CA GLY A 183 239.624 263.857 251.020 1.00 0.00 C +ATOM 184 CA ARG A 184 238.102 261.226 248.722 1.00 0.00 C +ATOM 185 CA SER A 185 236.040 260.505 245.601 1.00 0.00 C +ATOM 186 CA ASN A 186 234.276 260.438 242.225 1.00 0.00 C +ATOM 187 CA GLU A 187 232.241 259.689 239.092 1.00 0.00 C +ATOM 188 CA ARG A 188 229.035 257.630 239.078 1.00 0.00 C +ATOM 189 CA GLU A 189 227.601 254.717 237.084 1.00 0.00 C +ATOM 190 CA ARG A 190 225.589 252.669 234.580 1.00 0.00 C +ATOM 191 CA ASN A 191 225.726 248.904 234.016 1.00 0.00 C +ATOM 192 CA SER A 192 228.879 246.967 233.108 1.00 0.00 C +ATOM 193 CA GLU A 193 229.271 243.325 234.154 1.00 0.00 C +ATOM 194 CA ARG A 194 228.605 239.603 234.625 1.00 0.00 C +ATOM 195 CA GLU A 195 225.588 237.327 234.142 1.00 0.00 C +ATOM 196 CA GLU A 196 224.250 233.794 234.638 1.00 0.00 C +ATOM 197 CA GLU A 197 221.193 231.660 233.853 1.00 0.00 C +ATOM 198 CA ASN A 198 217.904 230.658 232.211 1.00 0.00 C +ATOM 199 CA GLU A 199 217.589 229.478 228.602 1.00 0.00 C +ATOM 200 CA ARG A 200 214.778 228.498 226.224 1.00 0.00 C +ATOM 201 CA ALA A 201 214.117 231.381 223.822 1.00 0.00 C +ATOM 202 CA ARG A 202 214.877 234.396 221.620 1.00 0.00 C +ATOM 203 CA GLU A 203 215.703 238.056 220.959 1.00 0.00 C +ATOM 204 CA LEU A 204 218.696 239.970 222.334 1.00 0.00 C +ATOM 205 CA SER A 205 222.462 239.979 222.913 1.00 0.00 C +ATOM 206 CA LEU A 206 224.303 240.393 219.603 1.00 0.00 C +ATOM 207 CA GLY A 207 224.019 241.514 215.973 1.00 0.00 C +ATOM 208 CA SER A 208 220.462 242.338 214.887 1.00 0.00 C +ATOM 209 CA ALA A 209 220.150 241.128 211.287 1.00 0.00 C +ATOM 210 CA HIS A 210 216.439 241.089 210.424 1.00 0.00 C +ATOM 211 CA ALA A 211 214.016 240.663 207.515 1.00 0.00 C +ATOM 212 CA HIS A 212 215.020 238.854 204.315 1.00 0.00 C +ATOM 213 CA ALA A 213 215.821 239.594 200.665 1.00 0.00 C +ATOM 214 CA SER A 214 213.578 241.756 198.471 1.00 0.00 C +ATOM 215 CA HIS A 215 214.459 242.554 194.852 1.00 0.00 C +ATOM 216 CA VAL A 216 215.293 240.637 191.666 1.00 0.00 C +ATOM 217 CA ARG A 217 217.315 242.507 189.034 1.00 0.00 C +ATOM 218 CA GLU A 218 219.187 240.224 186.625 1.00 0.00 C +ATOM 219 CA GLU A 219 220.429 236.623 186.687 1.00 0.00 C +ATOM 220 CA GLY A 220 223.906 235.740 187.968 1.00 0.00 C +ATOM 221 CA GLY A 221 224.881 237.022 191.422 1.00 0.00 C +ATOM 222 CA GLY A 222 227.811 236.908 193.854 1.00 0.00 C +ATOM 223 CA ARG A 223 230.698 239.297 193.164 1.00 0.00 C +ATOM 224 CA GLN A 224 230.083 241.640 190.223 1.00 0.00 C +ATOM 225 CA ARG A 225 230.377 242.158 186.460 1.00 0.00 C +ATOM 226 CA GLU A 226 230.888 238.828 184.680 1.00 0.00 C +ATOM 227 CA GLU A 227 232.087 239.271 181.091 1.00 0.00 C +ATOM 228 CA MET A 228 232.403 237.313 177.838 1.00 0.00 C +ATOM 229 CA GLY A 229 234.459 237.619 174.645 1.00 0.00 C +ATOM 230 CA TRP A 230 234.585 234.271 172.832 1.00 0.00 C +ATOM 231 CA GLY A 231 236.759 233.594 169.777 1.00 0.00 C +ATOM 232 CA GLY A 232 236.302 235.155 166.332 1.00 0.00 C +ATOM 233 CA ALA A 233 236.395 238.960 166.162 1.00 0.00 C +ATOM 234 CA PHE A 234 236.898 240.528 162.726 1.00 0.00 C +ATOM 235 CA GLY A 235 236.718 241.132 158.968 1.00 0.00 C +ATOM 236 CA PRO A 236 237.921 244.464 157.567 1.00 0.00 C +TER 237 PRO A 236 +END diff --git a/Plants/Q8S742/Q8S742.dcd b/Plants/Q8S742/Q8S742.dcd new file mode 100644 index 0000000000000000000000000000000000000000..7a5120f42ced44cd37143e3b757cfadadceb72ed --- /dev/null +++ b/Plants/Q8S742/Q8S742.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:cd2a30ffbbc21bd1a1d55f7971c3e1154d1ec6094994107b766f0262012b674d +size 10880276 diff --git a/Plants/Q8S742/top.pdb b/Plants/Q8S742/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..763c259a6db70cefde2569d81384e970d6d24784 --- /dev/null +++ b/Plants/Q8S742/top.pdb @@ -0,0 +1,88 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 221.249 298.755 270.547 1.00 0.00 C +ATOM 2 CA LYS A 2 220.723 301.293 267.755 1.00 0.00 C +ATOM 3 CA PRO A 3 222.913 303.444 265.497 1.00 0.00 C +ATOM 4 CA GLY A 4 225.880 302.780 263.201 1.00 0.00 C +ATOM 5 CA ILE A 5 229.567 302.106 263.885 1.00 0.00 C +ATOM 6 CA TYR A 6 232.204 302.733 261.208 1.00 0.00 C +ATOM 7 CA LEU A 7 235.121 301.584 259.043 1.00 0.00 C +ATOM 8 CA GLY A 8 238.756 302.598 258.523 1.00 0.00 C +ATOM 9 CA GLY A 9 241.310 299.775 258.685 1.00 0.00 C +ATOM 10 CA THR A 10 239.864 296.271 258.305 1.00 0.00 C +ATOM 11 CA ASP A 11 240.859 294.220 255.252 1.00 0.00 C +ATOM 12 CA VAL A 12 241.777 292.225 252.139 1.00 0.00 C +ATOM 13 CA PRO A 13 240.895 288.539 251.757 1.00 0.00 C +ATOM 14 CA THR A 14 243.333 285.655 251.253 1.00 0.00 C +ATOM 15 CA PRO A 15 246.594 284.412 252.782 1.00 0.00 C +ATOM 16 CA GLY A 16 248.530 283.560 255.951 1.00 0.00 C +ATOM 17 CA GLY A 17 249.500 279.962 256.744 1.00 0.00 C +ATOM 18 CA SER A 18 247.675 276.875 255.458 1.00 0.00 C +ATOM 19 CA THR A 19 246.626 274.163 252.995 1.00 0.00 C +ATOM 20 CA PRO A 20 246.440 274.834 249.249 1.00 0.00 C +ATOM 21 CA ALA A 21 246.440 273.869 245.564 1.00 0.00 C +ATOM 22 CA PRO A 22 248.965 271.087 244.932 1.00 0.00 C +ATOM 23 CA ALA A 23 252.735 271.509 244.578 1.00 0.00 C +ATOM 24 CA ARG A 24 256.348 270.750 245.521 1.00 0.00 C +ATOM 25 CA ASP A 25 258.595 270.295 248.563 1.00 0.00 C +ATOM 26 CA GLU A 26 260.551 268.780 251.461 1.00 0.00 C +ATOM 27 CA CYS A 27 262.484 267.158 254.316 1.00 0.00 C +ATOM 28 CA LEU A 28 266.148 267.854 255.094 1.00 0.00 C +ATOM 29 CA GLU A 29 268.860 267.851 252.418 1.00 0.00 C +ATOM 30 CA ALA A 30 271.996 265.721 252.800 1.00 0.00 C +ATOM 31 CA LEU A 31 274.156 264.232 255.563 1.00 0.00 C +ATOM 32 CA ILE A 32 274.049 260.915 257.435 1.00 0.00 C +ATOM 33 CA ASN A 33 273.511 257.348 258.662 1.00 0.00 C +ATOM 34 CA PRO A 34 274.182 255.913 262.127 1.00 0.00 C +ATOM 35 CA THR A 35 271.537 254.897 264.674 1.00 0.00 C +ATOM 36 CA GLY A 36 271.006 251.167 264.108 1.00 0.00 C +ATOM 37 CA ARG A 37 267.516 250.058 263.057 1.00 0.00 C +ATOM 38 CA GLY A 38 265.523 249.546 259.850 1.00 0.00 C +ATOM 39 CA GLU A 39 262.902 248.289 257.387 1.00 0.00 C +ATOM 40 CA ALA A 40 264.062 248.882 253.807 1.00 0.00 C +ATOM 41 CA GLY A 41 262.797 245.974 251.695 1.00 0.00 C +ATOM 42 CA SER A 42 264.552 243.027 250.037 1.00 0.00 C +ATOM 43 CA GLY A 43 268.170 241.991 250.630 1.00 0.00 C +ATOM 44 CA ARG A 44 269.770 241.221 247.259 1.00 0.00 C +ATOM 45 CA PRO A 45 271.096 237.675 246.828 1.00 0.00 C +ATOM 46 CA CYS A 46 271.592 234.468 248.823 1.00 0.00 C +ATOM 47 CA PRO A 47 269.888 231.078 248.474 1.00 0.00 C +ATOM 48 CA ARG A 48 266.819 228.962 247.685 1.00 0.00 C +ATOM 49 CA GLY A 49 263.299 228.731 249.124 1.00 0.00 C +ATOM 50 CA ARG A 50 259.813 229.283 250.559 1.00 0.00 C +ATOM 51 CA ASN A 51 257.294 226.548 249.728 1.00 0.00 C +ATOM 52 CA GLY A 52 256.091 226.056 246.147 1.00 0.00 C +ATOM 53 CA SER A 53 254.171 227.777 243.342 1.00 0.00 C +ATOM 54 CA GLY A 54 251.644 227.049 240.585 1.00 0.00 C +ATOM 55 CA PRO A 55 248.085 228.034 239.650 1.00 0.00 C +ATOM 56 CA THR A 56 245.578 230.233 241.493 1.00 0.00 C +ATOM 57 CA PRO A 57 245.034 228.434 244.807 1.00 0.00 C +ATOM 58 CA ARG A 58 243.738 224.884 244.322 1.00 0.00 C +ATOM 59 CA GLY A 59 241.734 222.941 241.728 1.00 0.00 C +ATOM 60 CA ASP A 60 239.327 225.474 240.209 1.00 0.00 C +ATOM 61 CA LYS A 61 238.654 229.093 239.226 1.00 0.00 C +ATOM 62 CA ARG A 62 236.125 230.378 236.682 1.00 0.00 C +ATOM 63 CA ARG A 63 236.702 228.473 233.433 1.00 0.00 C +ATOM 64 CA GLY A 64 238.478 229.628 230.266 1.00 0.00 C +ATOM 65 CA GLY A 65 241.645 228.731 228.346 1.00 0.00 C +ATOM 66 CA LEU A 66 245.057 227.058 228.080 1.00 0.00 C +ATOM 67 CA VAL A 67 246.432 224.186 230.172 1.00 0.00 C +ATOM 68 CA THR A 68 247.503 220.893 231.763 1.00 0.00 C +ATOM 69 CA LEU A 69 245.832 219.712 234.976 1.00 0.00 C +ATOM 70 CA GLY A 70 244.161 216.328 235.499 1.00 0.00 C +ATOM 71 CA PRO A 71 246.520 213.348 235.774 1.00 0.00 C +ATOM 72 CA ASP A 72 249.723 214.461 237.511 1.00 0.00 C +ATOM 73 CA PRO A 73 249.131 213.624 241.181 1.00 0.00 C +ATOM 74 CA GLY A 74 247.602 216.791 242.647 1.00 0.00 C +ATOM 75 CA HIS A 75 244.357 218.110 244.147 1.00 0.00 C +ATOM 76 CA VAL A 76 242.565 218.650 247.465 1.00 0.00 C +ATOM 77 CA GLY A 77 238.762 218.512 247.647 1.00 0.00 C +ATOM 78 CA ASP A 78 237.512 219.095 251.199 1.00 0.00 C +ATOM 79 CA CYS A 79 240.033 220.684 253.573 1.00 0.00 C +ATOM 80 CA GLY A 80 238.322 222.121 256.659 1.00 0.00 C +ATOM 81 CA TYR A 81 235.897 219.440 257.863 1.00 0.00 C +ATOM 82 CA PRO A 82 236.370 215.773 258.781 1.00 0.00 C +ATOM 83 CA ASN A 83 234.376 213.197 260.758 1.00 0.00 C +ATOM 84 CA LEU A 84 236.365 209.964 261.080 1.00 0.00 C +TER 85 LEU A 84 +END diff --git a/Plants/Q8S751/Q8S751.dcd b/Plants/Q8S751/Q8S751.dcd new file mode 100644 index 0000000000000000000000000000000000000000..d9c24821e06168c591934a87f4fb8dd56415e071 --- /dev/null +++ b/Plants/Q8S751/Q8S751.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f934fc405a021943e33b52c22d9f87a1a2c5abd6aa8a627655edd53a36a95fd9 +size 20600276 diff --git a/Plants/Q8S751/top.pdb b/Plants/Q8S751/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..67b74b53739bfde79d525761a35a971933eec63f --- /dev/null +++ b/Plants/Q8S751/top.pdb @@ -0,0 +1,169 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 261.982 274.798 219.382 1.00 0.00 C +ATOM 2 CA ARG A 2 264.699 273.189 217.249 1.00 0.00 C +ATOM 3 CA GLY A 3 267.146 273.559 214.353 1.00 0.00 C +ATOM 4 CA PRO A 4 270.862 272.718 214.428 1.00 0.00 C +ATOM 5 CA PRO A 5 273.151 269.917 215.624 1.00 0.00 C +ATOM 6 CA VAL A 6 273.732 266.346 216.820 1.00 0.00 C +ATOM 7 CA SER A 7 273.545 263.331 214.499 1.00 0.00 C +ATOM 8 CA GLY A 8 270.653 261.129 215.643 1.00 0.00 C +ATOM 9 CA PRO A 9 268.356 258.426 214.252 1.00 0.00 C +ATOM 10 CA GLY A 10 266.123 257.411 211.337 1.00 0.00 C +ATOM 11 CA GLU A 11 265.012 258.551 207.875 1.00 0.00 C +ATOM 12 CA ARG A 12 263.575 262.015 207.203 1.00 0.00 C +ATOM 13 CA GLY A 13 263.646 265.774 207.819 1.00 0.00 C +ATOM 14 CA ARG A 14 266.826 267.087 209.457 1.00 0.00 C +ATOM 15 CA GLY A 15 269.578 269.686 209.021 1.00 0.00 C +ATOM 16 CA GLY A 16 273.243 268.644 209.018 1.00 0.00 C +ATOM 17 CA GLY A 17 274.984 265.296 208.494 1.00 0.00 C +ATOM 18 CA THR A 18 273.298 263.738 205.454 1.00 0.00 C +ATOM 19 CA ARG A 19 271.613 260.498 204.366 1.00 0.00 C +ATOM 20 CA ASP A 20 270.008 257.048 204.183 1.00 0.00 C +ATOM 21 CA PRO A 21 270.712 254.188 206.601 1.00 0.00 C +ATOM 22 CA LEU A 22 271.765 255.297 210.091 1.00 0.00 C +ATOM 23 CA VAL A 23 273.649 258.604 210.269 1.00 0.00 C +ATOM 24 CA SER A 24 277.101 258.684 208.657 1.00 0.00 C +ATOM 25 CA ASP A 25 279.523 255.764 208.309 1.00 0.00 C +ATOM 26 CA SER A 26 282.266 254.906 205.807 1.00 0.00 C +ATOM 27 CA ARG A 27 284.742 252.620 207.585 1.00 0.00 C +ATOM 28 CA VAL A 28 285.246 249.600 205.318 1.00 0.00 C +ATOM 29 CA ALA A 29 281.854 247.867 205.221 1.00 0.00 C +ATOM 30 CA GLY A 30 281.715 244.279 206.494 1.00 0.00 C +ATOM 31 CA LEU A 31 282.938 241.877 203.801 1.00 0.00 C +ATOM 32 CA PRO A 32 283.621 243.522 200.433 1.00 0.00 C +ATOM 33 CA TRP A 33 280.705 243.630 197.983 1.00 0.00 C +ATOM 34 CA THR A 34 281.615 244.968 194.534 1.00 0.00 C +ATOM 35 CA GLY A 35 284.041 246.340 191.936 1.00 0.00 C +ATOM 36 CA THR A 36 285.829 249.177 193.743 1.00 0.00 C +ATOM 37 CA THR A 37 286.250 250.960 197.084 1.00 0.00 C +ATOM 38 CA ARG A 38 288.429 253.019 199.435 1.00 0.00 C +ATOM 39 CA VAL A 39 289.018 255.132 202.550 1.00 0.00 C +ATOM 40 CA ILE A 40 289.386 258.893 203.037 1.00 0.00 C +ATOM 41 CA HIS A 41 286.447 261.119 202.076 1.00 0.00 C +ATOM 42 CA ARG A 42 284.023 264.056 202.202 1.00 0.00 C +ATOM 43 CA ARG A 43 281.640 263.468 205.116 1.00 0.00 C +ATOM 44 CA TYR A 44 283.093 263.812 208.622 1.00 0.00 C +ATOM 45 CA THR A 45 285.194 263.258 211.751 1.00 0.00 C +ATOM 46 CA GLY A 46 283.514 261.601 214.743 1.00 0.00 C +ATOM 47 CA SER A 47 281.695 263.043 217.764 1.00 0.00 C +ATOM 48 CA THR A 48 280.991 266.199 219.779 1.00 0.00 C +ATOM 49 CA ALA A 49 280.760 269.387 221.853 1.00 0.00 C +ATOM 50 CA ARG A 50 277.165 269.469 223.112 1.00 0.00 C +ATOM 51 CA ILE A 51 276.794 272.856 224.817 1.00 0.00 C +ATOM 52 CA GLY A 52 275.662 275.864 222.771 1.00 0.00 C +ATOM 53 CA PRO A 53 274.208 279.385 222.827 1.00 0.00 C +ATOM 54 CA GLY A 54 270.959 280.556 224.437 1.00 0.00 C +ATOM 55 CA PRO A 55 270.487 279.887 228.158 1.00 0.00 C +ATOM 56 CA ILE A 56 266.816 279.803 229.176 1.00 0.00 C +ATOM 57 CA GLY A 57 263.151 280.806 228.908 1.00 0.00 C +ATOM 58 CA ARG A 58 260.661 280.376 231.759 1.00 0.00 C +ATOM 59 CA CYS A 59 257.721 278.098 232.587 1.00 0.00 C +ATOM 60 CA GLY A 60 254.401 279.920 232.174 1.00 0.00 C +ATOM 61 CA GLY A 61 252.195 282.814 233.302 1.00 0.00 C +ATOM 62 CA GLY A 62 249.897 281.678 236.121 1.00 0.00 C +ATOM 63 CA GLN A 63 248.395 281.538 239.620 1.00 0.00 C +ATOM 64 CA ALA A 64 247.192 284.012 242.256 1.00 0.00 C +ATOM 65 CA ARG A 65 243.500 284.848 241.826 1.00 0.00 C +ATOM 66 CA LEU A 66 241.258 282.198 240.256 1.00 0.00 C +ATOM 67 CA GLY A 67 237.648 283.412 240.364 1.00 0.00 C +ATOM 68 CA SER A 68 237.179 285.720 243.359 1.00 0.00 C +ATOM 69 CA ALA A 69 234.252 288.155 243.217 1.00 0.00 C +ATOM 70 CA GLN A 70 232.645 291.596 243.518 1.00 0.00 C +ATOM 71 CA SER A 71 230.133 294.459 243.581 1.00 0.00 C +ATOM 72 CA ARG A 72 226.393 293.990 243.027 1.00 0.00 C +ATOM 73 CA PRO A 73 224.753 291.358 245.240 1.00 0.00 C +ATOM 74 CA THR A 74 225.236 287.850 246.646 1.00 0.00 C +ATOM 75 CA GLY A 75 227.150 285.322 248.758 1.00 0.00 C +ATOM 76 CA HIS A 76 229.895 282.944 249.910 1.00 0.00 C +ATOM 77 CA GLY A 77 228.560 279.399 249.500 1.00 0.00 C +ATOM 78 CA ASP A 78 227.432 275.768 249.745 1.00 0.00 C +ATOM 79 CA GLY A 79 230.237 273.255 250.326 1.00 0.00 C +ATOM 80 CA ALA A 80 230.666 269.582 251.243 1.00 0.00 C +ATOM 81 CA ARG A 81 232.039 266.108 250.491 1.00 0.00 C +ATOM 82 CA THR A 82 230.970 264.201 247.371 1.00 0.00 C +ATOM 83 CA ARG A 83 232.749 260.916 246.623 1.00 0.00 C +ATOM 84 CA THR A 84 235.136 258.177 245.474 1.00 0.00 C +ATOM 85 CA ARG A 85 234.900 254.508 246.473 1.00 0.00 C +ATOM 86 CA VAL A 86 233.508 250.997 245.972 1.00 0.00 C +ATOM 87 CA ALA A 87 229.884 251.197 247.130 1.00 0.00 C +ATOM 88 CA ASP A 88 228.819 254.316 249.042 1.00 0.00 C +ATOM 89 CA ASP A 89 226.960 255.744 252.045 1.00 0.00 C +ATOM 90 CA GLY A 90 223.373 254.460 252.007 1.00 0.00 C +ATOM 91 CA ASN A 91 220.409 253.066 250.062 1.00 0.00 C +ATOM 92 CA ALA A 92 219.882 250.466 247.328 1.00 0.00 C +ATOM 93 CA GLY A 93 218.643 247.032 246.237 1.00 0.00 C +ATOM 94 CA GLY A 94 218.617 243.338 245.307 1.00 0.00 C +ATOM 95 CA ASP A 95 215.903 242.399 242.803 1.00 0.00 C +ATOM 96 CA GLY A 96 214.481 238.991 243.742 1.00 0.00 C +ATOM 97 CA GLY A 97 211.247 237.324 242.613 1.00 0.00 C +ATOM 98 CA ALA A 98 209.427 235.176 245.180 1.00 0.00 C +ATOM 99 CA ARG A 99 208.705 231.734 246.646 1.00 0.00 C +ATOM 100 CA ARG A 100 209.624 229.486 249.581 1.00 0.00 C +ATOM 101 CA ARG A 101 212.995 229.418 251.354 1.00 0.00 C +ATOM 102 CA ARG A 102 216.078 229.884 249.164 1.00 0.00 C +ATOM 103 CA ARG A 103 215.640 233.212 247.362 1.00 0.00 C +ATOM 104 CA ALA A 104 214.897 236.181 249.631 1.00 0.00 C +ATOM 105 CA VAL A 105 214.729 239.502 251.491 1.00 0.00 C +ATOM 106 CA MET A 106 218.276 240.869 251.738 1.00 0.00 C +ATOM 107 CA LEU A 107 221.327 238.626 252.160 1.00 0.00 C +ATOM 108 CA LYS A 108 224.236 238.435 254.613 1.00 0.00 C +ATOM 109 CA ARG A 109 225.690 236.469 257.535 1.00 0.00 C +ATOM 110 CA ARG A 110 225.122 233.591 259.966 1.00 0.00 C +ATOM 111 CA LEU A 111 225.803 234.488 263.605 1.00 0.00 C +ATOM 112 CA THR A 112 227.584 234.553 266.972 1.00 0.00 C +ATOM 113 CA GLY A 113 230.944 232.997 267.869 1.00 0.00 C +ATOM 114 CA GLY A 114 230.433 229.556 269.423 1.00 0.00 C +ATOM 115 CA GLY A 115 230.062 226.025 270.805 1.00 0.00 C +ATOM 116 CA ALA A 116 232.090 222.816 271.127 1.00 0.00 C +ATOM 117 CA LYS A 117 232.523 220.677 274.250 1.00 0.00 C +ATOM 118 CA ALA A 118 229.517 218.533 275.190 1.00 0.00 C +ATOM 119 CA ALA A 119 227.591 220.465 277.850 1.00 0.00 C +ATOM 120 CA ALA A 120 229.487 223.531 279.081 1.00 0.00 C +ATOM 121 CA ARG A 121 232.590 225.518 278.113 1.00 0.00 C +ATOM 122 CA ARG A 122 235.563 225.356 280.491 1.00 0.00 C +ATOM 123 CA GLU A 123 238.987 227.024 280.544 1.00 0.00 C +ATOM 124 CA ARG A 124 241.106 229.917 281.832 1.00 0.00 C +ATOM 125 CA GLU A 125 244.743 230.934 282.340 1.00 0.00 C +ATOM 126 CA GLY A 126 246.555 228.621 284.766 1.00 0.00 C +ATOM 127 CA LYS A 127 246.458 230.086 288.281 1.00 0.00 C +ATOM 128 CA ARG A 128 245.314 230.531 291.888 1.00 0.00 C +ATOM 129 CA GLY A 129 246.032 228.949 295.279 1.00 0.00 C +ATOM 130 CA GLU A 130 246.552 226.287 297.955 1.00 0.00 C +ATOM 131 CA GLY A 131 249.665 224.267 297.091 1.00 0.00 C +ATOM 132 CA VAL A 132 251.891 224.112 300.179 1.00 0.00 C +ATOM 133 CA PRO A 133 254.256 221.660 301.886 1.00 0.00 C +ATOM 134 CA HIS A 134 257.467 221.834 303.928 1.00 0.00 C +ATOM 135 CA ARG A 135 260.526 219.577 303.668 1.00 0.00 C +ATOM 136 CA GLY A 136 259.285 216.207 302.397 1.00 0.00 C +ATOM 137 CA CYS A 137 257.974 213.534 304.775 1.00 0.00 C +ATOM 138 CA PRO A 138 258.060 210.153 303.022 1.00 0.00 C +ATOM 139 CA ALA A 139 255.899 208.527 300.338 1.00 0.00 C +ATOM 140 CA ARG A 140 252.242 207.510 300.667 1.00 0.00 C +ATOM 141 CA ARG A 141 248.962 209.147 301.706 1.00 0.00 C +ATOM 142 CA LYS A 142 246.108 211.446 302.750 1.00 0.00 C +ATOM 143 CA MET A 143 245.049 215.000 301.878 1.00 0.00 C +ATOM 144 CA MET A 144 244.823 218.693 302.787 1.00 0.00 C +ATOM 145 CA ALA A 145 245.475 222.444 302.634 1.00 0.00 C +ATOM 146 CA ASN A 146 246.577 224.924 305.308 1.00 0.00 C +ATOM 147 CA GLY A 147 246.289 228.461 303.923 1.00 0.00 C +ATOM 148 CA ASP A 148 248.868 230.611 305.724 1.00 0.00 C +ATOM 149 CA GLY A 149 251.295 233.097 307.287 1.00 0.00 C +ATOM 150 CA LYS A 150 251.056 236.856 306.719 1.00 0.00 C +ATOM 151 CA PRO A 151 251.288 237.803 303.036 1.00 0.00 C +ATOM 152 CA ARG A 152 248.429 236.320 301.000 1.00 0.00 C +ATOM 153 CA GLU A 153 246.764 234.179 298.324 1.00 0.00 C +ATOM 154 CA ASP A 154 243.899 235.501 296.188 1.00 0.00 C +ATOM 155 CA ASP A 155 241.141 237.231 298.166 1.00 0.00 C +ATOM 156 CA VAL A 156 238.857 235.284 300.513 1.00 0.00 C +ATOM 157 CA GLY A 157 239.384 231.514 300.677 1.00 0.00 C +ATOM 158 CA GLY A 158 237.127 229.948 303.318 1.00 0.00 C +ATOM 159 CA ARG A 159 235.468 230.401 306.717 1.00 0.00 C +ATOM 160 CA THR A 160 235.174 233.632 308.715 1.00 0.00 C +ATOM 161 CA SER A 161 236.825 237.022 309.259 1.00 0.00 C +ATOM 162 CA PHE A 162 239.806 237.779 311.508 1.00 0.00 C +ATOM 163 CA GLY A 163 242.927 235.701 312.184 1.00 0.00 C +ATOM 164 CA VAL A 164 246.575 236.134 313.193 1.00 0.00 C +ATOM 165 CA PRO A 165 247.934 239.458 311.919 1.00 0.00 C +TER 166 PRO A 165 +END diff --git a/Plants/Q8S759/Q8S759.dcd b/Plants/Q8S759/Q8S759.dcd new file mode 100644 index 0000000000000000000000000000000000000000..43fec1e0e32036eefec780a1daf84db7f56415ac --- /dev/null +++ b/Plants/Q8S759/Q8S759.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:d5eeffedde9c14e39e5601e45cc401491ca833059cfc69a72c642f53780640db +size 12920276 diff --git a/Plants/Q8S759/top.pdb b/Plants/Q8S759/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..71b396171a2fef715edc53ef1a858429f121a870 --- /dev/null +++ b/Plants/Q8S759/top.pdb @@ -0,0 +1,105 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 229.952 265.284 219.312 1.00 0.00 C +ATOM 2 CA ALA A 2 227.497 267.285 221.431 1.00 0.00 C +ATOM 3 CA SER A 3 226.720 270.918 222.277 1.00 0.00 C +ATOM 4 CA ALA A 4 227.799 272.687 225.474 1.00 0.00 C +ATOM 5 CA MET A 5 230.415 274.993 227.009 1.00 0.00 C +ATOM 6 CA THR A 6 230.514 278.204 224.959 1.00 0.00 C +ATOM 7 CA SER A 7 230.083 279.571 221.429 1.00 0.00 C +ATOM 8 CA SER A 8 232.808 282.174 220.873 1.00 0.00 C +ATOM 9 CA PRO A 9 231.172 285.610 221.070 1.00 0.00 C +ATOM 10 CA ALA A 10 228.892 287.220 223.663 1.00 0.00 C +ATOM 11 CA ALA A 11 226.930 284.720 225.765 1.00 0.00 C +ATOM 12 CA ALA A 12 225.103 283.451 228.858 1.00 0.00 C +ATOM 13 CA ARG A 13 226.371 282.487 232.319 1.00 0.00 C +ATOM 14 CA ALA A 14 224.423 282.469 235.594 1.00 0.00 C +ATOM 15 CA CYS A 15 224.078 281.144 239.149 1.00 0.00 C +ATOM 16 CA LYS A 16 226.943 279.089 240.593 1.00 0.00 C +ATOM 17 CA LEU A 17 226.251 277.604 244.033 1.00 0.00 C +ATOM 18 CA ALA A 18 225.263 273.934 243.773 1.00 0.00 C +ATOM 19 CA GLY A 19 222.802 271.230 242.701 1.00 0.00 C +ATOM 20 CA GLU A 20 222.178 269.785 239.231 1.00 0.00 C +ATOM 21 CA ARG A 21 224.434 267.780 236.905 1.00 0.00 C +ATOM 22 CA ARG A 22 225.539 264.227 237.726 1.00 0.00 C +ATOM 23 CA ARG A 23 225.012 260.455 237.643 1.00 0.00 C +ATOM 24 CA ASP A 24 223.095 259.665 240.840 1.00 0.00 C +ATOM 25 CA GLY A 25 220.204 257.995 242.674 1.00 0.00 C +ATOM 26 CA THR A 26 217.806 255.316 243.936 1.00 0.00 C +ATOM 27 CA ASN A 27 217.359 252.128 241.898 1.00 0.00 C +ATOM 28 CA GLY A 28 219.624 249.532 243.526 1.00 0.00 C +ATOM 29 CA GLY A 29 223.026 250.450 244.974 1.00 0.00 C +ATOM 30 CA HIS A 30 225.224 253.341 243.824 1.00 0.00 C +ATOM 31 CA GLN A 31 228.106 252.034 241.701 1.00 0.00 C +ATOM 32 CA HIS A 32 231.733 253.131 241.304 1.00 0.00 C +ATOM 33 CA VAL A 33 234.891 252.867 239.190 1.00 0.00 C +ATOM 34 CA GLU A 34 234.998 254.253 235.643 1.00 0.00 C +ATOM 35 CA SER A 35 238.232 256.201 235.127 1.00 0.00 C +ATOM 36 CA ASP A 36 240.866 258.356 233.415 1.00 0.00 C +ATOM 37 CA ALA A 37 244.050 257.161 231.696 1.00 0.00 C +ATOM 38 CA ALA A 38 247.518 257.161 233.274 1.00 0.00 C +ATOM 39 CA ASN A 39 249.486 255.923 236.292 1.00 0.00 C +ATOM 40 CA SER A 40 248.676 254.234 239.610 1.00 0.00 C +ATOM 41 CA PRO A 41 248.311 254.784 243.362 1.00 0.00 C +ATOM 42 CA VAL A 42 250.063 253.079 246.285 1.00 0.00 C +ATOM 43 CA THR A 43 251.280 254.013 249.772 1.00 0.00 C +ATOM 44 CA LYS A 44 251.894 252.413 253.175 1.00 0.00 C +ATOM 45 CA THR A 45 251.395 251.750 256.893 1.00 0.00 C +ATOM 46 CA ALA A 46 251.125 252.684 260.577 1.00 0.00 C +ATOM 47 CA ALA A 47 252.553 253.803 263.927 1.00 0.00 C +ATOM 48 CA GLU A 48 256.276 253.191 264.458 1.00 0.00 C +ATOM 49 CA ASP A 49 258.889 252.118 261.901 1.00 0.00 C +ATOM 50 CA GLN A 50 261.734 249.792 260.894 1.00 0.00 C +ATOM 51 CA ARG A 51 261.579 246.252 262.296 1.00 0.00 C +ATOM 52 CA THR A 52 258.875 244.386 260.367 1.00 0.00 C +ATOM 53 CA ALA A 53 256.667 241.892 262.216 1.00 0.00 C +ATOM 54 CA THR A 54 256.877 238.358 263.626 1.00 0.00 C +ATOM 55 CA ALA A 55 257.448 234.593 263.517 1.00 0.00 C +ATOM 56 CA ASN A 56 256.455 231.096 262.378 1.00 0.00 C +ATOM 57 CA ASP A 57 255.581 230.224 258.773 1.00 0.00 C +ATOM 58 CA GLY A 58 252.189 228.493 258.666 1.00 0.00 C +ATOM 59 CA GLY A 59 248.431 227.986 259.035 1.00 0.00 C +ATOM 60 CA ALA A 60 246.656 230.375 256.656 1.00 0.00 C +ATOM 61 CA ASP A 61 247.442 234.091 256.948 1.00 0.00 C +ATOM 62 CA GLU A 62 247.338 237.540 258.565 1.00 0.00 C +ATOM 63 CA ASP A 63 250.174 240.067 258.859 1.00 0.00 C +ATOM 64 CA GLY A 64 248.981 243.401 257.454 1.00 0.00 C +ATOM 65 CA ASP A 65 247.267 245.144 260.376 1.00 0.00 C +ATOM 66 CA ALA A 66 246.971 245.291 264.171 1.00 0.00 C +ATOM 67 CA THR A 67 248.131 247.483 267.063 1.00 0.00 C +ATOM 68 CA ALA A 68 249.069 250.428 269.292 1.00 0.00 C +ATOM 69 CA THR A 69 250.943 249.551 272.491 1.00 0.00 C +ATOM 70 CA THR A 70 253.994 247.299 272.119 1.00 0.00 C +ATOM 71 CA THR A 71 256.872 249.565 271.073 1.00 0.00 C +ATOM 72 CA ALA A 72 260.428 248.795 272.204 1.00 0.00 C +ATOM 73 CA ALA A 73 261.512 245.915 269.958 1.00 0.00 C +ATOM 74 CA PHE A 74 264.129 243.235 269.259 1.00 0.00 C +ATOM 75 CA PRO A 75 265.348 240.483 271.594 1.00 0.00 C +ATOM 76 CA SER A 76 265.762 237.455 273.870 1.00 0.00 C +ATOM 77 CA ASP A 77 266.459 233.909 272.662 1.00 0.00 C +ATOM 78 CA GLY A 78 263.032 232.516 271.753 1.00 0.00 C +ATOM 79 CA ASP A 79 262.421 232.921 268.015 1.00 0.00 C +ATOM 80 CA ASP A 80 263.523 232.326 264.416 1.00 0.00 C +ATOM 81 CA TRP A 81 264.948 229.592 262.178 1.00 0.00 C +ATOM 82 CA SER A 82 267.468 226.883 263.087 1.00 0.00 C +ATOM 83 CA ASP A 83 269.417 224.991 260.415 1.00 0.00 C +ATOM 84 CA GLY A 84 272.547 223.078 261.445 1.00 0.00 C +ATOM 85 CA ASP A 85 273.851 221.004 258.527 1.00 0.00 C +ATOM 86 CA ALA A 86 276.257 218.099 259.062 1.00 0.00 C +ATOM 87 CA ARG A 87 279.849 219.014 258.180 1.00 0.00 C +ATOM 88 CA LEU A 88 281.896 222.220 258.383 1.00 0.00 C +ATOM 89 CA GLU A 89 281.912 225.945 257.581 1.00 0.00 C +ATOM 90 CA ARG A 90 279.560 227.620 260.066 1.00 0.00 C +ATOM 91 CA ARG A 91 280.704 231.227 260.514 1.00 0.00 C +ATOM 92 CA ARG A 92 284.118 232.918 260.528 1.00 0.00 C +ATOM 93 CA GLN A 93 287.264 233.249 258.404 1.00 0.00 C +ATOM 94 CA ARG A 94 286.975 236.401 256.283 1.00 0.00 C +ATOM 95 CA ARG A 95 284.382 238.841 254.926 1.00 0.00 C +ATOM 96 CA CYS A 96 283.301 238.989 251.276 1.00 0.00 C +ATOM 97 CA GLU A 97 285.110 241.209 248.762 1.00 0.00 C +ATOM 98 CA ALA A 98 288.085 241.405 246.390 1.00 0.00 C +ATOM 99 CA THR A 99 286.881 242.703 243.016 1.00 0.00 C +ATOM 100 CA ARG A 100 283.494 242.105 241.379 1.00 0.00 C +ATOM 101 CA CYS A 101 281.831 241.750 237.969 1.00 0.00 C +TER 102 CYS A 101 +END diff --git a/Plants/Q8S794/Q8S794.dcd b/Plants/Q8S794/Q8S794.dcd new file mode 100644 index 0000000000000000000000000000000000000000..8e932bde99fcbeb38a7aedba7e885117e258a29b --- /dev/null +++ b/Plants/Q8S794/Q8S794.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:a3ac29d42a1f1407d78fd12e57ce57e3f72190a4814945429ce4f54f1bcbeeee +size 22880276 diff --git a/Plants/Q8S794/top.pdb b/Plants/Q8S794/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..e8176e1cdeeb8adb24d687c00c93c0e5ab10164a --- /dev/null +++ b/Plants/Q8S794/top.pdb @@ -0,0 +1,188 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 224.601 246.949 277.907 1.00 0.00 C +ATOM 2 CA PRO A 2 224.239 250.737 278.108 1.00 0.00 C +ATOM 3 CA PRO A 3 220.577 251.378 278.940 1.00 0.00 C +ATOM 4 CA PRO A 4 218.491 250.238 275.963 1.00 0.00 C +ATOM 5 CA PRO A 5 214.998 251.760 275.997 1.00 0.00 C +ATOM 6 CA ARG A 6 211.841 253.639 274.988 1.00 0.00 C +ATOM 7 CA HIS A 7 209.818 254.438 278.116 1.00 0.00 C +ATOM 8 CA ALA A 8 208.297 257.909 277.721 1.00 0.00 C +ATOM 9 CA ALA A 9 209.404 261.064 275.895 1.00 0.00 C +ATOM 10 CA ALA A 10 208.999 263.935 273.422 1.00 0.00 C +ATOM 11 CA ALA A 11 210.844 267.052 274.602 1.00 0.00 C +ATOM 12 CA THR A 12 214.393 266.684 273.265 1.00 0.00 C +ATOM 13 CA ALA A 13 215.264 268.778 270.204 1.00 0.00 C +ATOM 14 CA PRO A 14 215.449 272.239 268.621 1.00 0.00 C +ATOM 15 CA GLN A 15 218.766 274.029 269.180 1.00 0.00 C +ATOM 16 CA ARG A 16 221.404 271.912 267.428 1.00 0.00 C +ATOM 17 CA HIS A 17 225.108 272.802 267.369 1.00 0.00 C +ATOM 18 CA ALA A 18 226.096 273.164 271.031 1.00 0.00 C +ATOM 19 CA VAL A 19 229.091 270.863 271.528 1.00 0.00 C +ATOM 20 CA ALA A 20 230.176 267.653 269.785 1.00 0.00 C +ATOM 21 CA ALA A 21 229.723 263.886 269.441 1.00 0.00 C +ATOM 22 CA VAL A 22 226.968 263.419 266.851 1.00 0.00 C +ATOM 23 CA ALA A 23 225.349 260.029 266.217 1.00 0.00 C +ATOM 24 CA THR A 24 223.875 257.930 263.399 1.00 0.00 C +ATOM 25 CA PRO A 25 225.458 255.989 260.528 1.00 0.00 C +ATOM 26 CA PRO A 26 225.655 257.921 257.251 1.00 0.00 C +ATOM 27 CA PRO A 27 227.556 257.857 253.949 1.00 0.00 C +ATOM 28 CA PRO A 28 230.757 255.909 254.640 1.00 0.00 C +ATOM 29 CA PRO A 29 233.899 254.620 252.913 1.00 0.00 C +ATOM 30 CA PRO A 30 235.944 251.439 253.378 1.00 0.00 C +ATOM 31 CA ARG A 31 236.813 249.979 249.968 1.00 0.00 C +ATOM 32 CA ARG A 32 234.807 246.848 249.136 1.00 0.00 C +ATOM 33 CA ARG A 33 233.033 243.818 250.614 1.00 0.00 C +ATOM 34 CA ALA A 34 231.807 240.363 251.652 1.00 0.00 C +ATOM 35 CA ASN A 35 230.059 240.782 255.012 1.00 0.00 C +ATOM 36 CA ARG A 36 226.760 239.353 256.272 1.00 0.00 C +ATOM 37 CA ARG A 37 224.070 240.447 258.739 1.00 0.00 C +ATOM 38 CA PRO A 38 224.006 241.024 262.505 1.00 0.00 C +ATOM 39 CA ASP A 39 222.724 238.110 264.598 1.00 0.00 C +ATOM 40 CA ALA A 40 219.022 238.419 265.442 1.00 0.00 C +ATOM 41 CA ALA A 41 216.190 240.352 267.103 1.00 0.00 C +ATOM 42 CA THR A 42 215.994 242.168 270.447 1.00 0.00 C +ATOM 43 CA PRO A 43 217.279 241.472 273.966 1.00 0.00 C +ATOM 44 CA PRO A 44 219.981 240.868 276.583 1.00 0.00 C +ATOM 45 CA LEU A 45 221.244 239.413 279.870 1.00 0.00 C +ATOM 46 CA THR A 46 222.213 235.735 280.082 1.00 0.00 C +ATOM 47 CA ASN A 47 224.626 233.749 277.902 1.00 0.00 C +ATOM 48 CA GLU A 48 227.041 234.215 274.992 1.00 0.00 C +ATOM 49 CA ASN A 49 229.120 237.029 273.484 1.00 0.00 C +ATOM 50 CA GLU A 50 232.287 236.586 271.413 1.00 0.00 C +ATOM 51 CA ASN A 51 235.442 234.481 271.771 1.00 0.00 C +ATOM 52 CA ASP A 52 238.331 232.150 272.630 1.00 0.00 C +ATOM 53 CA ARG A 53 241.860 233.412 273.314 1.00 0.00 C +ATOM 54 CA THR A 54 242.332 235.376 276.544 1.00 0.00 C +ATOM 55 CA ASN A 55 241.466 238.321 278.801 1.00 0.00 C +ATOM 56 CA GLU A 56 243.092 241.455 280.233 1.00 0.00 C +ATOM 57 CA SER A 57 243.518 245.226 279.890 1.00 0.00 C +ATOM 58 CA GLU A 58 243.936 248.983 279.416 1.00 0.00 C +ATOM 59 CA ASN A 59 242.658 252.343 278.153 1.00 0.00 C +ATOM 60 CA GLU A 60 238.996 251.977 277.168 1.00 0.00 C +ATOM 61 CA HIS A 61 237.861 250.018 274.104 1.00 0.00 C +ATOM 62 CA VAL A 62 240.659 249.805 271.527 1.00 0.00 C +ATOM 63 CA ASN A 63 243.559 252.239 271.956 1.00 0.00 C +ATOM 64 CA VAL A 64 247.318 252.767 271.635 1.00 0.00 C +ATOM 65 CA ARG A 65 248.341 256.325 270.734 1.00 0.00 C +ATOM 66 CA CYS A 66 245.378 258.270 269.337 1.00 0.00 C +ATOM 67 CA ARG A 67 246.037 261.229 267.028 1.00 0.00 C +ATOM 68 CA GLU A 68 244.410 264.625 267.608 1.00 0.00 C +ATOM 69 CA ASN A 69 243.538 267.870 269.403 1.00 0.00 C +ATOM 70 CA VAL A 70 244.348 268.463 273.079 1.00 0.00 C +ATOM 71 CA ASN A 71 243.885 267.689 276.780 1.00 0.00 C +ATOM 72 CA GLU A 72 244.692 267.439 280.496 1.00 0.00 C +ATOM 73 CA ASN A 73 242.039 265.594 282.514 1.00 0.00 C +ATOM 74 CA GLU A 74 241.291 263.140 285.331 1.00 0.00 C +ATOM 75 CA ASN A 75 242.811 263.521 288.803 1.00 0.00 C +ATOM 76 CA ASP A 76 246.429 263.071 289.909 1.00 0.00 C +ATOM 77 CA ARG A 77 248.171 261.712 293.013 1.00 0.00 C +ATOM 78 CA THR A 78 250.504 264.345 294.476 1.00 0.00 C +ATOM 79 CA ASN A 79 250.780 267.363 292.166 1.00 0.00 C +ATOM 80 CA GLU A 80 250.696 269.054 288.753 1.00 0.00 C +ATOM 81 CA SER A 81 251.863 269.841 285.213 1.00 0.00 C +ATOM 82 CA GLU A 82 252.925 271.179 281.807 1.00 0.00 C +ATOM 83 CA ASN A 83 252.557 269.505 278.405 1.00 0.00 C +ATOM 84 CA GLU A 84 250.731 266.161 278.452 1.00 0.00 C +ATOM 85 CA ASN A 85 249.080 262.810 279.198 1.00 0.00 C +ATOM 86 CA ASP A 86 250.841 259.545 278.330 1.00 0.00 C +ATOM 87 CA ARG A 87 254.083 257.728 277.489 1.00 0.00 C +ATOM 88 CA THR A 88 256.899 259.504 275.636 1.00 0.00 C +ATOM 89 CA LYS A 89 256.525 260.589 272.003 1.00 0.00 C +ATOM 90 CA THR A 90 259.593 259.413 270.074 1.00 0.00 C +ATOM 91 CA SER A 91 262.606 257.116 270.476 1.00 0.00 C +ATOM 92 CA GLU A 92 266.198 256.653 269.292 1.00 0.00 C +ATOM 93 CA ASN A 93 267.113 252.965 269.022 1.00 0.00 C +ATOM 94 CA GLU A 94 265.145 251.099 266.346 1.00 0.00 C +ATOM 95 CA GLY A 95 264.860 251.835 262.618 1.00 0.00 C +ATOM 96 CA THR A 96 262.643 254.500 261.037 1.00 0.00 C +ATOM 97 CA ASN A 97 259.994 255.317 258.424 1.00 0.00 C +ATOM 98 CA MET A 98 256.702 257.232 258.538 1.00 0.00 C +ATOM 99 CA ALA A 99 254.797 260.528 258.687 1.00 0.00 C +ATOM 100 CA ASP A 100 254.257 262.954 255.799 1.00 0.00 C +ATOM 101 CA ARG A 101 252.699 261.330 252.725 1.00 0.00 C +ATOM 102 CA ASP A 102 255.006 259.956 250.023 1.00 0.00 C +ATOM 103 CA GLU A 103 256.630 256.721 248.832 1.00 0.00 C +ATOM 104 CA GLU A 104 260.119 257.540 247.542 1.00 0.00 C +ATOM 105 CA GLN A 105 262.664 254.708 247.692 1.00 0.00 C +ATOM 106 CA ILE A 106 265.718 253.036 246.145 1.00 0.00 C +ATOM 107 CA LEU A 107 267.956 251.734 243.351 1.00 0.00 C +ATOM 108 CA TYR A 108 271.525 250.491 242.864 1.00 0.00 C +ATOM 109 CA ASP A 109 273.260 247.949 245.109 1.00 0.00 C +ATOM 110 CA THR A 110 273.731 244.487 243.588 1.00 0.00 C +ATOM 111 CA ILE A 111 276.022 243.319 240.777 1.00 0.00 C +ATOM 112 CA ALA A 112 279.102 242.468 238.701 1.00 0.00 C +ATOM 113 CA GLU A 113 282.593 241.059 238.118 1.00 0.00 C +ATOM 114 CA GLY A 114 285.116 243.734 237.122 1.00 0.00 C +ATOM 115 CA SER A 115 287.447 244.549 240.023 1.00 0.00 C +ATOM 116 CA SER A 116 285.853 245.913 243.204 1.00 0.00 C +ATOM 117 CA GLN A 117 286.714 249.297 244.729 1.00 0.00 C +ATOM 118 CA TYR A 118 285.492 252.224 242.619 1.00 0.00 C +ATOM 119 CA TRP A 119 286.047 252.504 238.860 1.00 0.00 C +ATOM 120 CA ASN A 120 286.008 251.712 235.133 1.00 0.00 C +ATOM 121 CA GLU A 121 284.905 248.544 233.327 1.00 0.00 C +ATOM 122 CA GLU A 122 285.355 247.902 229.599 1.00 0.00 C +ATOM 123 CA GLU A 123 282.890 245.475 228.001 1.00 0.00 C +ATOM 124 CA GLY A 124 280.998 243.434 230.604 1.00 0.00 C +ATOM 125 CA ASN A 125 278.897 240.649 229.073 1.00 0.00 C +ATOM 126 CA GLU A 126 279.456 239.894 225.381 1.00 0.00 C +ATOM 127 CA ASP A 127 282.423 238.686 223.317 1.00 0.00 C +ATOM 128 CA PRO A 128 282.053 237.281 219.795 1.00 0.00 C +ATOM 129 CA ASN A 129 282.822 234.163 217.746 1.00 0.00 C +ATOM 130 CA GLN A 130 284.153 234.273 214.177 1.00 0.00 C +ATOM 131 CA TYR A 131 281.941 236.554 212.075 1.00 0.00 C +ATOM 132 CA LEU A 132 280.513 239.513 214.005 1.00 0.00 C +ATOM 133 CA ASN A 133 279.456 242.706 215.794 1.00 0.00 C +ATOM 134 CA GLU A 134 276.330 244.835 215.331 1.00 0.00 C +ATOM 135 CA GLU A 135 274.144 247.417 217.083 1.00 0.00 C +ATOM 136 CA GLY A 136 274.373 251.168 216.455 1.00 0.00 C +ATOM 137 CA ASN A 137 273.306 253.139 219.535 1.00 0.00 C +ATOM 138 CA VAL A 138 274.405 256.782 219.725 1.00 0.00 C +ATOM 139 CA GLU A 139 274.049 260.547 219.262 1.00 0.00 C +ATOM 140 CA ARG A 140 271.007 261.621 221.289 1.00 0.00 C +ATOM 141 CA ASP A 141 268.131 263.219 223.211 1.00 0.00 C +ATOM 142 CA ALA A 142 264.987 265.139 222.237 1.00 0.00 C +ATOM 143 CA GLU A 143 263.419 263.749 219.055 1.00 0.00 C +ATOM 144 CA GLY A 144 266.226 261.808 217.360 1.00 0.00 C +ATOM 145 CA ASN A 145 265.495 262.153 213.637 1.00 0.00 C +ATOM 146 CA GLN A 146 262.030 260.898 212.669 1.00 0.00 C +ATOM 147 CA GLN A 147 260.652 258.491 215.281 1.00 0.00 C +ATOM 148 CA GLY A 148 257.306 259.918 216.416 1.00 0.00 C +ATOM 149 CA HIS A 149 255.485 263.228 216.912 1.00 0.00 C +ATOM 150 CA VAL A 150 256.252 265.167 220.100 1.00 0.00 C +ATOM 151 CA GLU A 151 253.169 265.494 222.314 1.00 0.00 C +ATOM 152 CA ARG A 152 251.225 262.783 224.155 1.00 0.00 C +ATOM 153 CA ASP A 153 249.890 261.518 227.491 1.00 0.00 C +ATOM 154 CA VAL A 154 246.256 262.499 228.082 1.00 0.00 C +ATOM 155 CA GLU A 155 244.170 259.479 229.106 1.00 0.00 C +ATOM 156 CA GLY A 156 244.977 255.968 227.864 1.00 0.00 C +ATOM 157 CA ASN A 157 247.023 253.062 229.236 1.00 0.00 C +ATOM 158 CA GLN A 158 244.419 250.558 230.447 1.00 0.00 C +ATOM 159 CA GLU A 159 242.283 248.716 227.885 1.00 0.00 C +ATOM 160 CA GLU A 160 243.732 246.214 225.404 1.00 0.00 C +ATOM 161 CA GLU A 161 242.045 246.707 222.023 1.00 0.00 C +ATOM 162 CA ALA A 162 243.747 246.161 218.658 1.00 0.00 C +ATOM 163 CA SER A 163 244.196 245.236 214.990 1.00 0.00 C +ATOM 164 CA GLY A 164 242.580 241.897 214.119 1.00 0.00 C +ATOM 165 CA SER A 165 244.322 238.763 212.831 1.00 0.00 C +ATOM 166 CA GLN A 166 246.014 235.400 212.246 1.00 0.00 C +ATOM 167 CA PRO A 167 249.682 235.053 211.274 1.00 0.00 C +ATOM 168 CA SER A 168 252.322 235.075 208.527 1.00 0.00 C +ATOM 169 CA VAL A 169 254.164 232.753 206.133 1.00 0.00 C +ATOM 170 CA GLY A 170 257.361 230.694 206.364 1.00 0.00 C +ATOM 171 CA GLN A 171 259.989 230.499 209.116 1.00 0.00 C +ATOM 172 CA LYS A 172 263.366 230.197 207.379 1.00 0.00 C +ATOM 173 CA ARG A 173 266.541 228.504 208.631 1.00 0.00 C +ATOM 174 CA ALA A 174 266.649 224.804 209.534 1.00 0.00 C +ATOM 175 CA ARG A 175 266.963 221.029 209.124 1.00 0.00 C +ATOM 176 CA GLY A 176 269.653 218.331 209.064 1.00 0.00 C +ATOM 177 CA GLN A 177 272.211 216.492 211.206 1.00 0.00 C +ATOM 178 CA ARG A 178 273.156 213.126 212.721 1.00 0.00 C +ATOM 179 CA GLY A 179 273.002 209.754 214.488 1.00 0.00 C +ATOM 180 CA ALA A 180 273.570 210.287 218.217 1.00 0.00 C +ATOM 181 CA ALA A 181 270.456 210.992 220.297 1.00 0.00 C +ATOM 182 CA LYS A 182 270.733 208.993 223.528 1.00 0.00 C +ATOM 183 CA LYS A 183 267.406 209.034 225.383 1.00 0.00 C +ATOM 184 CA LEU A 184 263.655 209.149 224.723 1.00 0.00 C +TER 185 LEU A 184 +END diff --git a/Plants/Q8S7R4/Q8S7R4.dcd b/Plants/Q8S7R4/Q8S7R4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..3cf16857d8585d535d5b816d5b396e027df1b949 --- /dev/null +++ b/Plants/Q8S7R4/Q8S7R4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:6430f2957fd3a23f69835c4bb96391a6f1d60965ded586800385dcd03cce03b9 +size 17600276 diff --git a/Plants/Q8S7R4/top.pdb b/Plants/Q8S7R4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..35cf0a67f3c9aee40c61e0c993450a6c99f111be --- /dev/null +++ b/Plants/Q8S7R4/top.pdb @@ -0,0 +1,144 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 296.553 248.594 264.683 1.00 0.00 C +ATOM 2 CA ALA A 2 300.310 249.219 264.779 1.00 0.00 C +ATOM 3 CA ALA A 3 302.003 248.305 261.491 1.00 0.00 C +ATOM 4 CA THR A 4 301.967 245.979 258.473 1.00 0.00 C +ATOM 5 CA ALA A 5 300.296 243.937 255.725 1.00 0.00 C +ATOM 6 CA ASP A 6 299.643 244.921 252.102 1.00 0.00 C +ATOM 7 CA GLY A 7 300.508 247.356 249.303 1.00 0.00 C +ATOM 8 CA GLU A 8 298.557 248.869 246.401 1.00 0.00 C +ATOM 9 CA GLY A 9 297.351 247.608 243.014 1.00 0.00 C +ATOM 10 CA GLU A 10 293.899 249.108 242.424 1.00 0.00 C +ATOM 11 CA VAL A 11 291.568 250.520 239.761 1.00 0.00 C +ATOM 12 CA ALA A 12 288.401 248.455 239.293 1.00 0.00 C +ATOM 13 CA PRO A 13 286.129 246.620 236.846 1.00 0.00 C +ATOM 14 CA THR A 14 283.007 246.799 234.670 1.00 0.00 C +ATOM 15 CA TRP A 15 280.759 243.730 234.459 1.00 0.00 C +ATOM 16 CA ARG A 16 278.374 244.324 231.548 1.00 0.00 C +ATOM 17 CA HIS A 17 275.747 241.882 230.263 1.00 0.00 C +ATOM 18 CA GLU A 18 272.627 242.508 228.167 1.00 0.00 C +ATOM 19 CA GLY A 19 269.749 240.576 226.586 1.00 0.00 C +ATOM 20 CA THR A 20 266.870 238.187 227.308 1.00 0.00 C +ATOM 21 CA PHE A 21 267.885 235.846 230.138 1.00 0.00 C +ATOM 22 CA VAL A 22 267.644 236.354 233.906 1.00 0.00 C +ATOM 23 CA GLY A 23 265.389 238.556 236.045 1.00 0.00 C +ATOM 24 CA GLN A 24 261.798 238.578 234.771 1.00 0.00 C +ATOM 25 CA HIS A 25 258.897 237.508 232.546 1.00 0.00 C +ATOM 26 CA VAL A 26 255.735 239.010 231.041 1.00 0.00 C +ATOM 27 CA ASP A 27 252.682 241.127 230.197 1.00 0.00 C +ATOM 28 CA ASP A 28 249.565 239.402 228.846 1.00 0.00 C +ATOM 29 CA PRO A 29 245.808 239.951 228.538 1.00 0.00 C +ATOM 30 CA ASP A 30 242.772 237.767 227.810 1.00 0.00 C +ATOM 31 CA ARG A 31 239.886 239.862 226.467 1.00 0.00 C +ATOM 32 CA PRO A 32 238.574 240.588 222.965 1.00 0.00 C +ATOM 33 CA GLU A 33 240.370 238.535 220.305 1.00 0.00 C +ATOM 34 CA GLN A 34 243.472 237.289 218.476 1.00 0.00 C +ATOM 35 CA PRO A 35 246.064 234.546 218.997 1.00 0.00 C +ATOM 36 CA ILE A 36 246.974 232.142 221.810 1.00 0.00 C +ATOM 37 CA GLY A 37 250.234 231.247 223.568 1.00 0.00 C +ATOM 38 CA ARG A 38 249.898 229.990 227.148 1.00 0.00 C +ATOM 39 CA PRO A 39 246.354 230.251 228.522 1.00 0.00 C +ATOM 40 CA ARG A 40 243.724 228.230 226.647 1.00 0.00 C +ATOM 41 CA ALA A 41 244.379 226.816 223.171 1.00 0.00 C +ATOM 42 CA SER A 42 241.697 224.165 222.626 1.00 0.00 C +ATOM 43 CA ALA A 43 240.331 222.717 219.378 1.00 0.00 C +ATOM 44 CA ALA A 44 236.829 222.465 217.898 1.00 0.00 C +ATOM 45 CA ARG A 45 237.249 222.591 214.113 1.00 0.00 C +ATOM 46 CA GLN A 46 239.544 219.929 212.642 1.00 0.00 C +ATOM 47 CA GLY A 47 243.071 220.814 213.779 1.00 0.00 C +ATOM 48 CA ALA A 48 245.504 223.571 214.778 1.00 0.00 C +ATOM 49 CA ARG A 49 248.964 224.283 216.205 1.00 0.00 C +ATOM 50 CA TRP A 50 249.426 228.030 216.724 1.00 0.00 C +ATOM 51 CA PRO A 51 251.210 230.625 214.580 1.00 0.00 C +ATOM 52 CA GLY A 52 251.692 231.659 210.944 1.00 0.00 C +ATOM 53 CA ALA A 53 251.424 234.314 208.225 1.00 0.00 C +ATOM 54 CA SER A 54 249.892 237.796 208.016 1.00 0.00 C +ATOM 55 CA ARG A 55 248.307 239.325 211.125 1.00 0.00 C +ATOM 56 CA ALA A 56 247.859 239.698 214.890 1.00 0.00 C +ATOM 57 CA ALA A 57 250.888 240.788 216.927 1.00 0.00 C +ATOM 58 CA ALA A 58 254.056 239.226 218.357 1.00 0.00 C +ATOM 59 CA ALA A 59 255.624 237.976 221.597 1.00 0.00 C +ATOM 60 CA GLY A 60 255.207 240.748 224.177 1.00 0.00 C +ATOM 61 CA GLN A 61 255.292 244.254 225.666 1.00 0.00 C +ATOM 62 CA LYS A 62 253.984 247.823 225.928 1.00 0.00 C +ATOM 63 CA ALA A 63 250.632 247.749 224.119 1.00 0.00 C +ATOM 64 CA ALA A 64 247.909 245.533 225.601 1.00 0.00 C +ATOM 65 CA ALA A 65 247.145 246.097 229.290 1.00 0.00 C +ATOM 66 CA LEU A 66 244.923 248.128 231.626 1.00 0.00 C +ATOM 67 CA SER A 67 241.863 250.191 232.574 1.00 0.00 C +ATOM 68 CA HIS A 68 241.720 253.114 235.013 1.00 0.00 C +ATOM 69 CA MET A 69 243.860 253.330 238.158 1.00 0.00 C +ATOM 70 CA VAL A 70 245.790 250.537 239.887 1.00 0.00 C +ATOM 71 CA ALA A 71 243.888 248.886 242.745 1.00 0.00 C +ATOM 72 CA GLY A 72 242.203 246.717 245.386 1.00 0.00 C +ATOM 73 CA GLY A 73 242.026 246.521 249.187 1.00 0.00 C +ATOM 74 CA GLY A 74 240.046 244.782 251.938 1.00 0.00 C +ATOM 75 CA ARG A 75 242.135 242.637 254.294 1.00 0.00 C +ATOM 76 CA ARG A 76 241.890 240.673 257.550 1.00 0.00 C +ATOM 77 CA ARG A 77 243.620 241.436 260.858 1.00 0.00 C +ATOM 78 CA HIS A 78 246.987 243.169 260.442 1.00 0.00 C +ATOM 79 CA THR A 79 250.736 243.805 260.683 1.00 0.00 C +ATOM 80 CA ARG A 80 253.693 244.250 263.044 1.00 0.00 C +ATOM 81 CA GLU A 81 255.894 242.911 265.851 1.00 0.00 C +ATOM 82 CA ALA A 82 256.495 244.979 268.994 1.00 0.00 C +ATOM 83 CA ALA A 83 253.088 245.847 270.464 1.00 0.00 C +ATOM 84 CA TRP A 84 250.094 245.349 272.766 1.00 0.00 C +ATOM 85 CA LYS A 85 246.943 247.091 274.013 1.00 0.00 C +ATOM 86 CA GLY A 86 243.453 246.153 272.805 1.00 0.00 C +ATOM 87 CA GLU A 87 239.894 245.351 271.707 1.00 0.00 C +ATOM 88 CA GLY A 88 236.980 247.048 269.934 1.00 0.00 C +ATOM 89 CA ALA A 89 235.922 249.154 266.940 1.00 0.00 C +ATOM 90 CA HIS A 90 236.268 252.912 267.457 1.00 0.00 C +ATOM 91 CA GLN A 91 238.161 255.109 264.986 1.00 0.00 C +ATOM 92 CA GLU A 92 241.147 256.225 262.898 1.00 0.00 C +ATOM 93 CA ASP A 93 240.362 258.077 259.663 1.00 0.00 C +ATOM 94 CA GLY A 94 238.436 261.228 260.600 1.00 0.00 C +ATOM 95 CA ASP A 95 240.776 263.111 262.944 1.00 0.00 C +ATOM 96 CA GLY A 96 243.464 265.509 261.703 1.00 0.00 C +ATOM 97 CA GLU A 97 246.800 265.196 259.888 1.00 0.00 C +ATOM 98 CA ALA A 98 249.833 265.357 262.188 1.00 0.00 C +ATOM 99 CA LYS A 99 252.934 265.590 259.987 1.00 0.00 C +ATOM 100 CA THR A 100 255.333 262.799 259.001 1.00 0.00 C +ATOM 101 CA GLY A 101 254.901 259.115 258.131 1.00 0.00 C +ATOM 102 CA ARG A 102 255.412 255.341 258.229 1.00 0.00 C +ATOM 103 CA ARG A 103 253.597 253.959 261.281 1.00 0.00 C +ATOM 104 CA LEU A 104 253.135 256.687 263.900 1.00 0.00 C +ATOM 105 CA THR A 105 250.616 258.576 266.045 1.00 0.00 C +ATOM 106 CA THR A 106 250.313 261.876 267.925 1.00 0.00 C +ATOM 107 CA ARG A 107 252.485 264.977 268.347 1.00 0.00 C +ATOM 108 CA ILE A 108 255.724 264.348 270.253 1.00 0.00 C +ATOM 109 CA GLY A 109 256.544 261.769 272.935 1.00 0.00 C +ATOM 110 CA GLY A 110 257.440 258.074 272.699 1.00 0.00 C +ATOM 111 CA GLY A 111 254.689 255.936 274.241 1.00 0.00 C +ATOM 112 CA VAL A 112 251.202 257.055 273.192 1.00 0.00 C +ATOM 113 CA SER A 113 248.059 258.583 274.709 1.00 0.00 C +ATOM 114 CA ARG A 114 244.620 257.455 273.519 1.00 0.00 C +ATOM 115 CA VAL A 115 241.010 258.532 272.948 1.00 0.00 C +ATOM 116 CA GLY A 116 238.891 260.319 270.334 1.00 0.00 C +ATOM 117 CA VAL A 117 236.726 262.800 272.250 1.00 0.00 C +ATOM 118 CA GLY A 118 237.001 266.240 273.865 1.00 0.00 C +ATOM 119 CA ASP A 119 236.601 269.840 275.046 1.00 0.00 C +ATOM 120 CA GLY A 120 235.932 273.353 273.730 1.00 0.00 C +ATOM 121 CA ALA A 121 232.521 274.493 272.471 1.00 0.00 C +ATOM 122 CA SER A 122 229.152 276.013 273.393 1.00 0.00 C +ATOM 123 CA ALA A 123 225.824 277.852 273.644 1.00 0.00 C +ATOM 124 CA THR A 124 225.414 281.438 274.862 1.00 0.00 C +ATOM 125 CA PRO A 125 227.328 284.007 276.925 1.00 0.00 C +ATOM 126 CA ASP A 126 229.959 285.483 279.252 1.00 0.00 C +ATOM 127 CA ARG A 127 230.727 283.695 282.527 1.00 0.00 C +ATOM 128 CA GLY A 128 228.979 280.494 283.629 1.00 0.00 C +ATOM 129 CA ARG A 129 227.973 277.656 285.964 1.00 0.00 C +ATOM 130 CA GLY A 130 226.349 275.091 288.266 1.00 0.00 C +ATOM 131 CA ALA A 131 226.015 275.996 291.952 1.00 0.00 C +ATOM 132 CA ALA A 132 226.128 274.189 295.304 1.00 0.00 C +ATOM 133 CA GLU A 133 223.641 271.523 296.412 1.00 0.00 C +ATOM 134 CA GLY A 134 219.956 270.772 297.025 1.00 0.00 C +ATOM 135 CA GLN A 135 217.218 270.401 294.402 1.00 0.00 C +ATOM 136 CA ARG A 136 219.078 270.075 291.093 1.00 0.00 C +ATOM 137 CA ASP A 137 217.990 270.455 287.461 1.00 0.00 C +ATOM 138 CA LEU A 138 214.232 270.990 287.133 1.00 0.00 C +ATOM 139 CA GLY A 139 213.168 273.472 284.445 1.00 0.00 C +ATOM 140 CA SER A 140 209.639 274.631 285.292 1.00 0.00 C +TER 141 SER A 140 +END diff --git a/Plants/Q8S832/Q8S832.dcd b/Plants/Q8S832/Q8S832.dcd new file mode 100644 index 0000000000000000000000000000000000000000..d34e175804fc12262e32a0b859b62a0f443bbfa7 --- /dev/null +++ b/Plants/Q8S832/Q8S832.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:28bebb56866770fdc0c8380444f6eb6677db5c64ed8ea244ed16b20c918e42cc +size 16160276 diff --git a/Plants/Q8S832/top.pdb b/Plants/Q8S832/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..467fae2bd34dccfbcd00c419f484d21ae3cc8c8d --- /dev/null +++ b/Plants/Q8S832/top.pdb @@ -0,0 +1,132 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 259.942 289.140 271.012 1.00 0.00 C +ATOM 2 CA ALA A 2 258.433 292.203 272.703 1.00 0.00 C +ATOM 3 CA ASN A 3 255.536 292.861 275.088 1.00 0.00 C +ATOM 4 CA GLY A 4 253.327 292.123 278.103 1.00 0.00 C +ATOM 5 CA ALA A 5 250.047 290.191 277.934 1.00 0.00 C +ATOM 6 CA THR A 6 248.672 290.233 281.487 1.00 0.00 C +ATOM 7 CA SER A 7 250.818 291.862 284.181 1.00 0.00 C +ATOM 8 CA GLY A 8 250.970 294.079 287.275 1.00 0.00 C +ATOM 9 CA GLY A 9 248.871 293.495 290.401 1.00 0.00 C +ATOM 10 CA CYS A 10 248.549 296.936 292.005 1.00 0.00 C +ATOM 11 CA GLY A 11 250.973 298.120 294.695 1.00 0.00 C +ATOM 12 CA ARG A 12 254.226 296.171 294.333 1.00 0.00 C +ATOM 13 CA ARG A 13 255.795 293.061 292.789 1.00 0.00 C +ATOM 14 CA GLU A 14 257.164 293.149 289.234 1.00 0.00 C +ATOM 15 CA ALA A 15 259.407 291.249 286.810 1.00 0.00 C +ATOM 16 CA ASP A 16 261.660 288.201 286.427 1.00 0.00 C +ATOM 17 CA GLY A 17 264.296 285.707 287.590 1.00 0.00 C +ATOM 18 CA LEU A 18 267.317 284.448 285.640 1.00 0.00 C +ATOM 19 CA ARG A 19 269.512 282.272 283.411 1.00 0.00 C +ATOM 20 CA GLU A 20 271.003 284.402 280.627 1.00 0.00 C +ATOM 21 CA ASP A 21 269.780 287.888 279.697 1.00 0.00 C +ATOM 22 CA LEU A 22 267.201 290.128 278.009 1.00 0.00 C +ATOM 23 CA ARG A 23 264.583 289.251 275.384 1.00 0.00 C +ATOM 24 CA ASN A 24 265.918 289.484 271.823 1.00 0.00 C +ATOM 25 CA LYS A 25 268.098 286.787 270.246 1.00 0.00 C +ATOM 26 CA MET A 26 267.436 285.159 266.866 1.00 0.00 C +ATOM 27 CA GLY A 27 267.481 282.629 264.017 1.00 0.00 C +ATOM 28 CA GLU A 28 267.772 278.837 264.244 1.00 0.00 C +ATOM 29 CA VAL A 29 266.328 275.926 262.255 1.00 0.00 C +ATOM 30 CA ARG A 30 263.321 275.028 260.095 1.00 0.00 C +ATOM 31 CA GLU A 31 259.680 274.240 260.892 1.00 0.00 C +ATOM 32 CA GLU A 32 257.217 271.558 259.771 1.00 0.00 C +ATOM 33 CA GLU A 33 258.207 268.777 257.362 1.00 0.00 C +ATOM 34 CA ARG A 34 258.595 265.027 256.815 1.00 0.00 C +ATOM 35 CA ASP A 35 261.566 262.780 256.014 1.00 0.00 C +ATOM 36 CA HIS A 36 265.111 263.476 257.225 1.00 0.00 C +ATOM 37 CA ARG A 37 267.471 266.460 257.032 1.00 0.00 C +ATOM 38 CA GLY A 38 265.998 269.280 259.128 1.00 0.00 C +ATOM 39 CA ARG A 39 265.427 268.791 262.863 1.00 0.00 C +ATOM 40 CA GLU A 40 265.072 267.647 266.480 1.00 0.00 C +ATOM 41 CA ARG A 41 261.792 266.782 268.215 1.00 0.00 C +ATOM 42 CA ARG A 42 260.894 268.360 271.565 1.00 0.00 C +ATOM 43 CA PRO A 43 259.415 266.415 274.488 1.00 0.00 C +ATOM 44 CA LYS A 44 255.719 265.487 274.489 1.00 0.00 C +ATOM 45 CA GLU A 45 252.322 267.003 275.312 1.00 0.00 C +ATOM 46 CA ALA A 46 250.189 266.417 272.210 1.00 0.00 C +ATOM 47 CA THR A 47 251.398 264.049 269.481 1.00 0.00 C +ATOM 48 CA MET A 48 251.060 260.262 269.727 1.00 0.00 C +ATOM 49 CA ALA A 49 251.465 256.587 268.809 1.00 0.00 C +ATOM 50 CA GLU A 50 253.349 255.722 265.612 1.00 0.00 C +ATOM 51 CA LEU A 51 256.258 258.181 265.525 1.00 0.00 C +ATOM 52 CA THR A 52 256.091 260.237 262.321 1.00 0.00 C +ATOM 53 CA GLY A 53 253.546 258.831 259.859 1.00 0.00 C +ATOM 54 CA ALA A 54 250.234 257.044 260.452 1.00 0.00 C +ATOM 55 CA ARG A 55 247.093 255.185 259.359 1.00 0.00 C +ATOM 56 CA GLY A 56 243.692 253.852 258.275 1.00 0.00 C +ATOM 57 CA GLY A 57 240.304 253.727 256.537 1.00 0.00 C +ATOM 58 CA ARG A 58 240.225 251.290 253.609 1.00 0.00 C +ATOM 59 CA GLY A 59 241.218 248.117 251.749 1.00 0.00 C +ATOM 60 CA SER A 60 240.040 244.498 251.926 1.00 0.00 C +ATOM 61 CA GLY A 61 238.070 241.322 251.184 1.00 0.00 C +ATOM 62 CA ASP A 62 240.515 238.449 250.652 1.00 0.00 C +ATOM 63 CA GLY A 63 239.748 234.748 250.170 1.00 0.00 C +ATOM 64 CA ARG A 64 238.163 231.307 250.574 1.00 0.00 C +ATOM 65 CA ARG A 65 238.692 227.952 248.849 1.00 0.00 C +ATOM 66 CA ARG A 66 238.119 228.699 245.157 1.00 0.00 C +ATOM 67 CA SER A 67 238.598 232.372 244.263 1.00 0.00 C +ATOM 68 CA GLY A 68 242.102 233.866 244.297 1.00 0.00 C +ATOM 69 CA GLY A 69 245.006 233.542 246.742 1.00 0.00 C +ATOM 70 CA GLY A 70 248.744 233.089 247.324 1.00 0.00 C +ATOM 71 CA ARG A 71 250.619 232.336 244.094 1.00 0.00 C +ATOM 72 CA GLY A 72 249.701 230.630 240.813 1.00 0.00 C +ATOM 73 CA ALA A 73 250.570 227.567 238.720 1.00 0.00 C +ATOM 74 CA SER A 74 251.292 227.889 234.993 1.00 0.00 C +ATOM 75 CA ARG A 75 250.967 226.363 231.517 1.00 0.00 C +ATOM 76 CA ASP A 76 249.973 222.711 231.960 1.00 0.00 C +ATOM 77 CA GLY A 77 252.167 220.028 233.542 1.00 0.00 C +ATOM 78 CA GLU A 78 253.243 216.503 232.578 1.00 0.00 C +ATOM 79 CA CYS A 79 253.406 212.703 232.355 1.00 0.00 C +ATOM 80 CA GLY A 80 254.883 211.522 229.047 1.00 0.00 C +ATOM 81 CA GLY A 81 256.674 211.218 225.698 1.00 0.00 C +ATOM 82 CA VAL A 82 256.771 214.527 223.811 1.00 0.00 C +ATOM 83 CA GLY A 83 257.904 218.035 222.850 1.00 0.00 C +ATOM 84 CA SER A 84 259.180 221.625 222.834 1.00 0.00 C +ATOM 85 CA GLU A 85 259.647 225.399 223.077 1.00 0.00 C +ATOM 86 CA VAL A 86 259.243 228.785 224.777 1.00 0.00 C +ATOM 87 CA GLN A 87 260.131 228.171 228.431 1.00 0.00 C +ATOM 88 CA ARG A 88 263.827 228.894 229.010 1.00 0.00 C +ATOM 89 CA GLY A 89 266.686 226.400 228.663 1.00 0.00 C +ATOM 90 CA GLY A 90 266.799 223.106 230.573 1.00 0.00 C +ATOM 91 CA LEU A 91 267.409 220.503 233.288 1.00 0.00 C +ATOM 92 CA ARG A 92 267.077 218.251 236.344 1.00 0.00 C +ATOM 93 CA ARG A 93 266.032 219.962 239.584 1.00 0.00 C +ATOM 94 CA LEU A 94 266.643 223.678 239.006 1.00 0.00 C +ATOM 95 CA ALA A 95 266.006 227.143 240.456 1.00 0.00 C +ATOM 96 CA ALA A 96 262.984 228.992 239.055 1.00 0.00 C +ATOM 97 CA ALA A 97 259.291 229.270 238.160 1.00 0.00 C +ATOM 98 CA GLY A 98 257.964 230.850 234.957 1.00 0.00 C +ATOM 99 CA GLU A 99 255.857 233.980 234.429 1.00 0.00 C +ATOM 100 CA ARG A 100 254.987 237.438 235.771 1.00 0.00 C +ATOM 101 CA LYS A 101 252.737 239.134 238.336 1.00 0.00 C +ATOM 102 CA SER A 102 248.960 239.427 238.742 1.00 0.00 C +ATOM 103 CA GLY A 103 246.027 237.640 237.092 1.00 0.00 C +ATOM 104 CA GLY A 104 243.656 235.186 235.397 1.00 0.00 C +ATOM 105 CA GLY A 105 245.920 232.805 233.468 1.00 0.00 C +ATOM 106 CA GLY A 106 247.963 234.191 230.566 1.00 0.00 C +ATOM 107 CA GLY A 107 246.292 233.710 227.176 1.00 0.00 C +ATOM 108 CA CYS A 108 248.522 231.251 225.306 1.00 0.00 C +ATOM 109 CA THR A 109 247.363 229.073 222.402 1.00 0.00 C +ATOM 110 CA LEU A 110 243.980 228.103 220.943 1.00 0.00 C +ATOM 111 CA LEU A 111 240.420 229.448 220.758 1.00 0.00 C +ATOM 112 CA GLU A 112 237.184 231.306 219.989 1.00 0.00 C +ATOM 113 CA ARG A 113 233.831 232.162 221.582 1.00 0.00 C +ATOM 114 CA LYS A 114 230.127 231.798 220.766 1.00 0.00 C +ATOM 115 CA ARG A 115 227.507 231.542 218.011 1.00 0.00 C +ATOM 116 CA ALA A 116 224.117 231.617 216.274 1.00 0.00 C +ATOM 117 CA GLN A 117 221.751 228.903 217.519 1.00 0.00 C +ATOM 118 CA GLY A 118 220.239 227.018 220.465 1.00 0.00 C +ATOM 119 CA SER A 119 217.383 224.498 220.561 1.00 0.00 C +ATOM 120 CA SER A 120 214.911 225.460 223.296 1.00 0.00 C +ATOM 121 CA VAL A 121 211.284 226.619 223.148 1.00 0.00 C +ATOM 122 CA LYS A 122 207.945 227.273 221.434 1.00 0.00 C +ATOM 123 CA TRP A 123 204.622 227.673 219.615 1.00 0.00 C +ATOM 124 CA GLY A 124 203.849 225.098 216.915 1.00 0.00 C +ATOM 125 CA LYS A 125 205.715 221.816 217.430 1.00 0.00 C +ATOM 126 CA ARG A 126 209.254 221.489 218.804 1.00 0.00 C +ATOM 127 CA GLU A 127 209.947 219.397 221.912 1.00 0.00 C +ATOM 128 CA ARG A 128 207.723 219.431 225.005 1.00 0.00 C +TER 129 ARG A 128 +END diff --git a/Plants/Q8S835/Q8S835.dcd b/Plants/Q8S835/Q8S835.dcd new file mode 100644 index 0000000000000000000000000000000000000000..bcf30113f27e69f058f61d830a1da958d7c724c7 --- /dev/null +++ b/Plants/Q8S835/Q8S835.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c20931100263491aeff43f907f2dacf8741f1914b3aa089d49955068ead4acb8 +size 76960276 diff --git a/Plants/Q8S835/top.pdb b/Plants/Q8S835/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..9a44270c8c62a4ebd3bef0ea9eea2b1b1cb7337c --- /dev/null +++ b/Plants/Q8S835/top.pdb @@ -0,0 +1,318 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 820.000 820.000 820.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 365.105 452.915 447.049 1.00 0.00 C +ATOM 2 CA ALA A 2 367.848 454.863 448.837 1.00 0.00 C +ATOM 3 CA GLY A 3 366.615 457.063 451.692 1.00 0.00 C +ATOM 4 CA ARG A 4 365.648 460.746 451.559 1.00 0.00 C +ATOM 5 CA GLY A 5 362.605 463.003 451.962 1.00 0.00 C +ATOM 6 CA ALA A 6 359.827 465.488 451.174 1.00 0.00 C +ATOM 7 CA ARG A 7 360.806 469.170 451.153 1.00 0.00 C +ATOM 8 CA GLY A 8 360.964 472.118 453.561 1.00 0.00 C +ATOM 9 CA PRO A 9 362.675 472.161 456.965 1.00 0.00 C +ATOM 10 CA GLY A 10 361.953 469.490 459.585 1.00 0.00 C +ATOM 11 CA PRO A 11 362.379 466.374 461.736 1.00 0.00 C +ATOM 12 CA ARG A 12 363.700 464.761 464.924 1.00 0.00 C +ATOM 13 CA GLU A 13 364.623 461.315 466.263 1.00 0.00 C +ATOM 14 CA VAL A 14 366.789 460.858 469.364 1.00 0.00 C +ATOM 15 CA GLY A 15 368.519 460.959 472.757 1.00 0.00 C +ATOM 16 CA PRO A 16 369.226 460.549 476.479 1.00 0.00 C +ATOM 17 CA THR A 17 368.997 457.777 479.083 1.00 0.00 C +ATOM 18 CA ARG A 18 370.111 455.555 481.970 1.00 0.00 C +ATOM 19 CA GLN A 19 368.605 453.730 484.956 1.00 0.00 C +ATOM 20 CA PRO A 20 368.635 449.925 484.769 1.00 0.00 C +ATOM 21 CA LEU A 21 365.177 448.903 485.998 1.00 0.00 C +ATOM 22 CA GLY A 22 364.302 447.805 489.540 1.00 0.00 C +ATOM 23 CA PRO A 23 365.469 445.032 491.877 1.00 0.00 C +ATOM 24 CA ARG A 24 365.858 441.367 492.842 1.00 0.00 C +ATOM 25 CA TRP A 25 367.547 438.324 491.294 1.00 0.00 C +ATOM 26 CA THR A 26 366.722 434.777 492.417 1.00 0.00 C +ATOM 27 CA GLY A 27 369.671 432.397 492.804 1.00 0.00 C +ATOM 28 CA ARG A 28 371.239 432.722 496.261 1.00 0.00 C +ATOM 29 CA THR A 29 372.161 434.533 499.484 1.00 0.00 C +ATOM 30 CA ARG A 30 375.629 436.068 499.855 1.00 0.00 C +ATOM 31 CA LEU A 31 378.535 436.179 497.394 1.00 0.00 C +ATOM 32 CA ALA A 32 378.253 434.641 493.920 1.00 0.00 C +ATOM 33 CA ALA A 33 379.487 431.213 492.804 1.00 0.00 C +ATOM 34 CA VAL A 34 382.067 429.749 490.413 1.00 0.00 C +ATOM 35 CA GLY A 35 383.582 426.477 489.183 1.00 0.00 C +ATOM 36 CA ALA A 36 385.456 424.045 486.926 1.00 0.00 C +ATOM 37 CA VAL A 37 387.186 420.690 487.438 1.00 0.00 C +ATOM 38 CA GLY A 38 389.909 420.943 490.091 1.00 0.00 C +ATOM 39 CA PRO A 39 392.738 419.598 492.259 1.00 0.00 C +ATOM 40 CA ALA A 40 394.408 416.373 491.105 1.00 0.00 C +ATOM 41 CA ARG A 41 396.892 414.321 489.072 1.00 0.00 C +ATOM 42 CA GLN A 42 398.148 413.609 485.546 1.00 0.00 C +ATOM 43 CA PRO A 43 400.683 410.774 485.320 1.00 0.00 C +ATOM 44 CA HIS A 44 401.703 408.521 482.422 1.00 0.00 C +ATOM 45 CA PRO A 45 403.871 409.483 479.441 1.00 0.00 C +ATOM 46 CA ARG A 46 405.015 407.417 476.451 1.00 0.00 C +ATOM 47 CA ALA A 47 404.240 406.332 472.882 1.00 0.00 C +ATOM 48 CA ARG A 48 401.671 403.975 471.346 1.00 0.00 C +ATOM 49 CA ALA A 49 397.899 403.478 471.552 1.00 0.00 C +ATOM 50 CA ALA A 50 396.656 404.208 468.025 1.00 0.00 C +ATOM 51 CA ASP A 51 398.466 405.260 464.841 1.00 0.00 C +ATOM 52 CA GLY A 52 400.082 408.678 464.372 1.00 0.00 C +ATOM 53 CA ARG A 53 403.466 410.430 464.424 1.00 0.00 C +ATOM 54 CA ALA A 54 405.717 413.501 464.562 1.00 0.00 C +ATOM 55 CA HIS A 55 408.580 415.005 462.549 1.00 0.00 C +ATOM 56 CA LEU A 56 407.435 417.450 459.861 1.00 0.00 C +ATOM 57 CA ALA A 57 406.931 416.795 456.142 1.00 0.00 C +ATOM 58 CA ALA A 58 409.471 414.139 455.140 1.00 0.00 C +ATOM 59 CA ALA A 59 413.048 413.449 454.023 1.00 0.00 C +ATOM 60 CA ARG A 60 414.234 415.829 451.295 1.00 0.00 C +ATOM 61 CA ALA A 61 411.921 416.750 448.410 1.00 0.00 C +ATOM 62 CA ARG A 62 409.469 416.107 445.566 1.00 0.00 C +ATOM 63 CA PRO A 63 406.515 414.485 443.787 1.00 0.00 C +ATOM 64 CA LYS A 64 406.726 414.707 439.989 1.00 0.00 C +ATOM 65 CA ALA A 65 404.568 415.383 436.923 1.00 0.00 C +ATOM 66 CA ALA A 66 401.179 417.028 436.353 1.00 0.00 C +ATOM 67 CA SER A 67 397.667 417.988 437.477 1.00 0.00 C +ATOM 68 CA PRO A 68 395.447 420.385 439.435 1.00 0.00 C +ATOM 69 CA ALA A 69 393.760 423.686 440.316 1.00 0.00 C +ATOM 70 CA ARG A 70 394.907 427.314 440.517 1.00 0.00 C +ATOM 71 CA PRO A 71 393.836 430.968 440.413 1.00 0.00 C +ATOM 72 CA THR A 72 390.204 431.033 439.262 1.00 0.00 C +ATOM 73 CA GLY A 73 387.984 434.124 439.443 1.00 0.00 C +ATOM 74 CA ALA A 74 385.826 437.063 440.549 1.00 0.00 C +ATOM 75 CA ALA A 75 385.019 438.266 444.073 1.00 0.00 C +ATOM 76 CA ARG A 76 385.862 441.937 444.647 1.00 0.00 C +ATOM 77 CA PRO A 77 388.520 443.802 442.654 1.00 0.00 C +ATOM 78 CA ARG A 78 388.622 446.478 439.944 1.00 0.00 C +ATOM 79 CA PRO A 79 387.111 448.940 437.460 1.00 0.00 C +ATOM 80 CA ASP A 80 389.606 450.801 435.261 1.00 0.00 C +ATOM 81 CA GLY A 81 392.445 452.781 433.669 1.00 0.00 C +ATOM 82 CA HIS A 82 391.846 455.998 431.719 1.00 0.00 C +ATOM 83 CA ARG A 83 392.512 459.745 431.526 1.00 0.00 C +ATOM 84 CA ARG A 84 391.194 462.665 429.464 1.00 0.00 C +ATOM 85 CA ARG A 85 387.525 463.325 428.679 1.00 0.00 C +ATOM 86 CA PRO A 86 384.852 460.770 429.598 1.00 0.00 C +ATOM 87 CA SER A 87 381.908 459.048 427.899 1.00 0.00 C +ATOM 88 CA ALA A 88 382.783 455.977 425.820 1.00 0.00 C +ATOM 89 CA ARG A 89 385.937 454.288 427.128 1.00 0.00 C +ATOM 90 CA ARG A 90 389.555 454.892 426.096 1.00 0.00 C +ATOM 91 CA SER A 91 390.120 453.379 422.645 1.00 0.00 C +ATOM 92 CA SER A 92 389.537 450.142 420.721 1.00 0.00 C +ATOM 93 CA ALA A 93 388.276 447.050 422.554 1.00 0.00 C +ATOM 94 CA ARG A 94 389.289 444.832 425.482 1.00 0.00 C +ATOM 95 CA GLU A 95 390.384 441.183 425.416 1.00 0.00 C +ATOM 96 CA SER A 96 389.286 438.086 427.345 1.00 0.00 C +ATOM 97 CA GLY A 97 389.139 438.076 431.152 1.00 0.00 C +ATOM 98 CA GLU A 98 385.689 439.390 432.093 1.00 0.00 C +ATOM 99 CA GLU A 99 382.871 439.627 429.540 1.00 0.00 C +ATOM 100 CA GLY A 100 382.770 437.789 426.204 1.00 0.00 C +ATOM 101 CA GLU A 101 383.503 436.886 422.576 1.00 0.00 C +ATOM 102 CA THR A 102 382.085 437.120 419.048 1.00 0.00 C +ATOM 103 CA GLU A 103 384.249 434.824 416.913 1.00 0.00 C +ATOM 104 CA GLY A 104 386.338 432.905 414.369 1.00 0.00 C +ATOM 105 CA THR A 105 388.457 430.940 411.887 1.00 0.00 C +ATOM 106 CA VAL A 106 390.109 429.857 408.629 1.00 0.00 C +ATOM 107 CA HIS A 107 390.945 432.439 405.955 1.00 0.00 C +ATOM 108 CA GLY A 108 388.322 432.815 403.218 1.00 0.00 C +ATOM 109 CA SER A 109 386.503 434.945 400.635 1.00 0.00 C +ATOM 110 CA PRO A 110 383.186 436.513 399.610 1.00 0.00 C +ATOM 111 CA ARG A 111 381.700 439.751 398.260 1.00 0.00 C +ATOM 112 CA ASP A 112 383.248 443.114 399.161 1.00 0.00 C +ATOM 113 CA THR A 113 383.911 442.967 402.910 1.00 0.00 C +ATOM 114 CA ARG A 114 385.797 442.978 406.220 1.00 0.00 C +ATOM 115 CA THR A 115 389.569 442.508 405.967 1.00 0.00 C +ATOM 116 CA ALA A 116 392.138 440.684 403.824 1.00 0.00 C +ATOM 117 CA GLU A 117 395.333 442.703 403.343 1.00 0.00 C +ATOM 118 CA THR A 118 398.910 441.517 402.785 1.00 0.00 C +ATOM 119 CA THR A 119 400.822 440.327 405.858 1.00 0.00 C +ATOM 120 CA ASN A 120 398.671 439.175 408.784 1.00 0.00 C +ATOM 121 CA GLY A 121 400.295 435.997 410.118 1.00 0.00 C +ATOM 122 CA VAL A 122 401.726 432.900 411.813 1.00 0.00 C +ATOM 123 CA GLU A 123 405.529 432.674 411.880 1.00 0.00 C +ATOM 124 CA LYS A 124 408.635 432.841 409.680 1.00 0.00 C +ATOM 125 CA ARG A 125 409.729 430.812 406.647 1.00 0.00 C +ATOM 126 CA GLY A 126 411.354 427.398 406.177 1.00 0.00 C +ATOM 127 CA GLY A 127 413.382 424.198 406.581 1.00 0.00 C +ATOM 128 CA ALA A 128 416.899 422.731 406.560 1.00 0.00 C +ATOM 129 CA ALA A 129 419.096 425.468 405.077 1.00 0.00 C +ATOM 130 CA ARG A 130 420.926 427.522 402.442 1.00 0.00 C +ATOM 131 CA ASP A 131 424.142 429.491 401.899 1.00 0.00 C +ATOM 132 CA ASP A 132 423.476 433.040 400.684 1.00 0.00 C +ATOM 133 CA ASP A 133 426.587 435.010 399.706 1.00 0.00 C +ATOM 134 CA ASP A 134 430.076 435.350 398.213 1.00 0.00 C +ATOM 135 CA GLY A 135 433.762 434.609 398.827 1.00 0.00 C +ATOM 136 CA GLY A 136 435.843 436.027 401.687 1.00 0.00 C +ATOM 137 CA ALA A 137 436.826 433.389 404.253 1.00 0.00 C +ATOM 138 CA PRO A 138 436.176 431.782 407.646 1.00 0.00 C +ATOM 139 CA THR A 139 435.420 432.050 411.371 1.00 0.00 C +ATOM 140 CA VAL A 140 432.427 432.140 413.726 1.00 0.00 C +ATOM 141 CA GLY A 141 429.887 433.355 416.293 1.00 0.00 C +ATOM 142 CA GLU A 142 426.125 432.749 416.274 1.00 0.00 C +ATOM 143 CA ARG A 143 423.245 430.335 415.650 1.00 0.00 C +ATOM 144 CA ASN A 144 421.946 427.207 417.395 1.00 0.00 C +ATOM 145 CA GLY A 145 423.813 425.656 420.332 1.00 0.00 C +ATOM 146 CA GLY A 146 425.537 422.968 422.411 1.00 0.00 C +ATOM 147 CA ALA A 147 427.290 419.753 421.357 1.00 0.00 C +ATOM 148 CA ASP A 148 430.044 417.875 419.512 1.00 0.00 C +ATOM 149 CA GLU A 149 433.054 418.781 417.360 1.00 0.00 C +ATOM 150 CA VAL A 150 436.346 417.127 416.386 1.00 0.00 C +ATOM 151 CA ASP A 151 437.058 413.431 415.796 1.00 0.00 C +ATOM 152 CA GLY A 152 440.220 411.359 415.322 1.00 0.00 C +ATOM 153 CA ASP A 153 442.046 412.018 412.043 1.00 0.00 C +ATOM 154 CA ALA A 154 440.562 414.734 409.822 1.00 0.00 C +ATOM 155 CA ALA A 155 441.154 415.239 406.092 1.00 0.00 C +ATOM 156 CA MET A 156 442.744 412.539 403.924 1.00 0.00 C +ATOM 157 CA PRO A 157 442.561 410.504 400.708 1.00 0.00 C +ATOM 158 CA ARG A 158 441.073 408.840 397.621 1.00 0.00 C +ATOM 159 CA GLU A 159 443.275 407.427 394.851 1.00 0.00 C +ATOM 160 CA VAL A 160 446.549 406.942 392.963 1.00 0.00 C +ATOM 161 CA ALA A 161 449.054 405.812 390.325 1.00 0.00 C +ATOM 162 CA PRO A 162 452.515 405.043 391.719 1.00 0.00 C +ATOM 163 CA SER A 163 456.244 405.816 391.591 1.00 0.00 C +ATOM 164 CA ARG A 164 458.110 403.086 393.483 1.00 0.00 C +ATOM 165 CA GLU A 165 461.629 401.749 394.068 1.00 0.00 C +ATOM 166 CA GLU A 166 462.648 398.338 395.425 1.00 0.00 C +ATOM 167 CA ASP A 167 466.388 397.878 395.994 1.00 0.00 C +ATOM 168 CA ARG A 168 470.042 398.620 396.775 1.00 0.00 C +ATOM 169 CA SER A 169 470.236 401.328 399.449 1.00 0.00 C +ATOM 170 CA ASP A 170 470.158 405.115 399.039 1.00 0.00 C +ATOM 171 CA ASP A 171 466.574 405.900 398.013 1.00 0.00 C +ATOM 172 CA GLY A 172 464.375 409.011 398.079 1.00 0.00 C +ATOM 173 CA GLY A 173 462.768 411.226 395.430 1.00 0.00 C +ATOM 174 CA GLU A 174 462.272 414.950 396.067 1.00 0.00 C +ATOM 175 CA PRO A 175 459.351 416.101 393.909 1.00 0.00 C +ATOM 176 CA GLU A 176 457.113 419.179 393.726 1.00 0.00 C +ATOM 177 CA ARG A 177 455.698 421.989 391.576 1.00 0.00 C +ATOM 178 CA ARG A 178 452.582 424.115 391.042 1.00 0.00 C +ATOM 179 CA LYS A 179 449.881 426.796 390.874 1.00 0.00 C +ATOM 180 CA ALA A 180 447.725 428.831 393.267 1.00 0.00 C +ATOM 181 CA THR A 181 444.405 430.334 392.155 1.00 0.00 C +ATOM 182 CA ALA A 182 442.652 431.448 388.960 1.00 0.00 C +ATOM 183 CA ARG A 183 444.512 432.786 385.916 1.00 0.00 C +ATOM 184 CA PHE A 184 446.627 430.913 383.359 1.00 0.00 C +ATOM 185 CA GLY A 185 450.255 430.490 384.443 1.00 0.00 C +ATOM 186 CA MET A 186 452.298 427.920 382.509 1.00 0.00 C +ATOM 187 CA PRO A 187 453.415 424.281 382.668 1.00 0.00 C +ATOM 188 CA ARG A 188 451.637 421.874 385.026 1.00 0.00 C +ATOM 189 CA ALA A 189 448.115 420.421 385.029 1.00 0.00 C +ATOM 190 CA THR A 190 445.562 417.640 384.512 1.00 0.00 C +ATOM 191 CA VAL A 191 444.955 414.121 383.185 1.00 0.00 C +ATOM 192 CA LEU A 192 447.578 412.338 381.074 1.00 0.00 C +ATOM 193 CA ARG A 193 451.246 411.707 381.889 1.00 0.00 C +ATOM 194 CA GLN A 194 453.965 409.672 380.162 1.00 0.00 C +ATOM 195 CA PRO A 195 457.403 410.953 379.136 1.00 0.00 C +ATOM 196 CA ALA A 196 460.228 409.004 380.789 1.00 0.00 C +ATOM 197 CA ASP A 197 463.399 406.892 380.795 1.00 0.00 C +ATOM 198 CA GLU A 198 462.929 403.794 382.962 1.00 0.00 C +ATOM 199 CA ALA A 199 462.115 401.098 385.528 1.00 0.00 C +ATOM 200 CA GLU A 200 460.258 397.788 385.854 1.00 0.00 C +ATOM 201 CA ARG A 201 456.789 397.804 387.431 1.00 0.00 C +ATOM 202 CA ARG A 202 455.417 395.466 390.108 1.00 0.00 C +ATOM 203 CA THR A 203 455.081 394.116 393.655 1.00 0.00 C +ATOM 204 CA GLY A 204 452.348 393.264 396.169 1.00 0.00 C +ATOM 205 CA SER A 205 450.361 396.448 396.825 1.00 0.00 C +ATOM 206 CA ALA A 206 449.109 399.699 398.368 1.00 0.00 C +ATOM 207 CA ALA A 207 447.537 398.668 401.681 1.00 0.00 C +ATOM 208 CA THR A 208 448.138 394.998 402.510 1.00 0.00 C +ATOM 209 CA ARG A 209 444.882 393.623 403.933 1.00 0.00 C +ATOM 210 CA ARG A 210 441.459 394.949 404.953 1.00 0.00 C +ATOM 211 CA SER A 211 438.686 392.596 406.089 1.00 0.00 C +ATOM 212 CA GLY A 212 435.178 393.159 407.463 1.00 0.00 C +ATOM 213 CA TRP A 213 431.442 393.510 406.804 1.00 0.00 C +ATOM 214 CA ARG A 214 429.041 391.765 404.414 1.00 0.00 C +ATOM 215 CA CYS A 215 425.589 390.327 403.688 1.00 0.00 C +ATOM 216 CA ARG A 216 424.431 389.959 400.076 1.00 0.00 C +ATOM 217 CA ARG A 217 425.479 390.977 396.557 1.00 0.00 C +ATOM 218 CA VAL A 218 426.142 391.445 392.835 1.00 0.00 C +ATOM 219 CA GLY A 219 425.341 389.275 389.807 1.00 0.00 C +ATOM 220 CA ARG A 220 425.903 387.624 386.419 1.00 0.00 C +ATOM 221 CA ARG A 221 423.244 388.864 383.988 1.00 0.00 C +ATOM 222 CA THR A 222 420.159 387.143 382.560 1.00 0.00 C +ATOM 223 CA GLY A 223 416.682 388.695 382.677 1.00 0.00 C +ATOM 224 CA ALA A 224 415.935 389.775 386.253 1.00 0.00 C +ATOM 225 CA THR A 225 413.627 391.661 388.626 1.00 0.00 C +ATOM 226 CA SER A 226 410.288 393.434 389.106 1.00 0.00 C +ATOM 227 CA ALA A 227 407.618 394.843 386.783 1.00 0.00 C +ATOM 228 CA ALA A 228 407.565 398.415 385.457 1.00 0.00 C +ATOM 229 CA ASN A 229 408.559 400.387 382.353 1.00 0.00 C +ATOM 230 CA ARG A 230 405.946 401.894 380.025 1.00 0.00 C +ATOM 231 CA ARG A 231 407.889 404.278 377.776 1.00 0.00 C +ATOM 232 CA ARG A 232 410.840 402.440 376.216 1.00 0.00 C +ATOM 233 CA ALA A 233 414.139 403.304 377.914 1.00 0.00 C +ATOM 234 CA GLY A 234 416.577 401.405 380.144 1.00 0.00 C +ATOM 235 CA LYS A 235 420.102 400.869 378.803 1.00 0.00 C +ATOM 236 CA ALA A 236 421.839 397.939 380.512 1.00 0.00 C +ATOM 237 CA GLY A 237 425.262 396.267 380.475 1.00 0.00 C +ATOM 238 CA CYS A 238 426.712 392.885 379.485 1.00 0.00 C +ATOM 239 CA GLY A 239 427.126 389.153 378.841 1.00 0.00 C +ATOM 240 CA GLY A 240 429.010 387.070 376.267 1.00 0.00 C +ATOM 241 CA ILE A 241 429.758 387.563 372.564 1.00 0.00 C +ATOM 242 CA ARG A 242 428.625 390.432 370.327 1.00 0.00 C +ATOM 243 CA GLY A 243 427.703 389.757 366.692 1.00 0.00 C +ATOM 244 CA GLY A 244 429.353 387.423 364.173 1.00 0.00 C +ATOM 245 CA GLY A 245 426.778 386.758 361.444 1.00 0.00 C +ATOM 246 CA GLY A 246 425.820 383.105 361.947 1.00 0.00 C +ATOM 247 CA ALA A 247 424.041 380.341 363.874 1.00 0.00 C +ATOM 248 CA ARG A 248 421.731 378.084 365.895 1.00 0.00 C +ATOM 249 CA ALA A 249 419.224 375.710 367.507 1.00 0.00 C +ATOM 250 CA ARG A 250 419.919 372.054 368.324 1.00 0.00 C +ATOM 251 CA ALA A 251 418.046 368.888 367.331 1.00 0.00 C +ATOM 252 CA GLY A 252 416.398 368.156 363.975 1.00 0.00 C +ATOM 253 CA GLY A 253 418.222 367.757 360.653 1.00 0.00 C +ATOM 254 CA GLY A 254 418.349 369.674 357.363 1.00 0.00 C +ATOM 255 CA CYS A 255 416.777 373.138 357.567 1.00 0.00 C +ATOM 256 CA GLY A 256 414.024 375.156 355.874 1.00 0.00 C +ATOM 257 CA ALA A 257 410.474 373.882 356.415 1.00 0.00 C +ATOM 258 CA ARG A 258 407.827 371.734 358.116 1.00 0.00 C +ATOM 259 CA ARG A 259 406.941 368.574 360.051 1.00 0.00 C +ATOM 260 CA LYS A 260 403.583 366.772 360.008 1.00 0.00 C +ATOM 261 CA THR A 261 401.216 364.055 361.242 1.00 0.00 C +ATOM 262 CA THR A 262 397.824 365.075 359.839 1.00 0.00 C +ATOM 263 CA GLY A 263 396.939 362.370 357.306 1.00 0.00 C +ATOM 264 CA GLY A 264 396.706 360.305 354.112 1.00 0.00 C +ATOM 265 CA SER A 265 394.958 362.316 351.388 1.00 0.00 C +ATOM 266 CA HIS A 266 393.489 359.713 349.026 1.00 0.00 C +ATOM 267 CA PRO A 267 392.778 356.398 350.762 1.00 0.00 C +ATOM 268 CA SER A 268 392.768 353.260 352.924 1.00 0.00 C +ATOM 269 CA ALA A 269 395.355 350.542 352.266 1.00 0.00 C +ATOM 270 CA ARG A 270 395.523 346.751 352.612 1.00 0.00 C +ATOM 271 CA VAL A 271 398.557 345.414 354.490 1.00 0.00 C +ATOM 272 CA ALA A 272 401.652 346.537 356.407 1.00 0.00 C +ATOM 273 CA GLY A 273 403.814 346.561 359.544 1.00 0.00 C +ATOM 274 CA GLY A 274 406.649 349.078 359.921 1.00 0.00 C +ATOM 275 CA PRO A 275 410.299 348.264 360.648 1.00 0.00 C +ATOM 276 CA ALA A 276 413.660 349.011 362.279 1.00 0.00 C +ATOM 277 CA CYS A 277 416.034 349.428 365.230 1.00 0.00 C +ATOM 278 CA GLN A 278 415.464 348.736 368.933 1.00 0.00 C +ATOM 279 CA ARG A 279 415.787 349.742 372.594 1.00 0.00 C +ATOM 280 CA ARG A 280 412.555 350.168 374.566 1.00 0.00 C +ATOM 281 CA ALA A 281 409.725 352.704 374.829 1.00 0.00 C +ATOM 282 CA ARG A 282 406.515 351.396 373.246 1.00 0.00 C +ATOM 283 CA ALA A 283 403.382 349.497 374.290 1.00 0.00 C +ATOM 284 CA GLY A 284 401.153 346.983 376.087 1.00 0.00 C +ATOM 285 CA GLU A 285 400.695 344.535 378.969 1.00 0.00 C +ATOM 286 CA ALA A 286 399.529 346.577 381.967 1.00 0.00 C +ATOM 287 CA ASP A 287 395.914 347.747 382.253 1.00 0.00 C +ATOM 288 CA GLY A 288 395.296 351.431 381.502 1.00 0.00 C +ATOM 289 CA PRO A 289 394.099 354.624 379.804 1.00 0.00 C +ATOM 290 CA TRP A 290 392.414 358.025 380.133 1.00 0.00 C +ATOM 291 CA GLY A 291 394.332 360.165 382.635 1.00 0.00 C +ATOM 292 CA LYS A 292 394.672 361.475 386.196 1.00 0.00 C +ATOM 293 CA ARG A 293 397.678 360.987 388.486 1.00 0.00 C +ATOM 294 CA GLU A 294 400.488 362.871 386.736 1.00 0.00 C +ATOM 295 CA ARG A 295 400.889 366.192 384.911 1.00 0.00 C +ATOM 296 CA GLY A 296 401.741 366.500 381.211 1.00 0.00 C +ATOM 297 CA ARG A 297 401.468 369.918 379.551 1.00 0.00 C +ATOM 298 CA ASP A 298 399.789 372.150 376.959 1.00 0.00 C +ATOM 299 CA TRP A 299 397.029 374.751 377.326 1.00 0.00 C +ATOM 300 CA ALA A 300 393.842 375.897 379.071 1.00 0.00 C +ATOM 301 CA GLU A 301 390.726 373.730 378.740 1.00 0.00 C +ATOM 302 CA PRO A 302 388.311 370.802 378.409 1.00 0.00 C +ATOM 303 CA ALA A 303 389.518 368.287 375.814 1.00 0.00 C +ATOM 304 CA GLN A 304 390.480 365.890 373.014 1.00 0.00 C +ATOM 305 CA GLU A 305 392.690 367.459 370.336 1.00 0.00 C +ATOM 306 CA GLY A 306 395.166 366.644 367.558 1.00 0.00 C +ATOM 307 CA LYS A 307 396.196 368.794 364.586 1.00 0.00 C +ATOM 308 CA GLY A 308 396.268 371.659 362.076 1.00 0.00 C +ATOM 309 CA GLY A 309 397.838 374.934 363.228 1.00 0.00 C +ATOM 310 CA GLU A 310 396.492 376.819 366.253 1.00 0.00 C +ATOM 311 CA LYS A 311 395.694 374.278 368.977 1.00 0.00 C +ATOM 312 CA ASN A 312 392.468 374.802 370.935 1.00 0.00 C +ATOM 313 CA PHE A 313 389.655 377.296 371.558 1.00 0.00 C +ATOM 314 CA PHE A 314 387.308 379.916 373.020 1.00 0.00 C +TER 315 PHE A 314 +END diff --git a/Plants/Q8S840/Q8S840.dcd b/Plants/Q8S840/Q8S840.dcd new file mode 100644 index 0000000000000000000000000000000000000000..418a81ef749658b555eac157995a4f42a111c6bc --- /dev/null +++ b/Plants/Q8S840/Q8S840.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:942da68c3c9a022cd94ad1e14b1c57b941d7c6c9a7532c88a695fada95545689 +size 38820276 diff --git a/Plants/Q8S840/top.pdb b/Plants/Q8S840/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..8ccf41c420ccb7411a0f28e03ee53d0cf4e6cd15 --- /dev/null +++ b/Plants/Q8S840/top.pdb @@ -0,0 +1,213 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 208.934 227.386 248.137 1.00 0.00 C +ATOM 2 CA TRP A 2 212.628 228.071 248.770 1.00 0.00 C +ATOM 3 CA LYS A 3 215.754 225.964 248.218 1.00 0.00 C +ATOM 4 CA TYR A 4 218.465 223.777 249.761 1.00 0.00 C +ATOM 5 CA GLY A 5 220.807 221.030 250.980 1.00 0.00 C +ATOM 6 CA SER A 6 223.661 218.586 250.350 1.00 0.00 C +ATOM 7 CA ALA A 7 225.381 219.866 247.201 1.00 0.00 C +ATOM 8 CA LEU A 8 227.970 219.161 244.496 1.00 0.00 C +ATOM 9 CA GLN A 9 228.630 215.481 243.765 1.00 0.00 C +ATOM 10 CA GLN A 10 228.336 211.706 244.188 1.00 0.00 C +ATOM 11 CA ARG A 11 225.345 210.914 246.411 1.00 0.00 C +ATOM 12 CA PRO A 12 221.575 210.877 245.859 1.00 0.00 C +ATOM 13 CA GLU A 13 219.302 213.771 246.847 1.00 0.00 C +ATOM 14 CA LEU A 14 219.656 217.203 245.231 1.00 0.00 C +ATOM 15 CA ASN A 15 217.410 219.884 243.719 1.00 0.00 C +ATOM 16 CA PRO A 16 217.385 221.462 240.251 1.00 0.00 C +ATOM 17 CA TYR A 17 218.333 220.865 236.610 1.00 0.00 C +ATOM 18 CA SER A 18 219.242 218.736 233.584 1.00 0.00 C +ATOM 19 CA THR A 19 221.714 215.888 234.132 1.00 0.00 C +ATOM 20 CA ARG A 20 220.476 212.864 232.173 1.00 0.00 C +ATOM 21 CA ALA A 21 222.709 210.218 230.583 1.00 0.00 C +ATOM 22 CA GLY A 22 226.423 210.906 230.083 1.00 0.00 C +ATOM 23 CA ARG A 23 227.781 212.444 226.872 1.00 0.00 C +ATOM 24 CA GLU A 24 229.484 215.579 225.535 1.00 0.00 C +ATOM 25 CA GLY A 25 230.241 219.297 225.193 1.00 0.00 C +ATOM 26 CA ALA A 26 232.009 222.456 224.005 1.00 0.00 C +ATOM 27 CA ARG A 27 233.995 224.662 226.394 1.00 0.00 C +ATOM 28 CA THR A 28 235.066 227.831 228.218 1.00 0.00 C +ATOM 29 CA GLY A 29 236.408 229.590 231.320 1.00 0.00 C +ATOM 30 CA SER A 30 238.820 232.519 230.971 1.00 0.00 C +ATOM 31 CA THR A 31 241.421 232.761 233.744 1.00 0.00 C +ATOM 32 CA GLY A 32 241.398 233.895 237.382 1.00 0.00 C +ATOM 33 CA VAL A 33 241.569 230.952 239.795 1.00 0.00 C +ATOM 34 CA GLY A 34 243.677 227.893 240.640 1.00 0.00 C +ATOM 35 CA PRO A 35 246.387 226.482 242.916 1.00 0.00 C +ATOM 36 CA THR A 36 249.495 224.335 243.414 1.00 0.00 C +ATOM 37 CA ARG A 37 252.477 225.911 245.186 1.00 0.00 C +ATOM 38 CA GLN A 38 255.713 225.424 243.235 1.00 0.00 C +ATOM 39 CA PRO A 39 255.807 226.053 239.478 1.00 0.00 C +ATOM 40 CA LEU A 40 254.428 229.338 238.126 1.00 0.00 C +ATOM 41 CA GLY A 41 255.407 232.251 240.378 1.00 0.00 C +ATOM 42 CA PRO A 42 252.450 232.620 242.751 1.00 0.00 C +ATOM 43 CA ARG A 43 249.088 232.469 244.538 1.00 0.00 C +ATOM 44 CA TRP A 44 246.427 231.753 247.169 1.00 0.00 C +ATOM 45 CA THR A 45 244.773 230.870 250.486 1.00 0.00 C +ATOM 46 CA GLY A 46 244.312 227.374 251.928 1.00 0.00 C +ATOM 47 CA ARG A 47 245.065 225.899 255.359 1.00 0.00 C +ATOM 48 CA THR A 48 247.169 222.767 254.830 1.00 0.00 C +ATOM 49 CA ARG A 49 249.215 221.840 251.753 1.00 0.00 C +ATOM 50 CA LEU A 50 248.888 218.650 249.695 1.00 0.00 C +ATOM 51 CA THR A 51 247.609 215.622 251.623 1.00 0.00 C +ATOM 52 CA PRO A 52 245.454 214.752 254.642 1.00 0.00 C +ATOM 53 CA ALA A 53 243.042 216.319 257.141 1.00 0.00 C +ATOM 54 CA GLY A 54 239.612 217.947 257.457 1.00 0.00 C +ATOM 55 CA ALA A 55 237.123 215.063 257.529 1.00 0.00 C +ATOM 56 CA PRO A 56 234.389 212.548 258.374 1.00 0.00 C +ATOM 57 CA ARG A 57 231.759 209.868 257.728 1.00 0.00 C +ATOM 58 CA GLY A 58 228.257 210.224 256.270 1.00 0.00 C +ATOM 59 CA ALA A 59 225.243 210.063 253.945 1.00 0.00 C +ATOM 60 CA PRO A 60 222.938 212.879 252.815 1.00 0.00 C +ATOM 61 CA GLU A 61 219.256 212.862 253.796 1.00 0.00 C +ATOM 62 CA GLY A 62 218.562 214.711 257.054 1.00 0.00 C +ATOM 63 CA GLY A 63 221.413 215.061 259.557 1.00 0.00 C +ATOM 64 CA LEU A 64 224.973 216.095 260.436 1.00 0.00 C +ATOM 65 CA ALA A 65 226.379 219.512 259.504 1.00 0.00 C +ATOM 66 CA GLY A 66 226.862 221.666 262.609 1.00 0.00 C +ATOM 67 CA THR A 67 229.000 224.118 264.592 1.00 0.00 C +ATOM 68 CA ALA A 68 230.895 226.358 262.161 1.00 0.00 C +ATOM 69 CA ASP A 69 228.261 228.187 260.104 1.00 0.00 C +ATOM 70 CA GLY A 70 229.245 231.413 258.330 1.00 0.00 C +ATOM 71 CA ARG A 71 229.017 235.215 258.265 1.00 0.00 C +ATOM 72 CA ARG A 72 230.629 236.620 255.112 1.00 0.00 C +ATOM 73 CA ARG A 73 232.330 236.491 251.705 1.00 0.00 C +ATOM 74 CA ALA A 74 233.349 236.194 248.046 1.00 0.00 C +ATOM 75 CA ARG A 75 236.851 235.803 246.599 1.00 0.00 C +ATOM 76 CA ALA A 76 238.570 232.742 248.080 1.00 0.00 C +ATOM 77 CA PRO A 77 236.763 230.260 250.336 1.00 0.00 C +ATOM 78 CA MET A 78 238.426 228.926 253.494 1.00 0.00 C +ATOM 79 CA VAL A 79 238.069 230.388 256.994 1.00 0.00 C +ATOM 80 CA THR A 80 238.161 234.185 257.300 1.00 0.00 C +ATOM 81 CA ALA A 81 239.515 237.567 256.185 1.00 0.00 C +ATOM 82 CA GLY A 82 241.834 240.556 255.732 1.00 0.00 C +ATOM 83 CA ASP A 83 243.554 243.890 255.067 1.00 0.00 C +ATOM 84 CA HIS A 84 244.598 245.044 251.590 1.00 0.00 C +ATOM 85 CA ARG A 85 247.633 247.222 250.842 1.00 0.00 C +ATOM 86 CA ARG A 86 250.806 245.321 249.925 1.00 0.00 C +ATOM 87 CA GLY A 87 253.217 243.688 252.382 1.00 0.00 C +ATOM 88 CA GLY A 88 256.019 241.129 252.041 1.00 0.00 C +ATOM 89 CA ALA A 89 259.649 240.266 252.811 1.00 0.00 C +ATOM 90 CA ALA A 90 262.447 239.151 255.145 1.00 0.00 C +ATOM 91 CA PRO A 91 266.145 240.055 255.297 1.00 0.00 C +ATOM 92 CA GLU A 92 269.907 240.240 255.872 1.00 0.00 C +ATOM 93 CA ARG A 93 273.687 240.176 255.399 1.00 0.00 C +ATOM 94 CA ALA A 94 276.999 241.427 253.992 1.00 0.00 C +ATOM 95 CA GLU A 95 279.212 242.048 257.031 1.00 0.00 C +ATOM 96 CA LYS A 96 282.644 243.047 255.712 1.00 0.00 C +ATOM 97 CA ARG A 97 282.532 246.734 254.758 1.00 0.00 C +ATOM 98 CA GLY A 98 282.279 249.201 257.651 1.00 0.00 C +ATOM 99 CA LYS A 99 284.946 250.304 260.138 1.00 0.00 C +ATOM 100 CA ARG A 100 288.722 250.740 260.406 1.00 0.00 C +ATOM 101 CA LYS A 101 292.471 251.339 260.086 1.00 0.00 C +ATOM 102 CA GLY A 102 294.418 248.129 259.438 1.00 0.00 C +ATOM 103 CA ARG A 103 293.158 245.838 256.666 1.00 0.00 C +ATOM 104 CA SER A 104 292.748 247.898 253.488 1.00 0.00 C +ATOM 105 CA THR A 105 292.335 246.470 249.980 1.00 0.00 C +ATOM 106 CA ALA A 106 295.114 245.402 247.603 1.00 0.00 C +ATOM 107 CA HIS A 107 298.745 246.524 247.876 1.00 0.00 C +ATOM 108 CA PRO A 108 302.282 245.356 248.681 1.00 0.00 C +ATOM 109 CA GLY A 109 302.601 243.150 251.771 1.00 0.00 C +ATOM 110 CA THR A 110 300.733 240.892 254.206 1.00 0.00 C +ATOM 111 CA THR A 111 296.952 241.263 254.496 1.00 0.00 C +ATOM 112 CA ARG A 112 295.804 239.538 257.693 1.00 0.00 C +ATOM 113 CA THR A 113 295.627 237.269 260.748 1.00 0.00 C +ATOM 114 CA ALA A 114 295.459 233.537 259.998 1.00 0.00 C +ATOM 115 CA GLU A 115 294.573 230.439 257.965 1.00 0.00 C +ATOM 116 CA THR A 116 291.436 228.400 258.686 1.00 0.00 C +ATOM 117 CA THR A 117 289.753 225.000 258.327 1.00 0.00 C +ATOM 118 CA THR A 118 287.059 224.684 255.652 1.00 0.00 C +ATOM 119 CA GLY A 119 286.314 221.342 253.981 1.00 0.00 C +ATOM 120 CA VAL A 120 284.533 220.415 250.743 1.00 0.00 C +ATOM 121 CA GLU A 121 284.752 222.517 247.573 1.00 0.00 C +ATOM 122 CA GLU A 122 282.836 225.123 245.559 1.00 0.00 C +ATOM 123 CA SER A 123 283.106 228.884 246.102 1.00 0.00 C +ATOM 124 CA GLY A 124 281.241 232.021 247.197 1.00 0.00 C +ATOM 125 CA GLY A 125 278.786 233.977 249.357 1.00 0.00 C +ATOM 126 CA ALA A 126 275.259 235.157 248.531 1.00 0.00 C +ATOM 127 CA VAL A 127 272.096 236.240 250.359 1.00 0.00 C +ATOM 128 CA ARG A 128 268.593 235.316 249.180 1.00 0.00 C +ATOM 129 CA ASP A 129 268.184 234.254 245.544 1.00 0.00 C +ATOM 130 CA GLY A 130 264.592 234.735 244.369 1.00 0.00 C +ATOM 131 CA GLU A 131 261.266 235.425 242.644 1.00 0.00 C +ATOM 132 CA ASP A 132 259.302 238.537 243.631 1.00 0.00 C +ATOM 133 CA ASP A 133 258.277 242.016 244.796 1.00 0.00 C +ATOM 134 CA GLY A 134 256.561 245.188 246.026 1.00 0.00 C +ATOM 135 CA ALA A 135 253.343 245.781 244.076 1.00 0.00 C +ATOM 136 CA PRO A 136 251.366 245.062 240.899 1.00 0.00 C +ATOM 137 CA ALA A 137 252.136 246.712 237.552 1.00 0.00 C +ATOM 138 CA VAL A 138 253.066 246.778 233.858 1.00 0.00 C +ATOM 139 CA GLY A 139 250.533 247.124 231.033 1.00 0.00 C +ATOM 140 CA GLY A 140 251.204 249.752 228.357 1.00 0.00 C +ATOM 141 CA ARG A 141 248.248 251.244 226.473 1.00 0.00 C +ATOM 142 CA ASN A 142 248.087 249.363 223.164 1.00 0.00 C +ATOM 143 CA GLY A 143 244.893 247.291 223.002 1.00 0.00 C +ATOM 144 CA GLY A 144 241.559 245.842 221.862 1.00 0.00 C +ATOM 145 CA ALA A 145 237.821 245.137 222.074 1.00 0.00 C +ATOM 146 CA ASP A 146 235.697 245.920 219.010 1.00 0.00 C +ATOM 147 CA GLU A 147 232.512 247.367 217.499 1.00 0.00 C +ATOM 148 CA VAL A 148 230.924 250.806 217.090 1.00 0.00 C +ATOM 149 CA ASP A 149 232.624 253.161 219.556 1.00 0.00 C +ATOM 150 CA ASP A 150 232.631 256.971 219.569 1.00 0.00 C +ATOM 151 CA ASP A 151 234.696 260.005 218.546 1.00 0.00 C +ATOM 152 CA ALA A 152 233.800 263.166 220.475 1.00 0.00 C +ATOM 153 CA ALA A 153 233.625 266.638 218.915 1.00 0.00 C +ATOM 154 CA LYS A 154 234.313 269.724 216.789 1.00 0.00 C +ATOM 155 CA PRO A 155 235.339 273.320 216.061 1.00 0.00 C +ATOM 156 CA MET A 156 237.799 275.441 218.053 1.00 0.00 C +ATOM 157 CA GLU A 157 240.960 274.560 219.988 1.00 0.00 C +ATOM 158 CA VAL A 158 244.454 273.268 219.187 1.00 0.00 C +ATOM 159 CA THR A 159 246.412 273.085 222.451 1.00 0.00 C +ATOM 160 CA PRO A 160 248.633 275.234 224.679 1.00 0.00 C +ATOM 161 CA ARG A 161 250.377 278.301 226.117 1.00 0.00 C +ATOM 162 CA ARG A 162 251.114 280.799 228.898 1.00 0.00 C +ATOM 163 CA GLU A 163 253.244 281.806 231.891 1.00 0.00 C +ATOM 164 CA GLU A 164 253.802 280.585 235.457 1.00 0.00 C +ATOM 165 CA VAL A 165 254.967 277.783 237.760 1.00 0.00 C +ATOM 166 CA ARG A 166 257.712 278.486 240.307 1.00 0.00 C +ATOM 167 CA GLY A 167 261.362 278.394 241.398 1.00 0.00 C +ATOM 168 CA ASP A 168 262.080 275.817 244.111 1.00 0.00 C +ATOM 169 CA ASP A 169 260.734 275.034 247.588 1.00 0.00 C +ATOM 170 CA GLY A 170 262.915 276.493 250.350 1.00 0.00 C +ATOM 171 CA GLY A 171 264.886 278.758 252.696 1.00 0.00 C +ATOM 172 CA GLU A 172 266.723 281.160 255.013 1.00 0.00 C +ATOM 173 CA PRO A 173 268.003 282.536 258.328 1.00 0.00 C +ATOM 174 CA GLU A 174 270.511 285.261 257.433 1.00 0.00 C +ATOM 175 CA LEU A 175 271.823 288.365 259.211 1.00 0.00 C +ATOM 176 CA GLY A 176 271.827 291.444 261.456 1.00 0.00 C +ATOM 177 CA GLY A 177 272.318 292.715 265.014 1.00 0.00 C +ATOM 178 CA ASP A 178 271.608 296.198 266.387 1.00 0.00 C +ATOM 179 CA GLY A 179 270.764 299.899 266.066 1.00 0.00 C +ATOM 180 CA GLY A 180 267.611 301.683 264.883 1.00 0.00 C +ATOM 181 CA GLU A 181 263.817 301.623 264.540 1.00 0.00 C +ATOM 182 CA ARG A 182 260.671 301.422 266.680 1.00 0.00 C +ATOM 183 CA GLY A 183 259.085 300.355 269.975 1.00 0.00 C +ATOM 184 CA ARG A 184 258.273 299.070 273.469 1.00 0.00 C +ATOM 185 CA ARG A 185 255.024 300.724 274.576 1.00 0.00 C +ATOM 186 CA ARG A 186 252.304 302.881 276.146 1.00 0.00 C +ATOM 187 CA GLY A 187 249.178 305.017 276.570 1.00 0.00 C +ATOM 188 CA LEU A 188 246.519 304.119 279.146 1.00 0.00 C +ATOM 189 CA ASP A 189 244.550 306.625 281.233 1.00 0.00 C +ATOM 190 CA SER A 190 245.277 309.782 283.240 1.00 0.00 C +ATOM 191 CA ASP A 191 243.762 309.234 286.692 1.00 0.00 C +ATOM 192 CA GLY A 192 241.365 309.214 289.653 1.00 0.00 C +ATOM 193 CA GLU A 193 237.710 308.204 290.030 1.00 0.00 C +ATOM 194 CA ARG A 194 235.614 311.088 288.687 1.00 0.00 C +ATOM 195 CA GLY A 195 234.312 314.626 289.236 1.00 0.00 C +ATOM 196 CA ARG A 196 232.873 316.521 286.261 1.00 0.00 C +ATOM 197 CA ARG A 197 235.529 317.096 283.590 1.00 0.00 C +ATOM 198 CA ALA A 198 238.874 317.644 285.331 1.00 0.00 C +ATOM 199 CA ALA A 199 241.317 320.039 283.653 1.00 0.00 C +ATOM 200 CA GLU A 200 244.362 322.019 282.506 1.00 0.00 C +ATOM 201 CA THR A 201 243.595 323.022 278.912 1.00 0.00 C +ATOM 202 CA LYS A 202 240.647 325.398 278.482 1.00 0.00 C +ATOM 203 CA GLU A 203 238.856 328.602 277.461 1.00 0.00 C +ATOM 204 CA GLY A 204 238.648 332.331 276.709 1.00 0.00 C +ATOM 205 CA SER A 205 238.444 332.758 272.928 1.00 0.00 C +ATOM 206 CA THR A 206 237.536 333.926 269.417 1.00 0.00 C +ATOM 207 CA GLY A 207 240.461 333.342 267.046 1.00 0.00 C +ATOM 208 CA ARG A 208 241.368 335.092 263.786 1.00 0.00 C +ATOM 209 CA VAL A 209 244.114 337.259 262.277 1.00 0.00 C +TER 210 VAL A 209 +END diff --git a/Plants/Q8S854/Q8S854.dcd b/Plants/Q8S854/Q8S854.dcd new file mode 100644 index 0000000000000000000000000000000000000000..6c52531f30f8fa0486685597d4166be827649525 --- /dev/null +++ b/Plants/Q8S854/Q8S854.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5f9da6639dee1b199f12a481fd886e1fa26c0edd3fc7a1390f3db23ff973b6c0 +size 16760276 diff --git a/Plants/Q8S854/top.pdb b/Plants/Q8S854/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..d95d1069aca646b0294a76f63696ece840b601a9 --- /dev/null +++ b/Plants/Q8S854/top.pdb @@ -0,0 +1,137 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 291.689 211.319 209.781 1.00 0.00 C +ATOM 2 CA VAL A 2 292.583 214.583 211.533 1.00 0.00 C +ATOM 3 CA THR A 3 291.525 217.670 213.499 1.00 0.00 C +ATOM 4 CA ALA A 4 288.411 219.027 215.224 1.00 0.00 C +ATOM 5 CA GLY A 5 288.235 222.389 217.009 1.00 0.00 C +ATOM 6 CA ASP A 6 284.985 224.271 216.367 1.00 0.00 C +ATOM 7 CA HIS A 7 281.362 223.709 215.333 1.00 0.00 C +ATOM 8 CA ARG A 8 279.284 226.827 214.643 1.00 0.00 C +ATOM 9 CA ARG A 9 280.626 230.341 214.036 1.00 0.00 C +ATOM 10 CA GLY A 10 281.262 233.602 212.171 1.00 0.00 C +ATOM 11 CA GLY A 11 279.720 233.048 208.731 1.00 0.00 C +ATOM 12 CA ALA A 12 278.487 230.531 206.151 1.00 0.00 C +ATOM 13 CA ALA A 13 276.627 231.893 203.118 1.00 0.00 C +ATOM 14 CA PRO A 14 272.856 232.381 203.362 1.00 0.00 C +ATOM 15 CA GLU A 15 271.595 235.555 205.050 1.00 0.00 C +ATOM 16 CA ARG A 16 271.304 235.817 208.840 1.00 0.00 C +ATOM 17 CA ALA A 17 268.138 236.968 210.619 1.00 0.00 C +ATOM 18 CA GLU A 18 265.888 239.548 208.946 1.00 0.00 C +ATOM 19 CA ARG A 19 263.347 242.104 207.711 1.00 0.00 C +ATOM 20 CA ARG A 20 262.350 245.328 205.942 1.00 0.00 C +ATOM 21 CA GLY A 21 262.641 249.082 206.521 1.00 0.00 C +ATOM 22 CA LYS A 22 264.024 251.314 203.760 1.00 0.00 C +ATOM 23 CA ALA A 23 265.052 254.712 202.375 1.00 0.00 C +ATOM 24 CA ASN A 24 266.624 255.116 198.928 1.00 0.00 C +ATOM 25 CA GLY A 25 268.847 258.176 198.468 1.00 0.00 C +ATOM 26 CA GLY A 26 266.604 261.254 198.553 1.00 0.00 C +ATOM 27 CA LEU A 27 267.270 264.790 199.805 1.00 0.00 C +ATOM 28 CA ARG A 28 268.628 267.632 201.950 1.00 0.00 C +ATOM 29 CA LEU A 29 270.814 270.748 201.799 1.00 0.00 C +ATOM 30 CA THR A 30 272.441 271.694 205.112 1.00 0.00 C +ATOM 31 CA PRO A 31 273.055 272.305 208.822 1.00 0.00 C +ATOM 32 CA GLY A 32 274.987 274.510 211.255 1.00 0.00 C +ATOM 33 CA GLN A 33 278.267 276.345 211.880 1.00 0.00 C +ATOM 34 CA ARG A 34 280.022 274.633 214.797 1.00 0.00 C +ATOM 35 CA ARG A 35 283.262 273.003 215.964 1.00 0.00 C +ATOM 36 CA ARG A 36 284.704 270.587 218.534 1.00 0.00 C +ATOM 37 CA ARG A 37 285.022 271.148 222.289 1.00 0.00 C +ATOM 38 CA GLU A 38 281.852 272.565 223.857 1.00 0.00 C +ATOM 39 CA ARG A 39 279.063 275.142 223.538 1.00 0.00 C +ATOM 40 CA ARG A 40 276.441 276.773 221.307 1.00 0.00 C +ATOM 41 CA PRO A 41 273.469 277.647 223.525 1.00 0.00 C +ATOM 42 CA GLU A 42 272.180 275.795 226.595 1.00 0.00 C +ATOM 43 CA ARG A 43 272.464 272.381 228.263 1.00 0.00 C +ATOM 44 CA ARG A 44 270.985 271.535 231.671 1.00 0.00 C +ATOM 45 CA LYS A 45 267.227 272.080 231.363 1.00 0.00 C +ATOM 46 CA ALA A 46 265.042 273.985 233.835 1.00 0.00 C +ATOM 47 CA ALA A 47 261.238 273.764 233.847 1.00 0.00 C +ATOM 48 CA ALA A 48 259.479 270.614 235.071 1.00 0.00 C +ATOM 49 CA ARG A 49 256.219 268.705 234.579 1.00 0.00 C +ATOM 50 CA PHE A 50 253.836 265.756 234.959 1.00 0.00 C +ATOM 51 CA GLY A 51 252.186 262.993 236.998 1.00 0.00 C +ATOM 52 CA MET A 52 251.024 260.656 239.774 1.00 0.00 C +ATOM 53 CA THR A 53 249.779 258.892 242.913 1.00 0.00 C +ATOM 54 CA MET A 54 250.612 255.432 244.272 1.00 0.00 C +ATOM 55 CA THR A 55 249.463 251.939 243.273 1.00 0.00 C +ATOM 56 CA THR A 56 246.064 251.014 244.725 1.00 0.00 C +ATOM 57 CA VAL A 57 242.798 251.405 246.647 1.00 0.00 C +ATOM 58 CA LEU A 58 241.036 253.960 248.857 1.00 0.00 C +ATOM 59 CA ARG A 59 237.816 252.907 250.602 1.00 0.00 C +ATOM 60 CA ARG A 60 236.852 252.993 254.287 1.00 0.00 C +ATOM 61 CA SER A 61 235.709 249.999 256.347 1.00 0.00 C +ATOM 62 CA ALA A 62 233.068 251.155 258.839 1.00 0.00 C +ATOM 63 CA GLY A 63 229.699 249.990 260.185 1.00 0.00 C +ATOM 64 CA GLU A 64 228.147 246.580 260.877 1.00 0.00 C +ATOM 65 CA ALA A 65 224.465 246.017 260.073 1.00 0.00 C +ATOM 66 CA GLU A 66 222.282 244.615 262.862 1.00 0.00 C +ATOM 67 CA ARG A 67 219.269 243.166 264.690 1.00 0.00 C +ATOM 68 CA ARG A 68 217.506 243.372 268.061 1.00 0.00 C +ATOM 69 CA THR A 69 215.370 245.210 270.625 1.00 0.00 C +ATOM 70 CA GLY A 70 213.795 248.132 268.756 1.00 0.00 C +ATOM 71 CA SER A 71 214.384 251.430 266.941 1.00 0.00 C +ATOM 72 CA ALA A 72 216.855 252.918 264.452 1.00 0.00 C +ATOM 73 CA ALA A 73 218.836 251.589 261.481 1.00 0.00 C +ATOM 74 CA THR A 74 222.614 251.958 261.153 1.00 0.00 C +ATOM 75 CA ARG A 75 223.714 254.784 263.460 1.00 0.00 C +ATOM 76 CA ARG A 76 223.064 257.141 266.381 1.00 0.00 C +ATOM 77 CA SER A 77 221.338 256.135 269.625 1.00 0.00 C +ATOM 78 CA GLY A 78 222.216 256.770 273.278 1.00 0.00 C +ATOM 79 CA TRP A 79 222.037 253.527 275.269 1.00 0.00 C +ATOM 80 CA ARG A 80 222.804 250.525 273.050 1.00 0.00 C +ATOM 81 CA CYS A 81 220.856 249.935 269.830 1.00 0.00 C +ATOM 82 CA ARG A 82 223.526 249.241 267.202 1.00 0.00 C +ATOM 83 CA ARG A 83 227.178 249.491 266.144 1.00 0.00 C +ATOM 84 CA VAL A 84 229.463 248.943 269.143 1.00 0.00 C +ATOM 85 CA GLY A 85 230.436 246.921 272.222 1.00 0.00 C +ATOM 86 CA ARG A 86 230.255 245.666 275.815 1.00 0.00 C +ATOM 87 CA ARG A 87 230.502 242.926 278.451 1.00 0.00 C +ATOM 88 CA THR A 88 232.275 239.598 278.997 1.00 0.00 C +ATOM 89 CA GLY A 89 231.135 238.053 282.287 1.00 0.00 C +ATOM 90 CA ALA A 90 230.493 240.319 285.282 1.00 0.00 C +ATOM 91 CA THR A 91 230.502 240.773 289.065 1.00 0.00 C +ATOM 92 CA THR A 92 228.328 239.375 291.864 1.00 0.00 C +ATOM 93 CA ALA A 93 229.072 239.364 295.601 1.00 0.00 C +ATOM 94 CA ALA A 94 231.725 241.340 297.491 1.00 0.00 C +ATOM 95 CA LYS A 95 232.163 241.796 301.248 1.00 0.00 C +ATOM 96 CA ARG A 96 229.087 242.535 303.370 1.00 0.00 C +ATOM 97 CA SER A 97 226.057 240.248 303.041 1.00 0.00 C +ATOM 98 CA SER A 98 226.826 236.545 303.499 1.00 0.00 C +ATOM 99 CA ALA A 99 225.384 233.698 301.418 1.00 0.00 C +ATOM 100 CA ALA A 100 226.140 230.513 299.468 1.00 0.00 C +ATOM 101 CA THR A 101 229.671 229.107 299.196 1.00 0.00 C +ATOM 102 CA ALA A 102 232.423 230.435 296.920 1.00 0.00 C +ATOM 103 CA GLU A 103 234.082 233.782 296.171 1.00 0.00 C +ATOM 104 CA ARG A 104 234.706 235.032 292.626 1.00 0.00 C +ATOM 105 CA GLU A 105 237.074 234.215 289.756 1.00 0.00 C +ATOM 106 CA GLU A 106 239.459 237.180 289.570 1.00 0.00 C +ATOM 107 CA HIS A 107 242.633 237.087 287.466 1.00 0.00 C +ATOM 108 CA GLY A 108 242.761 239.558 284.568 1.00 0.00 C +ATOM 109 CA ALA A 109 245.995 241.138 283.319 1.00 0.00 C +ATOM 110 CA SER A 110 247.573 243.039 280.419 1.00 0.00 C +ATOM 111 CA THR A 111 248.801 244.859 277.305 1.00 0.00 C +ATOM 112 CA ASP A 112 252.589 244.550 277.029 1.00 0.00 C +ATOM 113 CA PRO A 113 255.296 246.595 275.295 1.00 0.00 C +ATOM 114 CA THR A 114 255.792 245.847 271.592 1.00 0.00 C +ATOM 115 CA ALA A 115 252.477 244.626 270.165 1.00 0.00 C +ATOM 116 CA ARG A 116 249.520 246.710 271.359 1.00 0.00 C +ATOM 117 CA ALA A 117 246.041 245.431 270.477 1.00 0.00 C +ATOM 118 CA SER A 118 242.719 246.714 271.832 1.00 0.00 C +ATOM 119 CA GLY A 119 239.538 248.811 271.771 1.00 0.00 C +ATOM 120 CA GLU A 120 237.787 251.840 273.279 1.00 0.00 C +ATOM 121 CA ARG A 121 235.688 254.405 271.399 1.00 0.00 C +ATOM 122 CA ARG A 122 234.558 254.369 267.761 1.00 0.00 C +ATOM 123 CA LYS A 123 235.558 253.811 264.127 1.00 0.00 C +ATOM 124 CA ARG A 124 238.735 253.897 262.026 1.00 0.00 C +ATOM 125 CA LYS A 125 240.627 257.180 261.627 1.00 0.00 C +ATOM 126 CA SER A 126 243.851 258.928 260.594 1.00 0.00 C +ATOM 127 CA GLY A 127 246.125 261.937 260.057 1.00 0.00 C +ATOM 128 CA ALA A 128 249.645 262.964 261.091 1.00 0.00 C +ATOM 129 CA ARG A 129 252.858 263.245 259.062 1.00 0.00 C +ATOM 130 CA GLY A 130 255.815 265.602 259.530 1.00 0.00 C +ATOM 131 CA ALA A 131 259.229 265.492 261.218 1.00 0.00 C +ATOM 132 CA ILE A 132 260.848 262.639 263.155 1.00 0.00 C +ATOM 133 CA ILE A 133 261.288 263.790 266.761 1.00 0.00 C +TER 134 ILE A 133 +END diff --git a/Plants/Q8S8R1/Q8S8R1.dcd b/Plants/Q8S8R1/Q8S8R1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..9ed74eb4ea81a73acf082fe1ed15c3ca1af26af9 --- /dev/null +++ b/Plants/Q8S8R1/Q8S8R1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:093c2c3a69f55be7216fe9936ab50f3847a9a177f38e3e060afa24cc3ada94f6 +size 10760276 diff --git a/Plants/Q8S8R1/top.pdb b/Plants/Q8S8R1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..76c4afe85928f198f7368a80c079515d58e3a59e --- /dev/null +++ b/Plants/Q8S8R1/top.pdb @@ -0,0 +1,87 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 267.053 266.252 242.595 1.00 0.00 C +ATOM 2 CA GLU A 2 266.410 267.733 246.046 1.00 0.00 C +ATOM 3 CA ALA A 3 266.611 271.083 247.850 1.00 0.00 C +ATOM 4 CA GLY A 4 266.360 274.182 245.648 1.00 0.00 C +ATOM 5 CA LYS A 5 264.980 277.564 244.564 1.00 0.00 C +ATOM 6 CA THR A 6 267.323 280.560 244.796 1.00 0.00 C +ATOM 7 CA PRO A 7 270.855 281.355 245.983 1.00 0.00 C +ATOM 8 CA PRO A 8 273.831 281.640 243.622 1.00 0.00 C +ATOM 9 CA THR A 9 276.496 280.262 241.273 1.00 0.00 C +ATOM 10 CA THR A 10 277.769 277.101 239.570 1.00 0.00 C +ATOM 11 CA THR A 11 279.476 275.788 236.427 1.00 0.00 C +ATOM 12 CA THR A 12 281.332 278.632 234.701 1.00 0.00 C +ATOM 13 CA THR A 13 281.389 277.647 231.021 1.00 0.00 C +ATOM 14 CA THR A 14 282.734 274.299 229.797 1.00 0.00 C +ATOM 15 CA GLU A 15 285.065 272.351 232.097 1.00 0.00 C +ATOM 16 CA LYS A 16 283.736 270.601 235.210 1.00 0.00 C +ATOM 17 CA LYS A 17 285.800 270.140 238.379 1.00 0.00 C +ATOM 18 CA THR A 18 284.565 268.037 241.306 1.00 0.00 C +ATOM 19 CA GLU A 19 284.461 267.017 244.975 1.00 0.00 C +ATOM 20 CA GLN A 20 288.045 266.819 246.253 1.00 0.00 C +ATOM 21 CA VAL A 21 290.829 265.000 244.394 1.00 0.00 C +ATOM 22 CA LYS A 22 289.870 261.732 242.687 1.00 0.00 C +ATOM 23 CA ASP A 23 290.546 258.243 241.314 1.00 0.00 C +ATOM 24 CA ASN A 24 288.180 257.175 238.525 1.00 0.00 C +ATOM 25 CA ASP A 25 284.372 257.161 238.421 1.00 0.00 C +ATOM 26 CA LEU A 26 281.467 254.761 238.987 1.00 0.00 C +ATOM 27 CA PRO A 27 280.018 254.117 235.522 1.00 0.00 C +ATOM 28 CA THR A 28 277.034 253.525 233.229 1.00 0.00 C +ATOM 29 CA ASP A 29 277.218 256.292 230.616 1.00 0.00 C +ATOM 30 CA SER A 30 275.864 255.232 227.216 1.00 0.00 C +ATOM 31 CA PRO A 31 272.913 252.955 228.004 1.00 0.00 C +ATOM 32 CA TYR A 32 270.327 250.170 228.273 1.00 0.00 C +ATOM 33 CA MET A 33 266.708 249.070 227.815 1.00 0.00 C +ATOM 34 CA ALA A 34 263.817 250.888 226.126 1.00 0.00 C +ATOM 35 CA THR A 35 260.028 250.493 226.141 1.00 0.00 C +ATOM 36 CA GLY A 36 257.326 249.073 228.422 1.00 0.00 C +ATOM 37 CA THR A 37 255.407 246.806 230.808 1.00 0.00 C +ATOM 38 CA LEU A 38 251.629 246.681 230.336 1.00 0.00 C +ATOM 39 CA GLU A 39 248.078 246.805 231.711 1.00 0.00 C +ATOM 40 CA ASP A 40 245.333 244.463 232.935 1.00 0.00 C +ATOM 41 CA TYR A 41 243.923 240.991 232.249 1.00 0.00 C +ATOM 42 CA LYS A 42 243.952 238.029 234.645 1.00 0.00 C +ATOM 43 CA LEU A 43 241.074 237.388 237.058 1.00 0.00 C +ATOM 44 CA LYS A 44 239.985 235.563 240.221 1.00 0.00 C +ATOM 45 CA ALA A 45 236.262 236.297 240.554 1.00 0.00 C +ATOM 46 CA TYR A 46 233.586 237.318 238.041 1.00 0.00 C +ATOM 47 CA GLY A 47 229.904 236.494 238.575 1.00 0.00 C +ATOM 48 CA ALA A 48 229.201 235.347 242.140 1.00 0.00 C +ATOM 49 CA GLU A 49 227.107 234.869 245.286 1.00 0.00 C +ATOM 50 CA GLY A 50 224.486 233.130 247.436 1.00 0.00 C +ATOM 51 CA HIS A 51 225.859 232.770 250.972 1.00 0.00 C +ATOM 52 CA GLN A 52 229.248 233.397 252.596 1.00 0.00 C +ATOM 53 CA GLU A 53 230.468 231.925 255.892 1.00 0.00 C +ATOM 54 CA PRO A 54 231.879 228.537 256.912 1.00 0.00 C +ATOM 55 CA THR A 55 234.166 228.201 259.940 1.00 0.00 C +ATOM 56 CA PRO A 56 234.204 230.334 263.097 1.00 0.00 C +ATOM 57 CA GLY A 57 236.096 233.379 264.386 1.00 0.00 C +ATOM 58 CA LEU A 58 238.199 235.490 262.012 1.00 0.00 C +ATOM 59 CA GLY A 59 238.125 237.883 259.048 1.00 0.00 C +ATOM 60 CA GLY A 60 235.393 238.589 256.489 1.00 0.00 C +ATOM 61 CA GLY A 61 231.803 238.014 257.629 1.00 0.00 C +ATOM 62 CA SER A 62 231.786 238.191 261.435 1.00 0.00 C +ATOM 63 CA THR A 63 230.380 239.322 264.790 1.00 0.00 C +ATOM 64 CA ASP A 64 228.733 237.237 267.521 1.00 0.00 C +ATOM 65 CA ALA A 65 227.374 233.785 268.391 1.00 0.00 C +ATOM 66 CA PRO A 66 223.959 232.102 268.534 1.00 0.00 C +ATOM 67 CA THR A 67 222.552 231.551 272.032 1.00 0.00 C +ATOM 68 CA PRO A 68 221.452 234.485 274.199 1.00 0.00 C +ATOM 69 CA SER A 69 221.125 238.068 275.453 1.00 0.00 C +ATOM 70 CA GLY A 70 222.472 241.033 273.476 1.00 0.00 C +ATOM 71 CA ASP A 71 224.434 240.690 270.227 1.00 0.00 C +ATOM 72 CA ALA A 72 223.675 243.776 268.126 1.00 0.00 C +ATOM 73 CA PRO A 73 222.031 246.994 266.920 1.00 0.00 C +ATOM 74 CA ALA A 74 218.240 246.969 267.303 1.00 0.00 C +ATOM 75 CA ALA A 75 217.237 244.850 270.307 1.00 0.00 C +ATOM 76 CA THR A 76 217.735 245.485 274.030 1.00 0.00 C +ATOM 77 CA THR A 77 216.813 243.007 276.773 1.00 0.00 C +ATOM 78 CA THR A 78 218.186 243.249 280.319 1.00 0.00 C +ATOM 79 CA ASP A 79 216.542 243.391 283.753 1.00 0.00 C +ATOM 80 CA ALA A 80 218.314 242.648 287.042 1.00 0.00 C +ATOM 81 CA LYS A 81 217.355 240.062 289.671 1.00 0.00 C +ATOM 82 CA ALA A 82 216.867 236.539 291.037 1.00 0.00 C +ATOM 83 CA PRO A 83 216.560 232.918 289.892 1.00 0.00 C +TER 84 PRO A 83 +END diff --git a/Plants/Q8S9R3/Q8S9R3.dcd b/Plants/Q8S9R3/Q8S9R3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..1a2c36e9730273049bb1237cc04561f3c94b6d84 --- /dev/null +++ b/Plants/Q8S9R3/Q8S9R3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f8203ea9e96a84c952b97b7ae2bd3f961cc5dc7a8264495a05411df1e8f3c625 +size 8000276 diff --git a/Plants/Q8S9R3/top.pdb b/Plants/Q8S9R3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..3fa9c7fca70a1e90d0efb2f213f66fd24c83f672 --- /dev/null +++ b/Plants/Q8S9R3/top.pdb @@ -0,0 +1,64 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 243.789 223.292 228.599 1.00 0.00 C +ATOM 2 CA GLY A 2 246.112 220.275 228.704 1.00 0.00 C +ATOM 3 CA LEU A 3 247.964 220.567 232.021 1.00 0.00 C +ATOM 4 CA THR A 4 249.684 222.898 234.497 1.00 0.00 C +ATOM 5 CA HIS A 5 252.022 223.258 237.483 1.00 0.00 C +ATOM 6 CA ALA A 6 253.505 220.918 240.098 1.00 0.00 C +ATOM 7 CA PRO A 7 255.872 220.417 243.041 1.00 0.00 C +ATOM 8 CA PRO A 8 254.347 222.315 245.972 1.00 0.00 C +ATOM 9 CA PRO A 9 253.214 223.794 249.295 1.00 0.00 C +ATOM 10 CA ALA A 10 249.650 225.087 249.667 1.00 0.00 C +ATOM 11 CA GLY A 11 246.602 227.365 249.874 1.00 0.00 C +ATOM 12 CA PHE A 12 245.885 230.914 251.058 1.00 0.00 C +ATOM 13 CA LEU A 13 247.600 233.854 249.345 1.00 0.00 C +ATOM 14 CA PRO A 14 251.298 234.604 248.820 1.00 0.00 C +ATOM 15 CA PRO A 15 253.566 236.509 251.216 1.00 0.00 C +ATOM 16 CA PRO A 16 256.323 238.595 252.817 1.00 0.00 C +ATOM 17 CA ALA A 17 256.918 242.314 252.240 1.00 0.00 C +ATOM 18 CA ALA A 18 256.847 245.942 251.079 1.00 0.00 C +ATOM 19 CA SER A 19 254.816 248.408 249.003 1.00 0.00 C +ATOM 20 CA SER A 20 256.916 249.612 246.061 1.00 0.00 C +ATOM 21 CA HIS A 21 257.646 247.176 243.224 1.00 0.00 C +ATOM 22 CA ARG A 22 255.262 244.267 242.615 1.00 0.00 C +ATOM 23 CA ARG A 23 251.500 244.790 242.923 1.00 0.00 C +ATOM 24 CA GLY A 24 247.775 245.585 243.008 1.00 0.00 C +ATOM 25 CA SER A 25 246.378 248.378 240.825 1.00 0.00 C +ATOM 26 CA PRO A 26 246.243 251.012 238.076 1.00 0.00 C +ATOM 27 CA PRO A 27 247.242 254.673 237.743 1.00 0.00 C +ATOM 28 CA PRO A 28 248.711 255.749 241.090 1.00 0.00 C +ATOM 29 CA ALA A 29 250.015 252.909 243.268 1.00 0.00 C +ATOM 30 CA ALA A 30 248.367 251.761 246.506 1.00 0.00 C +ATOM 31 CA ALA A 31 247.890 254.433 249.179 1.00 0.00 C +ATOM 32 CA PHE A 32 251.006 255.668 250.990 1.00 0.00 C +ATOM 33 CA LEU A 33 252.090 255.942 254.632 1.00 0.00 C +ATOM 34 CA SER A 34 252.537 252.935 256.928 1.00 0.00 C +ATOM 35 CA ARG A 35 250.444 250.067 258.311 1.00 0.00 C +ATOM 36 CA ARG A 36 252.856 247.147 258.727 1.00 0.00 C +ATOM 37 CA LEU A 37 256.236 248.479 259.876 1.00 0.00 C +ATOM 38 CA SER A 38 258.537 251.273 258.687 1.00 0.00 C +ATOM 39 CA ARG A 39 258.480 254.797 260.133 1.00 0.00 C +ATOM 40 CA ARG A 40 261.141 257.469 259.588 1.00 0.00 C +ATOM 41 CA PRO A 41 260.683 259.845 256.646 1.00 0.00 C +ATOM 42 CA PRO A 42 257.288 259.649 254.927 1.00 0.00 C +ATOM 43 CA ARG A 43 256.562 262.067 252.073 1.00 0.00 C +ATOM 44 CA SER A 44 255.117 265.580 252.357 1.00 0.00 C +ATOM 45 CA SER A 45 251.584 266.501 253.448 1.00 0.00 C +ATOM 46 CA PRO A 46 249.904 269.819 252.621 1.00 0.00 C +ATOM 47 CA ALA A 47 248.678 273.244 251.491 1.00 0.00 C +ATOM 48 CA PRO A 48 248.148 276.992 251.926 1.00 0.00 C +ATOM 49 CA ALA A 49 246.060 279.170 254.253 1.00 0.00 C +ATOM 50 CA ALA A 50 244.605 276.857 256.907 1.00 0.00 C +ATOM 51 CA GLU A 51 243.626 273.843 259.023 1.00 0.00 C +ATOM 52 CA LEU A 52 240.326 273.936 260.925 1.00 0.00 C +ATOM 53 CA VAL A 53 236.586 273.653 261.597 1.00 0.00 C +ATOM 54 CA ALA A 54 235.025 270.187 261.857 1.00 0.00 C +ATOM 55 CA SER A 55 237.243 267.154 261.227 1.00 0.00 C +ATOM 56 CA LEU A 56 240.493 266.335 259.415 1.00 0.00 C +ATOM 57 CA ALA A 57 240.295 265.716 255.661 1.00 0.00 C +ATOM 58 CA GLY A 58 241.262 262.080 255.066 1.00 0.00 C +ATOM 59 CA HIS A 59 245.022 261.527 254.800 1.00 0.00 C +ATOM 60 CA LEU A 60 248.207 260.395 256.558 1.00 0.00 C +TER 61 LEU A 60 +END diff --git a/Plants/Q8SAR8/Q8SAR8.dcd b/Plants/Q8SAR8/Q8SAR8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..cf287b06ee16bd2637e6920021b16bc5e1f060ea --- /dev/null +++ b/Plants/Q8SAR8/Q8SAR8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:aa66273befc2ce624ed70b5334f1c77add32f00504059bb8dc8f02ce63ceeb6e +size 17480276 diff --git a/Plants/Q8SAR8/top.pdb b/Plants/Q8SAR8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..3c1c49c0bd54f0e166a8b1cb9c02ff423bdd3a99 --- /dev/null +++ b/Plants/Q8SAR8/top.pdb @@ -0,0 +1,143 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA SER A 1 237.948 272.670 269.786 1.00 0.00 C +ATOM 2 CA SER A 2 241.197 274.278 270.959 1.00 0.00 C +ATOM 3 CA SER A 3 242.361 277.880 270.533 1.00 0.00 C +ATOM 4 CA SER A 4 241.200 279.391 267.233 1.00 0.00 C +ATOM 5 CA SER A 5 237.837 281.175 267.398 1.00 0.00 C +ATOM 6 CA SER A 6 237.338 283.430 264.368 1.00 0.00 C +ATOM 7 CA SER A 7 240.068 282.581 261.849 1.00 0.00 C +ATOM 8 CA ASP A 8 241.021 283.472 258.269 1.00 0.00 C +ATOM 9 CA GLU A 9 244.535 282.458 257.201 1.00 0.00 C +ATOM 10 CA GLU A 10 247.288 281.347 259.590 1.00 0.00 C +ATOM 11 CA GLY A 11 250.238 282.504 261.705 1.00 0.00 C +ATOM 12 CA GLU A 12 252.970 279.913 262.292 1.00 0.00 C +ATOM 13 CA GLY A 13 254.204 277.352 259.755 1.00 0.00 C +ATOM 14 CA GLY A 14 253.943 273.688 260.764 1.00 0.00 C +ATOM 15 CA LYS A 15 254.053 271.638 257.554 1.00 0.00 C +ATOM 16 CA LYS A 16 257.365 271.277 255.706 1.00 0.00 C +ATOM 17 CA LYS A 17 256.979 268.265 253.406 1.00 0.00 C +ATOM 18 CA GLU A 18 257.970 265.287 251.245 1.00 0.00 C +ATOM 19 CA GLY A 19 256.337 262.236 252.837 1.00 0.00 C +ATOM 20 CA GLY A 20 254.488 261.351 256.049 1.00 0.00 C +ATOM 21 CA ARG A 21 254.666 261.813 259.827 1.00 0.00 C +ATOM 22 CA LYS A 22 253.516 263.227 263.172 1.00 0.00 C +ATOM 23 CA LYS A 23 253.615 260.753 266.068 1.00 0.00 C +ATOM 24 CA LYS A 24 250.025 260.160 267.197 1.00 0.00 C +ATOM 25 CA GLY A 25 249.600 261.777 270.620 1.00 0.00 C +ATOM 26 CA SER A 26 251.145 262.594 274.005 1.00 0.00 C +ATOM 27 CA LYS A 27 252.760 261.510 277.282 1.00 0.00 C +ATOM 28 CA ASP A 28 254.952 258.470 276.599 1.00 0.00 C +ATOM 29 CA LYS A 29 253.497 256.688 273.562 1.00 0.00 C +ATOM 30 CA THR A 30 250.109 255.090 272.864 1.00 0.00 C +ATOM 31 CA LYS A 31 248.919 251.474 272.702 1.00 0.00 C +ATOM 32 CA GLU A 32 246.228 248.964 273.689 1.00 0.00 C +ATOM 33 CA LYS A 33 244.300 248.754 276.969 1.00 0.00 C +ATOM 34 CA LEU A 34 244.479 247.728 280.634 1.00 0.00 C +ATOM 35 CA PRO A 35 245.095 249.173 284.105 1.00 0.00 C +ATOM 36 CA GLY A 36 244.305 252.472 285.839 1.00 0.00 C +ATOM 37 CA ALA A 37 245.088 255.259 288.317 1.00 0.00 C +ATOM 38 CA GLY A 38 244.323 258.718 289.719 1.00 0.00 C +ATOM 39 CA GLN A 39 246.070 262.097 289.510 1.00 0.00 C +ATOM 40 CA HIS A 40 248.717 264.539 288.264 1.00 0.00 C +ATOM 41 CA SER A 41 250.634 266.964 290.491 1.00 0.00 C +ATOM 42 CA SER A 42 251.006 270.720 289.970 1.00 0.00 C +ATOM 43 CA ASP A 43 247.976 272.855 289.090 1.00 0.00 C +ATOM 44 CA GLN A 44 245.205 275.461 288.871 1.00 0.00 C +ATOM 45 CA CYS A 45 242.601 277.024 286.571 1.00 0.00 C +ATOM 46 CA GLY A 46 238.803 277.196 286.819 1.00 0.00 C +ATOM 47 CA GLY A 47 237.248 274.358 284.810 1.00 0.00 C +ATOM 48 CA LYS A 48 238.097 272.661 281.505 1.00 0.00 C +ATOM 49 CA GLU A 49 238.642 271.913 277.810 1.00 0.00 C +ATOM 50 CA GLU A 50 235.665 270.990 275.618 1.00 0.00 C +ATOM 51 CA LYS A 51 231.870 270.886 275.303 1.00 0.00 C +ATOM 52 CA LYS A 52 229.981 269.605 272.253 1.00 0.00 C +ATOM 53 CA THR A 53 227.042 267.383 273.224 1.00 0.00 C +ATOM 54 CA GLY A 54 223.567 267.045 274.750 1.00 0.00 C +ATOM 55 CA LEU A 55 220.332 265.036 274.640 1.00 0.00 C +ATOM 56 CA LEU A 56 218.790 264.809 271.164 1.00 0.00 C +ATOM 57 CA ASP A 57 221.256 264.957 268.263 1.00 0.00 C +ATOM 58 CA LYS A 58 224.290 265.074 265.962 1.00 0.00 C +ATOM 59 CA ILE A 59 227.915 264.194 266.736 1.00 0.00 C +ATOM 60 CA LYS A 60 231.718 264.166 266.504 1.00 0.00 C +ATOM 61 CA GLU A 61 233.478 260.841 265.903 1.00 0.00 C +ATOM 62 CA LYS A 62 235.084 257.444 265.269 1.00 0.00 C +ATOM 63 CA ILE A 63 236.526 256.217 261.963 1.00 0.00 C +ATOM 64 CA PRO A 64 240.093 255.774 260.701 1.00 0.00 C +ATOM 65 CA GLY A 65 242.225 256.687 257.677 1.00 0.00 C +ATOM 66 CA HIS A 66 243.934 258.683 254.919 1.00 0.00 C +ATOM 67 CA GLN A 67 245.208 258.035 251.387 1.00 0.00 C +ATOM 68 CA GLU A 68 244.508 256.817 247.846 1.00 0.00 C +ATOM 69 CA LYS A 69 246.758 254.426 245.913 1.00 0.00 C +ATOM 70 CA LEU A 70 245.639 251.209 244.206 1.00 0.00 C +ATOM 71 CA SER A 71 242.905 248.561 244.377 1.00 0.00 C +ATOM 72 CA GLY A 72 239.664 250.363 243.502 1.00 0.00 C +ATOM 73 CA GLY A 73 240.056 254.121 243.993 1.00 0.00 C +ATOM 74 CA GLY A 74 237.997 256.127 246.493 1.00 0.00 C +ATOM 75 CA THR A 75 234.810 254.925 248.199 1.00 0.00 C +ATOM 76 CA HIS A 76 235.187 253.426 251.681 1.00 0.00 C +ATOM 77 CA SER A 77 238.506 252.390 253.239 1.00 0.00 C +ATOM 78 CA SER A 78 242.286 252.838 253.069 1.00 0.00 C +ATOM 79 CA ASP A 79 245.460 250.820 252.458 1.00 0.00 C +ATOM 80 CA GLU A 80 247.393 247.684 251.488 1.00 0.00 C +ATOM 81 CA CYS A 81 248.603 244.810 249.298 1.00 0.00 C +ATOM 82 CA GLY A 82 249.217 241.704 247.180 1.00 0.00 C +ATOM 83 CA GLY A 83 249.112 242.951 243.582 1.00 0.00 C +ATOM 84 CA LYS A 84 246.914 241.668 240.746 1.00 0.00 C +ATOM 85 CA GLU A 85 244.857 239.751 238.175 1.00 0.00 C +ATOM 86 CA GLU A 86 245.162 237.056 235.500 1.00 0.00 C +ATOM 87 CA LYS A 87 242.630 234.546 234.155 1.00 0.00 C +ATOM 88 CA LYS A 88 241.199 234.031 230.662 1.00 0.00 C +ATOM 89 CA THR A 89 244.160 234.388 228.292 1.00 0.00 C +ATOM 90 CA GLY A 90 246.247 236.109 225.609 1.00 0.00 C +ATOM 91 CA LEU A 91 248.460 237.280 222.737 1.00 0.00 C +ATOM 92 CA LEU A 92 250.595 234.907 220.656 1.00 0.00 C +ATOM 93 CA ASP A 93 254.176 236.087 220.106 1.00 0.00 C +ATOM 94 CA LYS A 94 256.806 237.979 222.110 1.00 0.00 C +ATOM 95 CA ILE A 95 260.554 237.852 222.782 1.00 0.00 C +ATOM 96 CA LYS A 96 263.316 240.421 223.317 1.00 0.00 C +ATOM 97 CA GLU A 97 265.357 242.821 225.460 1.00 0.00 C +ATOM 98 CA LYS A 98 267.552 245.785 226.414 1.00 0.00 C +ATOM 99 CA ILE A 99 267.160 248.652 228.893 1.00 0.00 C +ATOM 100 CA PRO A 100 269.832 248.968 231.590 1.00 0.00 C +ATOM 101 CA GLY A 101 272.900 247.033 230.425 1.00 0.00 C +ATOM 102 CA HIS A 102 274.712 244.417 228.330 1.00 0.00 C +ATOM 103 CA GLN A 103 276.188 241.642 226.178 1.00 0.00 C +ATOM 104 CA GLU A 104 274.235 238.389 225.829 1.00 0.00 C +ATOM 105 CA LYS A 105 275.380 234.793 225.306 1.00 0.00 C +ATOM 106 CA LEU A 106 276.281 231.132 224.754 1.00 0.00 C +ATOM 107 CA PRO A 107 274.749 228.226 226.683 1.00 0.00 C +ATOM 108 CA GLY A 108 273.782 225.488 224.217 1.00 0.00 C +ATOM 109 CA ASP A 109 271.264 222.658 224.621 1.00 0.00 C +ATOM 110 CA GLY A 110 269.180 219.512 225.151 1.00 0.00 C +ATOM 111 CA LYS A 111 265.601 219.283 226.435 1.00 0.00 C +ATOM 112 CA HIS A 112 265.087 219.339 230.210 1.00 0.00 C +ATOM 113 CA SER A 113 265.819 221.809 233.018 1.00 0.00 C +ATOM 114 CA SER A 114 267.030 220.484 236.378 1.00 0.00 C +ATOM 115 CA ASP A 115 268.406 218.095 239.008 1.00 0.00 C +ATOM 116 CA GLU A 116 265.723 215.844 240.508 1.00 0.00 C +ATOM 117 CA HIS A 117 262.663 216.316 238.288 1.00 0.00 C +ATOM 118 CA GLY A 118 259.211 214.716 238.489 1.00 0.00 C +ATOM 119 CA GLY A 119 256.547 215.470 235.872 1.00 0.00 C +ATOM 120 CA GLU A 120 256.651 219.080 234.657 1.00 0.00 C +ATOM 121 CA GLU A 121 254.921 219.121 231.262 1.00 0.00 C +ATOM 122 CA GLU A 122 251.542 219.974 229.721 1.00 0.00 C +ATOM 123 CA LYS A 123 249.703 216.742 228.889 1.00 0.00 C +ATOM 124 CA LYS A 124 249.838 213.572 226.780 1.00 0.00 C +ATOM 125 CA LEU A 125 251.156 214.086 223.243 1.00 0.00 C +ATOM 126 CA GLY A 126 250.194 216.482 220.441 1.00 0.00 C +ATOM 127 CA VAL A 127 250.419 219.936 218.848 1.00 0.00 C +ATOM 128 CA LEU A 128 251.504 222.836 216.628 1.00 0.00 C +ATOM 129 CA GLY A 129 254.392 225.313 216.437 1.00 0.00 C +ATOM 130 CA LYS A 130 257.892 226.654 215.751 1.00 0.00 C +ATOM 131 CA ILE A 131 260.570 229.330 216.184 1.00 0.00 C +ATOM 132 CA LYS A 132 264.325 228.851 216.618 1.00 0.00 C +ATOM 133 CA GLU A 133 266.211 231.198 218.953 1.00 0.00 C +ATOM 134 CA LYS A 134 267.458 234.002 216.695 1.00 0.00 C +ATOM 135 CA LEU A 135 265.296 236.055 214.322 1.00 0.00 C +ATOM 136 CA PRO A 136 261.505 236.420 214.242 1.00 0.00 C +ATOM 137 CA GLY A 137 257.942 235.188 213.688 1.00 0.00 C +ATOM 138 CA HIS A 138 254.946 237.501 213.248 1.00 0.00 C +ATOM 139 CA LYS A 139 255.768 241.111 212.351 1.00 0.00 C +TER 140 LYS A 139 +END diff --git a/Plants/Q8SAS0/Q8SAS0.dcd b/Plants/Q8SAS0/Q8SAS0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..80d5e88ff20b2a5946102fd6d99628bd228b46f5 --- /dev/null +++ b/Plants/Q8SAS0/Q8SAS0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e750529b91550d953f60a0caddfd71cdeeeef57392a39cc7becc6c30da195896 +size 6560276 diff --git a/Plants/Q8SAS0/top.pdb b/Plants/Q8SAS0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..1d49494db52de48588d4b5d8259aea9f43766603 --- /dev/null +++ b/Plants/Q8SAS0/top.pdb @@ -0,0 +1,52 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA ALA A 1 263.465 254.498 247.069 1.00 0.00 C +ATOM 2 CA TYR A 2 267.107 253.816 247.956 1.00 0.00 C +ATOM 3 CA ASP A 3 267.734 252.850 251.588 1.00 0.00 C +ATOM 4 CA MET A 4 270.532 250.795 253.159 1.00 0.00 C +ATOM 5 CA ARG A 5 273.252 248.962 251.222 1.00 0.00 C +ATOM 6 CA LYS A 6 273.246 246.900 248.018 1.00 0.00 C +ATOM 7 CA GLN A 7 269.795 245.637 247.012 1.00 0.00 C +ATOM 8 CA LEU A 8 267.218 243.391 245.329 1.00 0.00 C +ATOM 9 CA THR A 9 264.318 245.624 244.269 1.00 0.00 C +ATOM 10 CA VAL A 10 260.676 245.518 245.383 1.00 0.00 C +ATOM 11 CA LYS A 11 259.895 242.719 247.847 1.00 0.00 C +ATOM 12 CA SER A 12 256.275 242.154 248.892 1.00 0.00 C +ATOM 13 CA ASP A 13 252.592 242.870 248.230 1.00 0.00 C +ATOM 14 CA GLY A 14 250.214 239.894 248.293 1.00 0.00 C +ATOM 15 CA LYS A 15 248.551 237.993 245.441 1.00 0.00 C +ATOM 16 CA HIS A 16 246.844 234.817 244.210 1.00 0.00 C +ATOM 17 CA HIS A 17 246.871 232.634 241.087 1.00 0.00 C +ATOM 18 CA HIS A 18 243.493 232.818 239.335 1.00 0.00 C +ATOM 19 CA HIS A 19 240.001 234.173 240.031 1.00 0.00 C +ATOM 20 CA HIS A 20 239.030 237.845 240.324 1.00 0.00 C +ATOM 21 CA HIS A 21 239.756 240.939 238.221 1.00 0.00 C +ATOM 22 CA HIS A 22 239.264 243.888 240.582 1.00 0.00 C +ATOM 23 CA GLN A 23 242.199 245.892 241.954 1.00 0.00 C +ATOM 24 CA HIS A 24 241.630 246.949 245.570 1.00 0.00 C +ATOM 25 CA SER A 25 239.027 249.648 246.245 1.00 0.00 C +ATOM 26 CA GLY A 26 235.530 249.096 244.839 1.00 0.00 C +ATOM 27 CA ALA A 27 231.721 249.077 244.725 1.00 0.00 C +ATOM 28 CA CYS A 28 229.020 247.097 246.541 1.00 0.00 C +ATOM 29 CA CYS A 29 229.189 247.041 250.347 1.00 0.00 C +ATOM 30 CA GLY A 30 230.708 249.272 253.036 1.00 0.00 C +ATOM 31 CA GLY A 31 234.022 250.626 251.731 1.00 0.00 C +ATOM 32 CA ASP A 32 235.137 253.888 250.110 1.00 0.00 C +ATOM 33 CA GLY A 33 237.836 256.048 251.713 1.00 0.00 C +ATOM 34 CA SER A 34 240.178 254.763 254.429 1.00 0.00 C +ATOM 35 CA ASP A 35 242.968 257.192 255.338 1.00 0.00 C +ATOM 36 CA GLY A 36 244.441 260.316 253.729 1.00 0.00 C +ATOM 37 CA LYS A 37 245.707 259.806 250.172 1.00 0.00 C +ATOM 38 CA LEU A 38 249.480 259.278 250.148 1.00 0.00 C +ATOM 39 CA GLN A 39 251.490 261.908 252.034 1.00 0.00 C +ATOM 40 CA SER A 40 253.764 260.677 254.833 1.00 0.00 C +ATOM 41 CA ALA A 41 256.655 262.864 256.005 1.00 0.00 C +ATOM 42 CA ALA A 42 259.172 261.026 258.197 1.00 0.00 C +ATOM 43 CA ASP A 43 261.492 261.816 261.114 1.00 0.00 C +ATOM 44 CA LYS A 44 259.589 263.317 264.054 1.00 0.00 C +ATOM 45 CA LYS A 45 256.406 263.676 266.117 1.00 0.00 C +ATOM 46 CA SER A 46 253.854 260.847 266.151 1.00 0.00 C +ATOM 47 CA LYS A 47 250.588 259.705 264.557 1.00 0.00 C +ATOM 48 CA GLU A 48 248.068 257.439 262.816 1.00 0.00 C +TER 49 GLU A 48 +END diff --git a/Plants/Q8SB20/Q8SB20.dcd b/Plants/Q8SB20/Q8SB20.dcd new file mode 100644 index 0000000000000000000000000000000000000000..c58e8dbbf388ff257f32d71642844968797bf41b --- /dev/null +++ b/Plants/Q8SB20/Q8SB20.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:de75bbf17eccf9a7dca392bd6c581eeec286f7fc6e524664112ce083a5032e26 +size 17720276 diff --git a/Plants/Q8SB20/top.pdb b/Plants/Q8SB20/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..11e21eb830b99a02074fe98f7d97dc3a7c57271c --- /dev/null +++ b/Plants/Q8SB20/top.pdb @@ -0,0 +1,145 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 227.598 280.990 220.089 1.00 0.00 C +ATOM 2 CA GLY A 2 228.915 277.420 219.891 1.00 0.00 C +ATOM 3 CA GLY A 3 232.686 277.572 219.370 1.00 0.00 C +ATOM 4 CA ALA A 4 235.325 280.226 218.659 1.00 0.00 C +ATOM 5 CA SER A 5 238.148 281.834 220.650 1.00 0.00 C +ATOM 6 CA TRP A 6 238.430 283.649 223.988 1.00 0.00 C +ATOM 7 CA THR A 7 239.875 287.119 223.368 1.00 0.00 C +ATOM 8 CA LYS A 8 240.264 290.870 222.829 1.00 0.00 C +ATOM 9 CA VAL A 9 243.369 293.075 222.692 1.00 0.00 C +ATOM 10 CA ARG A 10 245.940 294.660 225.014 1.00 0.00 C +ATOM 11 CA GLU A 11 246.744 298.382 225.134 1.00 0.00 C +ATOM 12 CA ASP A 12 247.162 301.983 223.963 1.00 0.00 C +ATOM 13 CA ALA A 13 250.676 303.153 224.859 1.00 0.00 C +ATOM 14 CA LEU A 14 253.001 304.701 227.450 1.00 0.00 C +ATOM 15 CA GLU A 15 254.432 303.904 230.890 1.00 0.00 C +ATOM 16 CA THR A 16 252.049 302.123 233.271 1.00 0.00 C +ATOM 17 CA LYS A 17 253.419 298.680 234.152 1.00 0.00 C +ATOM 18 CA THR A 18 253.497 294.875 234.340 1.00 0.00 C +ATOM 19 CA VAL A 19 251.299 293.612 237.184 1.00 0.00 C +ATOM 20 CA THR A 20 252.894 291.479 239.908 1.00 0.00 C +ATOM 21 CA GLN A 21 251.806 290.086 243.284 1.00 0.00 C +ATOM 22 CA SER A 22 251.449 287.251 245.804 1.00 0.00 C +ATOM 23 CA ARG A 23 250.868 283.486 245.890 1.00 0.00 C +ATOM 24 CA GLN A 24 247.536 282.297 247.303 1.00 0.00 C +ATOM 25 CA SER A 25 247.422 278.640 248.366 1.00 0.00 C +ATOM 26 CA LEU A 26 244.279 276.883 247.120 1.00 0.00 C +ATOM 27 CA ARG A 27 243.886 273.137 246.549 1.00 0.00 C +ATOM 28 CA LYS A 28 246.688 271.346 248.407 1.00 0.00 C +ATOM 29 CA MET A 29 248.023 268.785 250.893 1.00 0.00 C +ATOM 30 CA THR A 30 248.846 267.013 254.164 1.00 0.00 C +ATOM 31 CA PRO A 31 248.292 266.865 257.930 1.00 0.00 C +ATOM 32 CA LYS A 32 246.403 267.240 261.218 1.00 0.00 C +ATOM 33 CA SER A 33 246.809 267.001 264.999 1.00 0.00 C +ATOM 34 CA GLN A 34 244.513 268.574 267.601 1.00 0.00 C +ATOM 35 CA CYS A 35 243.489 272.222 267.998 1.00 0.00 C +ATOM 36 CA SER A 36 240.678 272.752 270.516 1.00 0.00 C +ATOM 37 CA ARG A 37 239.562 275.200 273.213 1.00 0.00 C +ATOM 38 CA THR A 38 240.184 273.515 276.573 1.00 0.00 C +ATOM 39 CA VAL A 39 237.319 272.834 278.991 1.00 0.00 C +ATOM 40 CA LYS A 40 233.739 272.911 277.689 1.00 0.00 C +ATOM 41 CA ASP A 41 232.583 275.294 274.950 1.00 0.00 C +ATOM 42 CA GLU A 42 233.283 275.527 271.212 1.00 0.00 C +ATOM 43 CA THR A 43 233.768 276.700 267.620 1.00 0.00 C +ATOM 44 CA SER A 44 231.147 276.111 264.919 1.00 0.00 C +ATOM 45 CA HIS A 45 228.427 274.262 262.996 1.00 0.00 C +ATOM 46 CA ARG A 46 228.531 271.415 260.466 1.00 0.00 C +ATOM 47 CA VAL A 47 230.992 268.836 259.120 1.00 0.00 C +ATOM 48 CA CYS A 48 231.454 266.196 256.412 1.00 0.00 C +ATOM 49 CA GLN A 49 234.655 264.210 255.841 1.00 0.00 C +ATOM 50 CA THR A 50 237.307 261.515 255.373 1.00 0.00 C +ATOM 51 CA PRO A 51 240.852 260.870 256.612 1.00 0.00 C +ATOM 52 CA GLY A 52 244.228 260.069 255.038 1.00 0.00 C +ATOM 53 CA GLN A 53 244.754 259.224 251.361 1.00 0.00 C +ATOM 54 CA LEU A 54 248.018 257.882 249.923 1.00 0.00 C +ATOM 55 CA ARG A 55 249.079 254.970 252.138 1.00 0.00 C +ATOM 56 CA THR A 56 251.375 252.494 250.374 1.00 0.00 C +ATOM 57 CA ASN A 57 249.763 249.330 248.994 1.00 0.00 C +ATOM 58 CA ALA A 58 248.120 246.241 247.484 1.00 0.00 C +ATOM 59 CA HIS A 59 249.304 242.780 248.548 1.00 0.00 C +ATOM 60 CA ALA A 60 247.349 239.718 249.699 1.00 0.00 C +ATOM 61 CA SER A 61 244.210 237.611 250.168 1.00 0.00 C +ATOM 62 CA VAL A 62 240.882 236.445 248.726 1.00 0.00 C +ATOM 63 CA SER A 63 239.065 236.534 245.378 1.00 0.00 C +ATOM 64 CA ASN A 64 240.494 235.879 241.907 1.00 0.00 C +ATOM 65 CA THR A 65 242.955 236.463 239.057 1.00 0.00 C +ATOM 66 CA ALA A 66 243.719 234.600 235.823 1.00 0.00 C +ATOM 67 CA TRP A 67 247.443 234.081 235.205 1.00 0.00 C +ATOM 68 CA ALA A 68 251.198 234.378 235.775 1.00 0.00 C +ATOM 69 CA ARG A 69 252.672 236.928 233.358 1.00 0.00 C +ATOM 70 CA GLN A 70 255.626 237.231 230.971 1.00 0.00 C +ATOM 71 CA GLY A 71 257.220 238.942 227.963 1.00 0.00 C +ATOM 72 CA THR A 72 259.355 242.026 227.296 1.00 0.00 C +ATOM 73 CA THR A 73 263.071 241.558 227.998 1.00 0.00 C +ATOM 74 CA MET A 74 264.032 242.347 231.599 1.00 0.00 C +ATOM 75 CA ASN A 75 264.587 245.640 233.434 1.00 0.00 C +ATOM 76 CA HIS A 76 267.099 245.187 236.263 1.00 0.00 C +ATOM 77 CA LYS A 77 265.682 246.717 239.451 1.00 0.00 C +ATOM 78 CA PRO A 78 266.940 248.757 242.413 1.00 0.00 C +ATOM 79 CA MET A 79 270.388 250.102 241.507 1.00 0.00 C +ATOM 80 CA LEU A 80 272.641 252.013 243.913 1.00 0.00 C +ATOM 81 CA LYS A 81 271.302 253.140 247.298 1.00 0.00 C +ATOM 82 CA GLU A 82 272.069 251.997 250.850 1.00 0.00 C +ATOM 83 CA THR A 83 274.398 249.925 253.041 1.00 0.00 C +ATOM 84 CA SER A 84 273.561 247.272 255.644 1.00 0.00 C +ATOM 85 CA ARG A 85 273.295 243.806 257.204 1.00 0.00 C +ATOM 86 CA GLU A 86 271.058 242.934 260.163 1.00 0.00 C +ATOM 87 CA ASP A 87 268.450 243.529 262.876 1.00 0.00 C +ATOM 88 CA LEU A 88 266.052 245.114 265.377 1.00 0.00 C +ATOM 89 CA TRP A 89 262.728 246.925 265.806 1.00 0.00 C +ATOM 90 CA ASN A 90 260.509 247.859 268.759 1.00 0.00 C +ATOM 91 CA GLY A 91 256.796 248.712 268.760 1.00 0.00 C +ATOM 92 CA ARG A 92 254.866 246.490 266.342 1.00 0.00 C +ATOM 93 CA ASN A 93 253.705 244.349 263.411 1.00 0.00 C +ATOM 94 CA ALA A 94 251.879 241.136 262.486 1.00 0.00 C +ATOM 95 CA ARG A 95 254.165 238.355 261.238 1.00 0.00 C +ATOM 96 CA THR A 96 256.313 239.430 258.281 1.00 0.00 C +ATOM 97 CA THR A 97 257.792 236.714 256.057 1.00 0.00 C +ATOM 98 CA GLY A 98 261.429 235.762 255.441 1.00 0.00 C +ATOM 99 CA GLU A 99 263.596 233.538 257.650 1.00 0.00 C +ATOM 100 CA LYS A 100 264.440 229.830 257.423 1.00 0.00 C +ATOM 101 CA SER A 101 267.687 228.522 255.919 1.00 0.00 C +ATOM 102 CA THR A 102 267.588 224.989 254.495 1.00 0.00 C +ATOM 103 CA GLY A 103 264.489 223.761 252.651 1.00 0.00 C +ATOM 104 CA ASP A 104 261.081 223.348 250.998 1.00 0.00 C +ATOM 105 CA VAL A 105 257.898 224.290 252.870 1.00 0.00 C +ATOM 106 CA ALA A 106 257.016 225.864 256.225 1.00 0.00 C +ATOM 107 CA MET A 107 255.932 224.076 259.410 1.00 0.00 C +ATOM 108 CA LEU A 108 255.465 223.479 263.144 1.00 0.00 C +ATOM 109 CA ARG A 109 257.442 223.255 266.393 1.00 0.00 C +ATOM 110 CA ARG A 110 259.832 225.073 268.737 1.00 0.00 C +ATOM 111 CA ALA A 111 261.514 226.857 271.654 1.00 0.00 C +ATOM 112 CA PRO A 112 260.592 229.200 274.513 1.00 0.00 C +ATOM 113 CA VAL A 113 258.695 228.902 277.804 1.00 0.00 C +ATOM 114 CA SER A 114 256.996 227.002 280.636 1.00 0.00 C +ATOM 115 CA THR A 115 256.231 223.522 279.288 1.00 0.00 C +ATOM 116 CA ALA A 116 257.962 220.570 277.613 1.00 0.00 C +ATOM 117 CA THR A 117 255.854 218.741 275.020 1.00 0.00 C +ATOM 118 CA THR A 118 252.859 216.822 273.655 1.00 0.00 C +ATOM 119 CA SER A 119 249.785 217.408 271.482 1.00 0.00 C +ATOM 120 CA GLY A 120 248.367 220.900 270.926 1.00 0.00 C +ATOM 121 CA GLY A 121 249.829 223.227 268.286 1.00 0.00 C +ATOM 122 CA VAL A 122 248.446 222.532 264.805 1.00 0.00 C +ATOM 123 CA ASP A 123 247.041 220.215 262.126 1.00 0.00 C +ATOM 124 CA HIS A 124 248.815 218.032 259.557 1.00 0.00 C +ATOM 125 CA ARG A 125 250.134 215.487 257.047 1.00 0.00 C +ATOM 126 CA GLN A 126 248.146 214.193 254.065 1.00 0.00 C +ATOM 127 CA ARG A 127 249.765 210.903 253.033 1.00 0.00 C +ATOM 128 CA ASN A 128 248.664 208.358 250.420 1.00 0.00 C +ATOM 129 CA CYS A 129 247.803 208.388 246.708 1.00 0.00 C +ATOM 130 CA GLY A 130 244.174 207.737 245.749 1.00 0.00 C +ATOM 131 CA PRO A 131 241.172 210.080 245.628 1.00 0.00 C +ATOM 132 CA ARG A 132 239.157 210.582 242.434 1.00 0.00 C +ATOM 133 CA GLY A 133 240.047 212.129 239.067 1.00 0.00 C +ATOM 134 CA ALA A 134 240.190 211.311 235.349 1.00 0.00 C +ATOM 135 CA THR A 135 243.234 212.134 233.211 1.00 0.00 C +ATOM 136 CA GLN A 136 242.417 215.055 230.905 1.00 0.00 C +ATOM 137 CA ARG A 137 241.580 218.742 231.370 1.00 0.00 C +ATOM 138 CA GLN A 138 242.338 221.391 228.738 1.00 0.00 C +ATOM 139 CA PRO A 139 240.486 223.727 226.366 1.00 0.00 C +ATOM 140 CA GLU A 140 236.785 223.311 227.167 1.00 0.00 C +ATOM 141 CA ALA A 141 236.307 223.641 230.932 1.00 0.00 C +TER 142 ALA A 141 +END diff --git a/Plants/Q8VWL0/Q8VWL0.dcd b/Plants/Q8VWL0/Q8VWL0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..cc81ed3e620b568147b0955de796ab9a8b84256d --- /dev/null +++ b/Plants/Q8VWL0/Q8VWL0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:17adabc816e5ea6c2c336e8daf824202c1a3a51931879d90d719e31f060fac29 +size 4880276 diff --git a/Plants/Q8VWL0/top.pdb b/Plants/Q8VWL0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..6b90f006dc427dd50f5f5d4b6368d639d6eb9738 --- /dev/null +++ b/Plants/Q8VWL0/top.pdb @@ -0,0 +1,38 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA SER A 1 259.527 268.936 269.649 1.00 0.00 C +ATOM 2 CA PRO A 2 260.140 265.320 270.678 1.00 0.00 C +ATOM 3 CA LEU A 3 257.868 262.698 272.253 1.00 0.00 C +ATOM 4 CA GLN A 4 254.728 261.681 274.157 1.00 0.00 C +ATOM 5 CA LYS A 5 252.684 259.442 271.849 1.00 0.00 C +ATOM 6 CA LYS A 6 249.993 258.011 269.563 1.00 0.00 C +ATOM 7 CA LEU A 7 247.768 255.729 267.475 1.00 0.00 C +ATOM 8 CA ASN A 8 247.893 252.024 266.599 1.00 0.00 C +ATOM 9 CA GLY A 9 250.982 250.968 264.633 1.00 0.00 C +ATOM 10 CA PRO A 10 252.073 247.528 265.853 1.00 0.00 C +ATOM 11 CA SER A 11 252.416 245.414 262.702 1.00 0.00 C +ATOM 12 CA LEU A 12 249.585 243.658 260.853 1.00 0.00 C +ATOM 13 CA SER A 13 246.910 242.042 258.674 1.00 0.00 C +ATOM 14 CA PRO A 14 245.158 238.973 257.251 1.00 0.00 C +ATOM 15 CA VAL A 15 244.258 237.431 253.885 1.00 0.00 C +ATOM 16 CA LYS A 16 247.448 236.075 252.305 1.00 0.00 C +ATOM 17 CA LYS A 17 249.613 239.077 251.399 1.00 0.00 C +ATOM 18 CA SER A 18 249.858 242.329 249.430 1.00 0.00 C +ATOM 19 CA GLY A 19 247.370 245.035 250.434 1.00 0.00 C +ATOM 20 CA ALA A 20 248.788 248.327 249.141 1.00 0.00 C +ATOM 21 CA GLU A 21 248.542 251.841 247.690 1.00 0.00 C +ATOM 22 CA GLY A 22 250.507 251.868 244.425 1.00 0.00 C +ATOM 23 CA LYS A 23 251.251 253.262 240.958 1.00 0.00 C +ATOM 24 CA LYS A 24 252.222 251.200 237.906 1.00 0.00 C +ATOM 25 CA THR A 25 252.900 252.348 234.336 1.00 0.00 C +ATOM 26 CA PRO A 26 253.547 249.112 232.432 1.00 0.00 C +ATOM 27 CA ASN A 27 251.777 247.250 229.618 1.00 0.00 C +ATOM 28 CA GLY A 28 249.744 244.053 230.013 1.00 0.00 C +ATOM 29 CA LYS A 29 246.660 242.365 228.544 1.00 0.00 C +ATOM 30 CA MET A 30 244.583 244.377 226.063 1.00 0.00 C +ATOM 31 CA SER A 31 243.957 247.996 227.075 1.00 0.00 C +ATOM 32 CA THR A 32 245.297 251.429 228.040 1.00 0.00 C +ATOM 33 CA LYS A 33 247.144 254.324 226.390 1.00 0.00 C +ATOM 34 CA LYS A 34 246.811 257.877 227.724 1.00 0.00 C +TER 35 LYS A 34 +END diff --git a/Plants/Q8VXY1/Q8VXY1.dcd b/Plants/Q8VXY1/Q8VXY1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..3ee747a8ddfd262ccc566bee24d7f1b3801665ea --- /dev/null +++ b/Plants/Q8VXY1/Q8VXY1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:66cc8cfc9797ea1af4a269124c9db6b16050b3aa75071186a1d34bced310b66f +size 18560276 diff --git a/Plants/Q8VXY1/top.pdb b/Plants/Q8VXY1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..e23b2f45f56a60a3751fd27d3d495a09b520172f --- /dev/null +++ b/Plants/Q8VXY1/top.pdb @@ -0,0 +1,152 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 248.937 228.332 224.996 1.00 0.00 C +ATOM 2 CA GLU A 2 246.702 229.223 222.042 1.00 0.00 C +ATOM 3 CA LYS A 3 247.585 228.363 218.437 1.00 0.00 C +ATOM 4 CA GLU A 4 249.917 230.124 215.992 1.00 0.00 C +ATOM 5 CA LEU A 5 253.096 232.183 216.403 1.00 0.00 C +ATOM 6 CA HIS A 6 252.247 234.645 219.184 1.00 0.00 C +ATOM 7 CA GLU A 7 250.351 236.598 221.850 1.00 0.00 C +ATOM 8 CA SER A 8 252.752 238.199 224.338 1.00 0.00 C +ATOM 9 CA LYS A 9 255.348 240.010 222.217 1.00 0.00 C +ATOM 10 CA VAL A 10 255.426 243.349 220.384 1.00 0.00 C +ATOM 11 CA ALA A 11 253.282 243.386 217.235 1.00 0.00 C +ATOM 12 CA THR A 12 254.591 246.070 214.869 1.00 0.00 C +ATOM 13 CA TYR A 13 253.636 245.756 211.194 1.00 0.00 C +ATOM 14 CA THR A 14 250.925 247.991 209.720 1.00 0.00 C +ATOM 15 CA GLU A 15 250.839 251.579 208.442 1.00 0.00 C +ATOM 16 CA ARG A 16 249.395 255.069 207.936 1.00 0.00 C +ATOM 17 CA GLY A 17 246.967 256.402 210.552 1.00 0.00 C +ATOM 18 CA ILE A 18 245.926 259.943 211.498 1.00 0.00 C +ATOM 19 CA GLY A 19 247.366 261.047 214.848 1.00 0.00 C +ATOM 20 CA SER A 20 248.732 263.185 217.690 1.00 0.00 C +ATOM 21 CA HIS A 21 249.279 266.937 217.318 1.00 0.00 C +ATOM 22 CA ASP A 22 250.723 269.782 219.401 1.00 0.00 C +ATOM 23 CA SER A 23 249.958 273.505 219.670 1.00 0.00 C +ATOM 24 CA SER A 24 252.646 276.200 219.836 1.00 0.00 C +ATOM 25 CA PRO A 25 255.166 277.998 222.058 1.00 0.00 C +ATOM 26 CA GLU A 26 256.914 280.431 219.703 1.00 0.00 C +ATOM 27 CA LYS A 27 255.605 281.786 216.392 1.00 0.00 C +ATOM 28 CA GLU A 28 258.442 282.385 213.921 1.00 0.00 C +ATOM 29 CA LYS A 29 261.396 281.133 211.865 1.00 0.00 C +ATOM 30 CA GLU A 30 264.384 281.333 214.219 1.00 0.00 C +ATOM 31 CA LYS A 31 264.945 278.749 216.962 1.00 0.00 C +ATOM 32 CA SER A 32 264.013 279.764 220.514 1.00 0.00 C +ATOM 33 CA HIS A 33 266.942 280.343 222.880 1.00 0.00 C +ATOM 34 CA LYS A 34 269.629 282.029 224.991 1.00 0.00 C +ATOM 35 CA HIS A 35 270.977 281.998 228.555 1.00 0.00 C +ATOM 36 CA ARG A 36 271.286 280.033 231.804 1.00 0.00 C +ATOM 37 CA GLY A 37 270.564 277.473 234.531 1.00 0.00 C +ATOM 38 CA LEU A 38 272.704 274.350 234.103 1.00 0.00 C +ATOM 39 CA PHE A 39 270.977 270.975 233.721 1.00 0.00 C +ATOM 40 CA HIS A 40 268.508 268.956 235.804 1.00 0.00 C +ATOM 41 CA LEU A 41 265.548 271.268 236.444 1.00 0.00 C +ATOM 42 CA HIS A 42 262.394 269.216 237.038 1.00 0.00 C +ATOM 43 CA HIS A 43 260.416 267.861 234.077 1.00 0.00 C +ATOM 44 CA SER A 44 256.610 267.704 234.006 1.00 0.00 C +ATOM 45 CA LYS A 45 253.831 270.205 233.272 1.00 0.00 C +ATOM 46 CA ASP A 46 254.334 273.013 230.746 1.00 0.00 C +ATOM 47 CA GLU A 47 255.247 272.013 227.185 1.00 0.00 C +ATOM 48 CA LYS A 48 255.002 269.368 224.453 1.00 0.00 C +ATOM 49 CA ASP A 49 258.065 268.943 222.227 1.00 0.00 C +ATOM 50 CA GLY A 50 260.131 265.757 221.912 1.00 0.00 C +ATOM 51 CA ASP A 51 263.160 265.510 219.615 1.00 0.00 C +ATOM 52 CA LYS A 52 263.265 262.128 217.863 1.00 0.00 C +ATOM 53 CA LYS A 53 261.874 259.472 220.213 1.00 0.00 C +ATOM 54 CA LYS A 54 258.230 258.443 220.638 1.00 0.00 C +ATOM 55 CA GLU A 55 255.241 260.797 220.445 1.00 0.00 C +ATOM 56 CA GLY A 56 253.150 263.623 221.915 1.00 0.00 C +ATOM 57 CA SER A 57 251.867 263.817 225.497 1.00 0.00 C +ATOM 58 CA LYS A 58 252.270 265.387 228.945 1.00 0.00 C +ATOM 59 CA ARG A 59 249.057 266.779 230.448 1.00 0.00 C +ATOM 60 CA GLU A 60 247.690 269.745 232.411 1.00 0.00 C +ATOM 61 CA LYS A 61 244.570 270.799 230.495 1.00 0.00 C +ATOM 62 CA ILE A 62 241.046 269.709 231.450 1.00 0.00 C +ATOM 63 CA ALA A 63 237.768 267.926 232.223 1.00 0.00 C +ATOM 64 CA ALA A 64 236.051 264.937 230.602 1.00 0.00 C +ATOM 65 CA ALA A 65 232.629 265.101 228.935 1.00 0.00 C +ATOM 66 CA MET A 66 229.702 267.275 230.041 1.00 0.00 C +ATOM 67 CA VAL A 67 225.990 267.472 230.877 1.00 0.00 C +ATOM 68 CA GLY A 68 223.613 265.506 233.114 1.00 0.00 C +ATOM 69 CA LEU A 69 225.114 264.633 236.505 1.00 0.00 C +ATOM 70 CA GLY A 70 228.330 262.635 236.072 1.00 0.00 C +ATOM 71 CA ALA A 71 228.146 258.983 237.142 1.00 0.00 C +ATOM 72 CA THR A 72 226.250 256.910 234.568 1.00 0.00 C +ATOM 73 CA PHE A 73 222.692 256.977 233.208 1.00 0.00 C +ATOM 74 CA MET A 74 221.015 253.851 234.598 1.00 0.00 C +ATOM 75 CA LYS A 75 223.486 251.566 236.384 1.00 0.00 C +ATOM 76 CA LYS A 76 224.381 251.451 240.085 1.00 0.00 C +ATOM 77 CA LYS A 77 227.454 250.561 242.154 1.00 0.00 C +ATOM 78 CA HIS A 78 226.906 249.206 245.673 1.00 0.00 C +ATOM 79 CA LYS A 79 226.585 249.972 249.392 1.00 0.00 C +ATOM 80 CA GLY A 80 228.148 248.404 252.492 1.00 0.00 C +ATOM 81 CA GLY A 81 227.722 245.961 255.385 1.00 0.00 C +ATOM 82 CA GLY A 82 230.105 243.099 254.580 1.00 0.00 C +ATOM 83 CA LYS A 83 228.865 240.699 251.893 1.00 0.00 C +ATOM 84 CA LYS A 84 231.195 237.938 250.682 1.00 0.00 C +ATOM 85 CA GLU A 85 233.877 236.897 248.185 1.00 0.00 C +ATOM 86 CA LYS A 86 237.173 235.424 249.403 1.00 0.00 C +ATOM 87 CA ARG A 87 240.387 235.558 251.445 1.00 0.00 C +ATOM 88 CA GLY A 88 239.549 233.921 254.782 1.00 0.00 C +ATOM 89 CA GLY A 89 240.101 236.041 257.898 1.00 0.00 C +ATOM 90 CA GLY A 90 242.572 238.773 256.923 1.00 0.00 C +ATOM 91 CA GLY A 91 242.729 242.529 257.539 1.00 0.00 C +ATOM 92 CA GLY A 92 242.540 245.218 260.232 1.00 0.00 C +ATOM 93 CA LYS A 93 245.726 246.418 261.943 1.00 0.00 C +ATOM 94 CA GLU A 94 248.618 248.281 263.580 1.00 0.00 C +ATOM 95 CA GLU A 95 249.633 251.951 263.718 1.00 0.00 C +ATOM 96 CA GLU A 96 252.586 254.306 263.216 1.00 0.00 C +ATOM 97 CA GLY A 97 254.494 255.285 266.366 1.00 0.00 C +ATOM 98 CA GLY A 98 257.823 254.235 267.891 1.00 0.00 C +ATOM 99 CA GLY A 99 260.788 252.191 266.647 1.00 0.00 C +ATOM 100 CA GLU A 100 261.033 248.432 266.074 1.00 0.00 C +ATOM 101 CA GLU A 101 258.730 246.608 263.648 1.00 0.00 C +ATOM 102 CA GLU A 102 255.102 245.554 264.148 1.00 0.00 C +ATOM 103 CA GLY A 103 253.938 242.012 263.365 1.00 0.00 C +ATOM 104 CA GLU A 104 254.006 240.093 266.655 1.00 0.00 C +ATOM 105 CA GLU A 105 252.710 236.703 267.815 1.00 0.00 C +ATOM 106 CA GLU A 106 250.423 233.854 268.896 1.00 0.00 C +ATOM 107 CA GLU A 107 251.076 230.982 271.313 1.00 0.00 C +ATOM 108 CA GLU A 108 252.050 231.840 274.895 1.00 0.00 C +ATOM 109 CA SER A 109 250.183 231.635 278.210 1.00 0.00 C +ATOM 110 CA SER A 110 249.255 232.628 281.769 1.00 0.00 C +ATOM 111 CA SER A 111 246.691 231.580 284.385 1.00 0.00 C +ATOM 112 CA SER A 112 242.946 230.892 284.515 1.00 0.00 C +ATOM 113 CA GLU A 113 239.896 231.479 286.722 1.00 0.00 C +ATOM 114 CA GLU A 114 237.846 232.253 289.838 1.00 0.00 C +ATOM 115 CA GLU A 115 236.255 230.202 292.627 1.00 0.00 C +ATOM 116 CA GLU A 116 237.112 228.124 295.703 1.00 0.00 C +ATOM 117 CA GLU A 117 238.285 230.423 298.506 1.00 0.00 C +ATOM 118 CA GLU A 118 241.088 229.032 300.679 1.00 0.00 C +ATOM 119 CA GLU A 119 242.626 225.594 300.102 1.00 0.00 C +ATOM 120 CA GLU A 120 244.715 224.979 296.976 1.00 0.00 C +ATOM 121 CA GLY A 121 244.932 222.267 294.309 1.00 0.00 C +ATOM 122 CA GLY A 122 244.175 222.495 290.581 1.00 0.00 C +ATOM 123 CA GLY A 123 245.682 221.330 287.282 1.00 0.00 C +ATOM 124 CA GLY A 124 246.332 224.185 284.844 1.00 0.00 C +ATOM 125 CA GLY A 125 249.660 225.643 285.991 1.00 0.00 C +ATOM 126 CA GLY A 126 251.442 226.862 282.852 1.00 0.00 C +ATOM 127 CA ASP A 127 255.221 226.684 282.395 1.00 0.00 C +ATOM 128 CA GLU A 128 258.111 225.423 280.257 1.00 0.00 C +ATOM 129 CA GLU A 129 260.200 223.979 277.417 1.00 0.00 C +ATOM 130 CA GLU A 130 262.932 226.528 276.671 1.00 0.00 C +ATOM 131 CA GLY A 131 261.389 229.988 276.264 1.00 0.00 C +ATOM 132 CA GLY A 132 261.362 233.760 276.794 1.00 0.00 C +ATOM 133 CA GLY A 133 262.876 235.006 280.061 1.00 0.00 C +ATOM 134 CA LYS A 134 261.969 234.191 283.671 1.00 0.00 C +ATOM 135 CA PHE A 135 258.500 235.536 284.492 1.00 0.00 C +ATOM 136 CA SER A 136 257.620 239.009 285.787 1.00 0.00 C +ATOM 137 CA ALA A 137 255.049 241.797 286.158 1.00 0.00 C +ATOM 138 CA PHE A 138 253.889 242.389 289.739 1.00 0.00 C +ATOM 139 CA ILE A 139 255.609 241.518 293.025 1.00 0.00 C +ATOM 140 CA THR A 140 255.802 239.831 296.436 1.00 0.00 C +ATOM 141 CA MET A 141 256.583 238.320 299.845 1.00 0.00 C +ATOM 142 CA ILE A 142 258.747 238.478 302.976 1.00 0.00 C +ATOM 143 CA ALA A 143 262.534 238.055 302.999 1.00 0.00 C +ATOM 144 CA GLU A 144 265.512 235.691 303.238 1.00 0.00 C +ATOM 145 CA ALA A 145 267.257 234.227 306.292 1.00 0.00 C +ATOM 146 CA PHE A 146 266.738 235.131 309.957 1.00 0.00 C +ATOM 147 CA GLU A 147 269.681 233.934 312.060 1.00 0.00 C +ATOM 148 CA GLU A 148 271.414 235.585 315.025 1.00 0.00 C +TER 149 GLU A 148 +END diff --git a/Plants/Q8W192/Q8W192.dcd b/Plants/Q8W192/Q8W192.dcd new file mode 100644 index 0000000000000000000000000000000000000000..94ec05cd56676ff1784172185acb65a9b34474df --- /dev/null +++ b/Plants/Q8W192/Q8W192.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:42444e4ff04fcd9716027ccc6e7f8bac5770cf12065ec2b77dba6b5647e9f619 +size 20000276 diff --git a/Plants/Q8W192/top.pdb b/Plants/Q8W192/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..c72b051a16a646873ebc106be3eaa5d65e28a95d --- /dev/null +++ b/Plants/Q8W192/top.pdb @@ -0,0 +1,164 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 292.881 275.378 264.883 1.00 0.00 C +ATOM 2 CA GLU A 2 294.319 272.320 266.642 1.00 0.00 C +ATOM 3 CA HIS A 3 294.306 268.696 267.818 1.00 0.00 C +ATOM 4 CA GLY A 4 293.253 266.198 265.140 1.00 0.00 C +ATOM 5 CA GLN A 5 291.744 263.990 262.426 1.00 0.00 C +ATOM 6 CA ALA A 6 290.556 260.558 263.575 1.00 0.00 C +ATOM 7 CA THR A 7 288.745 257.277 264.262 1.00 0.00 C +ATOM 8 CA ILE A 8 286.402 255.383 266.594 1.00 0.00 C +ATOM 9 CA ARG A 9 286.317 256.511 270.232 1.00 0.00 C +ATOM 10 CA VAL A 10 282.957 258.273 270.581 1.00 0.00 C +ATOM 11 CA ASP A 11 279.473 259.386 269.514 1.00 0.00 C +ATOM 12 CA GLU A 12 275.679 259.240 269.194 1.00 0.00 C +ATOM 13 CA TYR A 13 274.340 259.974 265.703 1.00 0.00 C +ATOM 14 CA GLY A 14 270.892 260.510 264.174 1.00 0.00 C +ATOM 15 CA ASN A 15 271.517 260.652 260.418 1.00 0.00 C +ATOM 16 CA PRO A 16 274.147 258.551 258.634 1.00 0.00 C +ATOM 17 CA VAL A 17 275.128 259.478 255.071 1.00 0.00 C +ATOM 18 CA ALA A 18 277.979 261.594 253.687 1.00 0.00 C +ATOM 19 CA GLY A 19 279.576 262.787 250.441 1.00 0.00 C +ATOM 20 CA HIS A 20 279.509 263.858 246.785 1.00 0.00 C +ATOM 21 CA GLY A 21 280.224 266.667 244.312 1.00 0.00 C +ATOM 22 CA VAL A 22 281.178 266.771 240.624 1.00 0.00 C +ATOM 23 CA GLY A 23 279.325 268.929 238.089 1.00 0.00 C +ATOM 24 CA THR A 24 275.926 268.614 236.397 1.00 0.00 C +ATOM 25 CA GLY A 25 273.354 270.217 238.707 1.00 0.00 C +ATOM 26 CA MET A 26 272.999 268.358 242.014 1.00 0.00 C +ATOM 27 CA GLY A 27 273.952 265.254 244.007 1.00 0.00 C +ATOM 28 CA ALA A 28 272.492 261.820 244.777 1.00 0.00 C +ATOM 29 CA HIS A 29 270.888 262.172 248.215 1.00 0.00 C +ATOM 30 CA GLY A 30 268.708 265.295 248.312 1.00 0.00 C +ATOM 31 CA GLY A 31 264.984 264.486 248.312 1.00 0.00 C +ATOM 32 CA SER A 32 263.459 264.617 251.801 1.00 0.00 C +ATOM 33 CA GLY A 33 264.292 262.600 254.924 1.00 0.00 C +ATOM 34 CA THR A 34 262.988 262.740 258.501 1.00 0.00 C +ATOM 35 CA GLY A 35 263.137 263.761 262.169 1.00 0.00 C +ATOM 36 CA ALA A 36 259.859 263.127 264.005 1.00 0.00 C +ATOM 37 CA ALA A 37 257.072 260.930 265.390 1.00 0.00 C +ATOM 38 CA THR A 38 253.594 259.968 264.167 1.00 0.00 C +ATOM 39 CA GLY A 39 252.709 256.969 261.991 1.00 0.00 C +ATOM 40 CA GLY A 40 250.504 253.948 262.721 1.00 0.00 C +ATOM 41 CA HIS A 41 248.598 254.313 266.000 1.00 0.00 C +ATOM 42 CA PHE A 42 245.799 252.349 267.680 1.00 0.00 C +ATOM 43 CA GLN A 43 243.371 250.157 265.727 1.00 0.00 C +ATOM 44 CA PRO A 44 240.985 248.179 263.511 1.00 0.00 C +ATOM 45 CA THR A 45 239.195 249.661 260.492 1.00 0.00 C +ATOM 46 CA ARG A 46 236.009 251.345 261.728 1.00 0.00 C +ATOM 47 CA GLU A 47 234.528 254.649 262.916 1.00 0.00 C +ATOM 48 CA GLU A 48 232.237 255.255 265.900 1.00 0.00 C +ATOM 49 CA HIS A 49 228.670 254.559 267.044 1.00 0.00 C +ATOM 50 CA LYS A 50 226.199 255.697 264.375 1.00 0.00 C +ATOM 51 CA ALA A 51 224.426 252.778 262.687 1.00 0.00 C +ATOM 52 CA GLY A 52 221.784 250.091 262.123 1.00 0.00 C +ATOM 53 CA GLY A 53 221.774 247.003 259.892 1.00 0.00 C +ATOM 54 CA ILE A 54 223.365 248.062 256.596 1.00 0.00 C +ATOM 55 CA LEU A 55 224.722 247.990 253.036 1.00 0.00 C +ATOM 56 CA GLN A 56 227.656 249.739 251.348 1.00 0.00 C +ATOM 57 CA ARG A 57 228.148 253.243 249.934 1.00 0.00 C +ATOM 58 CA SER A 58 227.947 256.915 250.928 1.00 0.00 C +ATOM 59 CA GLY A 59 228.211 260.670 251.522 1.00 0.00 C +ATOM 60 CA SER A 60 229.326 263.784 249.632 1.00 0.00 C +ATOM 61 CA SER A 61 232.366 263.044 247.457 1.00 0.00 C +ATOM 62 CA SER A 62 231.594 264.071 243.870 1.00 0.00 C +ATOM 63 CA SER A 63 229.744 265.012 240.675 1.00 0.00 C +ATOM 64 CA SER A 64 228.105 263.985 237.393 1.00 0.00 C +ATOM 65 CA SER A 65 229.569 262.169 234.380 1.00 0.00 C +ATOM 66 CA SER A 66 230.687 262.751 230.785 1.00 0.00 C +ATOM 67 CA GLU A 67 228.722 261.312 227.856 1.00 0.00 C +ATOM 68 CA ASP A 68 225.148 260.181 228.535 1.00 0.00 C +ATOM 69 CA ASP A 69 222.694 261.332 231.213 1.00 0.00 C +ATOM 70 CA GLY A 70 221.922 264.392 233.348 1.00 0.00 C +ATOM 71 CA MET A 71 219.193 266.852 234.353 1.00 0.00 C +ATOM 72 CA GLY A 72 215.813 267.353 236.038 1.00 0.00 C +ATOM 73 CA GLY A 73 216.277 267.082 239.810 1.00 0.00 C +ATOM 74 CA ARG A 74 214.999 264.620 242.423 1.00 0.00 C +ATOM 75 CA ARG A 75 217.094 262.877 245.086 1.00 0.00 C +ATOM 76 CA LYS A 76 219.878 265.340 245.921 1.00 0.00 C +ATOM 77 CA LYS A 77 223.042 263.241 246.231 1.00 0.00 C +ATOM 78 CA GLY A 78 224.951 260.368 244.612 1.00 0.00 C +ATOM 79 CA ILE A 79 228.404 258.918 243.915 1.00 0.00 C +ATOM 80 CA LYS A 80 228.253 255.280 242.795 1.00 0.00 C +ATOM 81 CA ASP A 81 227.591 252.430 240.354 1.00 0.00 C +ATOM 82 CA LYS A 82 230.020 252.133 237.434 1.00 0.00 C +ATOM 83 CA ILE A 83 230.917 253.993 234.232 1.00 0.00 C +ATOM 84 CA LYS A 84 232.612 252.718 231.067 1.00 0.00 C +ATOM 85 CA GLU A 85 232.926 248.924 231.213 1.00 0.00 C +ATOM 86 CA LYS A 86 233.903 245.450 232.436 1.00 0.00 C +ATOM 87 CA LEU A 87 235.309 245.072 235.957 1.00 0.00 C +ATOM 88 CA PRO A 88 238.282 242.804 236.687 1.00 0.00 C +ATOM 89 CA GLY A 89 238.952 240.413 239.577 1.00 0.00 C +ATOM 90 CA GLY A 90 242.166 239.686 241.490 1.00 0.00 C +ATOM 91 CA HIS A 91 241.689 239.546 245.267 1.00 0.00 C +ATOM 92 CA GLY A 92 241.880 242.561 247.588 1.00 0.00 C +ATOM 93 CA ASP A 93 243.539 241.735 250.917 1.00 0.00 C +ATOM 94 CA GLN A 94 245.184 242.823 254.177 1.00 0.00 C +ATOM 95 CA GLN A 95 246.685 246.324 254.089 1.00 0.00 C +ATOM 96 CA HIS A 96 248.428 247.615 250.957 1.00 0.00 C +ATOM 97 CA ALA A 97 248.030 245.762 247.652 1.00 0.00 C +ATOM 98 CA ASP A 98 248.733 245.669 243.908 1.00 0.00 C +ATOM 99 CA GLY A 99 247.042 245.462 240.500 1.00 0.00 C +ATOM 100 CA THR A 100 247.272 241.909 239.145 1.00 0.00 C +ATOM 101 CA TYR A 101 248.484 239.200 236.756 1.00 0.00 C +ATOM 102 CA GLY A 102 250.335 239.316 233.428 1.00 0.00 C +ATOM 103 CA GLN A 103 252.573 242.384 233.127 1.00 0.00 C +ATOM 104 CA GLN A 104 253.682 246.026 232.960 1.00 0.00 C +ATOM 105 CA GLY A 105 251.894 249.340 232.379 1.00 0.00 C +ATOM 106 CA THR A 106 250.165 252.549 233.486 1.00 0.00 C +ATOM 107 CA GLY A 107 251.981 253.931 236.538 1.00 0.00 C +ATOM 108 CA MET A 108 253.340 253.804 240.095 1.00 0.00 C +ATOM 109 CA ALA A 109 254.825 250.764 241.847 1.00 0.00 C +ATOM 110 CA GLY A 110 256.509 251.556 245.172 1.00 0.00 C +ATOM 111 CA THR A 111 257.286 252.469 248.788 1.00 0.00 C +ATOM 112 CA GLY A 112 260.413 254.108 250.221 1.00 0.00 C +ATOM 113 CA ALA A 113 261.849 255.978 253.213 1.00 0.00 C +ATOM 114 CA HIS A 114 264.164 254.352 255.765 1.00 0.00 C +ATOM 115 CA GLY A 115 264.555 251.819 258.584 1.00 0.00 C +ATOM 116 CA SER A 116 261.542 249.526 259.006 1.00 0.00 C +ATOM 117 CA ALA A 117 260.520 246.055 260.198 1.00 0.00 C +ATOM 118 CA ALA A 118 261.834 243.676 257.527 1.00 0.00 C +ATOM 119 CA THR A 119 265.255 244.154 255.921 1.00 0.00 C +ATOM 120 CA GLY A 120 265.645 247.621 254.391 1.00 0.00 C +ATOM 121 CA GLY A 121 268.490 247.726 251.858 1.00 0.00 C +ATOM 122 CA THR A 122 270.972 245.953 249.576 1.00 0.00 C +ATOM 123 CA TYR A 123 271.377 242.376 248.327 1.00 0.00 C +ATOM 124 CA GLY A 124 268.876 241.200 245.705 1.00 0.00 C +ATOM 125 CA GLN A 125 265.135 241.301 246.422 1.00 0.00 C +ATOM 126 CA PRO A 126 261.979 243.166 247.460 1.00 0.00 C +ATOM 127 CA GLY A 127 258.366 243.234 246.253 1.00 0.00 C +ATOM 128 CA HIS A 128 254.915 244.550 245.318 1.00 0.00 C +ATOM 129 CA THR A 129 253.795 243.051 241.999 1.00 0.00 C +ATOM 130 CA GLY A 130 254.882 240.243 239.666 1.00 0.00 C +ATOM 131 CA MET A 131 253.898 236.564 239.569 1.00 0.00 C +ATOM 132 CA THR A 132 255.984 233.556 240.626 1.00 0.00 C +ATOM 133 CA GLY A 133 254.336 230.452 242.097 1.00 0.00 C +ATOM 134 CA THR A 134 251.885 229.251 239.438 1.00 0.00 C +ATOM 135 CA GLY A 135 250.892 225.924 237.868 1.00 0.00 C +ATOM 136 CA THR A 136 248.815 224.184 240.547 1.00 0.00 C +ATOM 137 CA HIS A 137 247.041 223.041 243.719 1.00 0.00 C +ATOM 138 CA VAL A 138 244.480 224.434 246.172 1.00 0.00 C +ATOM 139 CA THR A 139 240.947 223.772 244.909 1.00 0.00 C +ATOM 140 CA ASP A 140 238.493 226.432 243.718 1.00 0.00 C +ATOM 141 CA GLY A 141 239.262 230.154 243.986 1.00 0.00 C +ATOM 142 CA ALA A 142 241.452 230.440 247.091 1.00 0.00 C +ATOM 143 CA GLY A 143 242.042 233.758 248.868 1.00 0.00 C +ATOM 144 CA GLU A 144 243.566 235.349 251.976 1.00 0.00 C +ATOM 145 CA LYS A 145 242.116 237.217 254.964 1.00 0.00 C +ATOM 146 CA LYS A 146 240.159 238.199 258.082 1.00 0.00 C +ATOM 147 CA GLY A 147 239.035 238.691 261.689 1.00 0.00 C +ATOM 148 CA ILE A 148 237.282 236.513 264.278 1.00 0.00 C +ATOM 149 CA MET A 149 237.349 232.823 263.331 1.00 0.00 C +ATOM 150 CA ASP A 150 237.378 229.596 261.307 1.00 0.00 C +ATOM 151 CA LYS A 151 235.044 226.606 260.943 1.00 0.00 C +ATOM 152 CA ILE A 152 235.562 223.525 258.764 1.00 0.00 C +ATOM 153 CA LYS A 153 236.291 224.728 255.223 1.00 0.00 C +ATOM 154 CA GLU A 154 237.384 221.997 252.802 1.00 0.00 C +ATOM 155 CA LYS A 155 240.543 219.884 253.073 1.00 0.00 C +ATOM 156 CA LEU A 156 241.117 217.746 256.174 1.00 0.00 C +ATOM 157 CA PRO A 157 244.707 216.951 257.172 1.00 0.00 C +ATOM 158 CA GLY A 158 247.623 219.397 257.344 1.00 0.00 C +ATOM 159 CA GLN A 159 248.116 223.053 256.391 1.00 0.00 C +ATOM 160 CA HIS A 160 247.635 226.830 256.271 1.00 0.00 C +TER 161 HIS A 160 +END diff --git a/Plants/Q8W267/Q8W267.dcd b/Plants/Q8W267/Q8W267.dcd new file mode 100644 index 0000000000000000000000000000000000000000..bd314c8dc7c811aa5f43d1e0cbe3b40fd1db85d5 --- /dev/null +++ b/Plants/Q8W267/Q8W267.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:01e8243909767445a26933987d2957d0d7a87230031607390a13b5971079b2be +size 11960276 diff --git a/Plants/Q8W267/top.pdb b/Plants/Q8W267/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..34fc4616e9d9b9a8818dce14193835dee8d7273e --- /dev/null +++ b/Plants/Q8W267/top.pdb @@ -0,0 +1,97 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 230.978 260.435 268.574 1.00 0.00 C +ATOM 2 CA SER A 2 234.296 260.954 270.372 1.00 0.00 C +ATOM 3 CA GLY A 3 234.791 258.180 272.936 1.00 0.00 C +ATOM 4 CA ILE A 4 234.234 258.179 276.706 1.00 0.00 C +ATOM 5 CA MET A 5 237.544 258.949 278.429 1.00 0.00 C +ATOM 6 CA HIS A 6 241.223 257.983 278.209 1.00 0.00 C +ATOM 7 CA LYS A 7 242.061 254.309 277.648 1.00 0.00 C +ATOM 8 CA ILE A 8 244.368 251.470 278.714 1.00 0.00 C +ATOM 9 CA GLU A 9 247.152 250.663 276.241 1.00 0.00 C +ATOM 10 CA ASP A 10 246.177 248.025 273.671 1.00 0.00 C +ATOM 11 CA ALA A 11 247.323 245.594 270.970 1.00 0.00 C +ATOM 12 CA LEU A 12 244.696 242.970 270.118 1.00 0.00 C +ATOM 13 CA HIS A 13 245.775 239.730 268.429 1.00 0.00 C +ATOM 14 CA ILE A 14 248.773 237.771 267.128 1.00 0.00 C +ATOM 15 CA GLY A 15 249.996 234.391 268.391 1.00 0.00 C +ATOM 16 CA GLY A 16 250.274 230.599 268.638 1.00 0.00 C +ATOM 17 CA ARG A 17 247.825 228.611 266.501 1.00 0.00 C +ATOM 18 CA LYS A 18 244.400 229.256 264.959 1.00 0.00 C +ATOM 19 CA LYS A 19 241.264 228.879 267.089 1.00 0.00 C +ATOM 20 CA GLU A 20 237.463 228.673 267.265 1.00 0.00 C +ATOM 21 CA GLU A 21 235.938 228.881 263.779 1.00 0.00 C +ATOM 22 CA GLU A 22 238.310 230.295 261.155 1.00 0.00 C +ATOM 23 CA HIS A 23 238.145 234.092 261.417 1.00 0.00 C +ATOM 24 CA LYS A 24 237.737 237.859 261.818 1.00 0.00 C +ATOM 25 CA GLY A 25 234.459 238.972 263.408 1.00 0.00 C +ATOM 26 CA GLU A 26 232.027 239.866 260.614 1.00 0.00 C +ATOM 27 CA HIS A 27 232.388 242.465 257.851 1.00 0.00 C +ATOM 28 CA HIS A 28 235.969 242.293 256.562 1.00 0.00 C +ATOM 29 CA GLY A 29 239.086 243.060 258.614 1.00 0.00 C +ATOM 30 CA GLU A 30 239.896 246.783 258.567 1.00 0.00 C +ATOM 31 CA HIS A 31 238.806 249.312 255.935 1.00 0.00 C +ATOM 32 CA LYS A 32 238.932 253.052 256.655 1.00 0.00 C +ATOM 33 CA GLY A 33 236.309 254.995 258.619 1.00 0.00 C +ATOM 34 CA GLU A 34 237.107 258.102 260.675 1.00 0.00 C +ATOM 35 CA HIS A 35 238.567 261.253 259.110 1.00 0.00 C +ATOM 36 CA LYS A 36 242.317 261.075 258.458 1.00 0.00 C +ATOM 37 CA GLY A 37 244.343 259.662 255.557 1.00 0.00 C +ATOM 38 CA GLU A 38 245.010 256.139 254.269 1.00 0.00 C +ATOM 39 CA HIS A 39 248.124 256.419 252.092 1.00 0.00 C +ATOM 40 CA HIS A 40 251.124 254.924 250.280 1.00 0.00 C +ATOM 41 CA GLY A 41 250.691 251.311 249.150 1.00 0.00 C +ATOM 42 CA GLU A 42 247.497 249.300 249.664 1.00 0.00 C +ATOM 43 CA HIS A 43 245.088 246.400 249.107 1.00 0.00 C +ATOM 44 CA LYS A 44 242.114 247.548 247.021 1.00 0.00 C +ATOM 45 CA GLY A 45 243.061 251.018 245.765 1.00 0.00 C +ATOM 46 CA GLU A 46 241.853 253.564 243.200 1.00 0.00 C +ATOM 47 CA HIS A 47 240.704 257.015 244.332 1.00 0.00 C +ATOM 48 CA LYS A 48 237.410 258.580 243.229 1.00 0.00 C +ATOM 49 CA GLU A 49 234.798 258.462 245.999 1.00 0.00 C +ATOM 50 CA GLY A 50 233.533 259.583 249.414 1.00 0.00 C +ATOM 51 CA ILE A 51 233.146 262.769 251.466 1.00 0.00 C +ATOM 52 CA VAL A 52 235.969 265.325 251.566 1.00 0.00 C +ATOM 53 CA ASP A 53 238.566 266.979 249.322 1.00 0.00 C +ATOM 54 CA LYS A 54 242.273 267.339 248.517 1.00 0.00 C +ATOM 55 CA ILE A 55 244.028 270.721 248.511 1.00 0.00 C +ATOM 56 CA LYS A 56 247.632 269.982 247.519 1.00 0.00 C +ATOM 57 CA ASP A 57 250.326 267.459 246.577 1.00 0.00 C +ATOM 58 CA LYS A 58 250.183 264.863 243.792 1.00 0.00 C +ATOM 59 CA ILE A 59 248.163 263.740 240.763 1.00 0.00 C +ATOM 60 CA HIS A 60 247.636 259.968 240.657 1.00 0.00 C +ATOM 61 CA GLY A 61 247.774 256.162 240.774 1.00 0.00 C +ATOM 62 CA GLU A 62 248.305 252.534 239.738 1.00 0.00 C +ATOM 63 CA GLY A 63 249.953 249.679 241.648 1.00 0.00 C +ATOM 64 CA HIS A 64 253.080 251.206 243.199 1.00 0.00 C +ATOM 65 CA GLU A 65 256.643 252.411 242.593 1.00 0.00 C +ATOM 66 CA GLU A 66 260.375 252.743 241.899 1.00 0.00 C +ATOM 67 CA LYS A 67 263.801 254.074 240.897 1.00 0.00 C +ATOM 68 CA LYS A 68 266.884 256.174 241.675 1.00 0.00 C +ATOM 69 CA LYS A 69 270.105 255.567 239.733 1.00 0.00 C +ATOM 70 CA LYS A 70 269.493 252.762 237.228 1.00 0.00 C +ATOM 71 CA LYS A 71 268.445 249.749 235.145 1.00 0.00 C +ATOM 72 CA LYS A 72 266.491 246.826 233.679 1.00 0.00 C +ATOM 73 CA GLU A 73 263.714 244.563 234.977 1.00 0.00 C +ATOM 74 CA LYS A 74 262.348 242.041 237.485 1.00 0.00 C +ATOM 75 CA LYS A 75 263.067 238.349 238.093 1.00 0.00 C +ATOM 76 CA HIS A 76 264.458 235.287 236.302 1.00 0.00 C +ATOM 77 CA ASP A 77 266.604 236.128 233.268 1.00 0.00 C +ATOM 78 CA GLU A 78 264.881 238.629 230.968 1.00 0.00 C +ATOM 79 CA HIS A 79 263.324 239.971 227.760 1.00 0.00 C +ATOM 80 CA GLY A 80 259.614 239.113 227.627 1.00 0.00 C +ATOM 81 CA HIS A 81 257.228 241.863 226.506 1.00 0.00 C +ATOM 82 CA ASP A 82 258.594 245.336 227.271 1.00 0.00 C +ATOM 83 CA GLY A 83 262.280 246.278 227.489 1.00 0.00 C +ATOM 84 CA HIS A 84 264.082 249.629 227.284 1.00 0.00 C +ATOM 85 CA SER A 85 267.801 248.988 226.763 1.00 0.00 C +ATOM 86 CA SER A 86 269.813 250.357 223.832 1.00 0.00 C +ATOM 87 CA SER A 87 273.355 251.475 224.677 1.00 0.00 C +ATOM 88 CA SER A 88 273.429 254.575 226.891 1.00 0.00 C +ATOM 89 CA SER A 89 275.285 255.448 230.102 1.00 0.00 C +ATOM 90 CA SER A 90 278.339 253.170 230.153 1.00 0.00 C +ATOM 91 CA ASP A 91 281.162 252.126 232.489 1.00 0.00 C +ATOM 92 CA SER A 92 283.394 253.518 235.245 1.00 0.00 C +ATOM 93 CA ASP A 93 286.002 256.224 234.618 1.00 0.00 C +TER 94 ASP A 93 +END diff --git a/Plants/Q8W2R9/Q8W2R9.dcd b/Plants/Q8W2R9/Q8W2R9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..97d3bb585c8c440f30ac7a39738e8fa1719a0be1 --- /dev/null +++ b/Plants/Q8W2R9/Q8W2R9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:534faf52a0674c1952e6a1dba1c619d28d2e6f937a1c3472565fbb542482cd1d +size 8360276 diff --git a/Plants/Q8W2R9/top.pdb b/Plants/Q8W2R9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..6049a42db3801a035c278bfe0c86e3cb7a12a186 --- /dev/null +++ b/Plants/Q8W2R9/top.pdb @@ -0,0 +1,67 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 284.786 258.995 245.904 1.00 0.00 C +ATOM 2 CA ALA A 2 282.449 256.060 245.237 1.00 0.00 C +ATOM 3 CA SER A 3 280.514 253.291 243.475 1.00 0.00 C +ATOM 4 CA SER A 4 278.917 254.321 240.173 1.00 0.00 C +ATOM 5 CA PRO A 5 277.082 257.559 240.991 1.00 0.00 C +ATOM 6 CA ALA A 6 275.607 259.018 244.186 1.00 0.00 C +ATOM 7 CA ARG A 7 275.028 257.062 247.404 1.00 0.00 C +ATOM 8 CA GLY A 8 272.322 254.478 248.124 1.00 0.00 C +ATOM 9 CA GLY A 9 271.415 254.691 251.818 1.00 0.00 C +ATOM 10 CA LYS A 10 268.262 256.183 253.350 1.00 0.00 C +ATOM 11 CA ARG A 11 265.524 256.646 255.958 1.00 0.00 C +ATOM 12 CA THR A 12 263.856 260.029 256.494 1.00 0.00 C +ATOM 13 CA PRO A 13 263.172 260.244 260.236 1.00 0.00 C +ATOM 14 CA THR A 14 266.468 261.208 261.887 1.00 0.00 C +ATOM 15 CA ALA A 15 267.311 258.688 264.617 1.00 0.00 C +ATOM 16 CA GLU A 16 267.579 259.218 268.381 1.00 0.00 C +ATOM 17 CA LEU A 17 269.022 256.086 270.002 1.00 0.00 C +ATOM 18 CA ASP A 18 269.273 253.181 267.550 1.00 0.00 C +ATOM 19 CA GLY A 19 269.802 249.408 267.540 1.00 0.00 C +ATOM 20 CA GLU A 20 268.754 246.766 265.003 1.00 0.00 C +ATOM 21 CA GLY A 21 265.437 244.907 265.237 1.00 0.00 C +ATOM 22 CA VAL A 22 262.562 247.099 266.442 1.00 0.00 C +ATOM 23 CA ASP A 23 261.040 250.014 264.519 1.00 0.00 C +ATOM 24 CA GLY A 24 260.270 251.255 261.000 1.00 0.00 C +ATOM 25 CA VAL A 25 258.338 250.505 257.802 1.00 0.00 C +ATOM 26 CA ALA A 26 256.202 250.221 254.660 1.00 0.00 C +ATOM 27 CA ARG A 27 254.067 249.501 251.588 1.00 0.00 C +ATOM 28 CA GLY A 28 250.503 249.089 252.870 1.00 0.00 C +ATOM 29 CA LEU A 29 247.375 251.215 253.326 1.00 0.00 C +ATOM 30 CA ALA A 30 246.412 252.297 249.802 1.00 0.00 C +ATOM 31 CA ASN A 31 244.780 255.505 248.555 1.00 0.00 C +ATOM 32 CA PRO A 32 241.674 257.491 247.589 1.00 0.00 C +ATOM 33 CA THR A 33 239.317 258.329 250.463 1.00 0.00 C +ATOM 34 CA THR A 34 241.093 257.166 253.627 1.00 0.00 C +ATOM 35 CA ALA A 35 241.210 257.926 257.359 1.00 0.00 C +ATOM 36 CA THR A 36 240.535 256.488 260.822 1.00 0.00 C +ATOM 37 CA VAL A 37 237.604 254.318 261.926 1.00 0.00 C +ATOM 38 CA ARG A 38 237.955 250.525 261.858 1.00 0.00 C +ATOM 39 CA LEU A 39 236.218 249.073 258.793 1.00 0.00 C +ATOM 40 CA GLY A 40 233.300 251.148 257.490 1.00 0.00 C +ATOM 41 CA ASP A 41 231.988 252.548 254.198 1.00 0.00 C +ATOM 42 CA GLY A 42 231.015 255.539 252.049 1.00 0.00 C +ATOM 43 CA SER A 43 230.913 257.617 248.857 1.00 0.00 C +ATOM 44 CA SER A 44 229.523 256.035 245.683 1.00 0.00 C +ATOM 45 CA GLY A 45 228.992 256.193 241.913 1.00 0.00 C +ATOM 46 CA ASP A 46 229.100 256.975 238.186 1.00 0.00 C +ATOM 47 CA ASP A 47 231.842 255.430 236.038 1.00 0.00 C +ATOM 48 CA ARG A 48 234.393 252.920 237.344 1.00 0.00 C +ATOM 49 CA ARG A 49 237.667 252.979 239.292 1.00 0.00 C +ATOM 50 CA PRO A 50 238.994 249.781 240.881 1.00 0.00 C +ATOM 51 CA LYS A 51 237.115 246.712 239.629 1.00 0.00 C +ATOM 52 CA VAL A 52 236.253 243.866 237.247 1.00 0.00 C +ATOM 53 CA ALA A 53 232.683 242.733 236.548 1.00 0.00 C +ATOM 54 CA LYS A 54 229.056 241.565 236.536 1.00 0.00 C +ATOM 55 CA ALA A 55 227.381 238.623 234.788 1.00 0.00 C +ATOM 56 CA ALA A 56 227.187 234.900 234.002 1.00 0.00 C +ATOM 57 CA ALA A 57 227.737 231.133 233.855 1.00 0.00 C +ATOM 58 CA ALA A 58 228.193 229.372 237.203 1.00 0.00 C +ATOM 59 CA GLY A 59 231.964 229.006 237.601 1.00 0.00 C +ATOM 60 CA GLY A 60 235.101 226.924 237.016 1.00 0.00 C +ATOM 61 CA ALA A 61 236.501 223.794 238.678 1.00 0.00 C +ATOM 62 CA ARG A 62 240.160 222.938 239.308 1.00 0.00 C +ATOM 63 CA CYS A 63 243.206 225.216 239.090 1.00 0.00 C +TER 64 CYS A 63 +END diff --git a/Plants/Q8W2Y8/Q8W2Y8.dcd b/Plants/Q8W2Y8/Q8W2Y8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..52d65e47734357e385c2f02c944edff3d6c91449 --- /dev/null +++ b/Plants/Q8W2Y8/Q8W2Y8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:820a951807fc4ae83877969291161dad52a9f1aae47316380e6f5a5f3523c34d +size 7160276 diff --git a/Plants/Q8W2Y8/top.pdb b/Plants/Q8W2Y8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..fb5e92b403afd1f48ce3a7e596313985f252de51 --- /dev/null +++ b/Plants/Q8W2Y8/top.pdb @@ -0,0 +1,57 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 292.508 282.350 235.620 1.00 0.00 C +ATOM 2 CA SER A 2 293.074 279.730 238.328 1.00 0.00 C +ATOM 3 CA GLY A 3 289.847 279.069 240.243 1.00 0.00 C +ATOM 4 CA VAL A 4 287.241 278.014 242.815 1.00 0.00 C +ATOM 5 CA ALA A 5 287.496 274.260 243.414 1.00 0.00 C +ATOM 6 CA ALA A 6 285.074 271.376 243.992 1.00 0.00 C +ATOM 7 CA ALA A 7 282.677 268.470 243.424 1.00 0.00 C +ATOM 8 CA THR A 8 279.281 266.773 243.096 1.00 0.00 C +ATOM 9 CA ALA A 9 275.653 267.917 242.880 1.00 0.00 C +ATOM 10 CA GLY A 10 273.635 265.240 244.691 1.00 0.00 C +ATOM 11 CA GLY A 11 274.494 262.245 246.884 1.00 0.00 C +ATOM 12 CA GLY A 12 272.748 262.533 250.258 1.00 0.00 C +ATOM 13 CA GLY A 13 269.093 261.796 249.472 1.00 0.00 C +ATOM 14 CA THR A 14 267.164 261.033 252.667 1.00 0.00 C +ATOM 15 CA PRO A 15 264.156 263.361 252.890 1.00 0.00 C +ATOM 16 CA PRO A 16 260.969 265.444 252.739 1.00 0.00 C +ATOM 17 CA PRO A 17 259.104 266.738 255.799 1.00 0.00 C +ATOM 18 CA THR A 18 256.142 265.685 257.951 1.00 0.00 C +ATOM 19 CA GLY A 19 252.659 264.224 257.451 1.00 0.00 C +ATOM 20 CA ALA A 20 250.101 262.365 255.325 1.00 0.00 C +ATOM 21 CA GLY A 21 246.595 260.890 255.555 1.00 0.00 C +ATOM 22 CA SER A 22 243.296 262.616 254.750 1.00 0.00 C +ATOM 23 CA GLY A 23 240.626 260.541 256.506 1.00 0.00 C +ATOM 24 CA SER A 24 237.536 258.660 255.311 1.00 0.00 C +ATOM 25 CA GLY A 25 236.237 260.029 252.001 1.00 0.00 C +ATOM 26 CA ALA A 26 235.887 257.599 249.088 1.00 0.00 C +ATOM 27 CA GLY A 27 236.575 254.153 247.615 1.00 0.00 C +ATOM 28 CA ALA A 28 235.620 250.465 247.594 1.00 0.00 C +ATOM 29 CA PRO A 29 234.359 247.624 249.798 1.00 0.00 C +ATOM 30 CA GLY A 30 235.912 244.156 249.519 1.00 0.00 C +ATOM 31 CA GLY A 31 233.852 241.750 251.637 1.00 0.00 C +ATOM 32 CA GLY A 32 231.337 238.965 252.295 1.00 0.00 C +ATOM 33 CA ALA A 33 231.855 235.464 250.883 1.00 0.00 C +ATOM 34 CA VAL A 34 235.455 234.388 250.253 1.00 0.00 C +ATOM 35 CA ASN A 35 237.173 234.390 246.852 1.00 0.00 C +ATOM 36 CA ASP A 36 240.837 233.412 247.216 1.00 0.00 C +ATOM 37 CA TYR A 37 241.996 230.044 245.863 1.00 0.00 C +ATOM 38 CA ASN A 38 241.702 227.265 243.273 1.00 0.00 C +ATOM 39 CA ASN A 39 243.494 225.182 240.634 1.00 0.00 C +ATOM 40 CA GLY A 40 241.185 223.334 238.231 1.00 0.00 C +ATOM 41 CA GLY A 41 237.486 223.166 239.128 1.00 0.00 C +ATOM 42 CA ASN A 42 235.507 223.277 242.382 1.00 0.00 C +ATOM 43 CA SER A 43 232.524 224.133 244.592 1.00 0.00 C +ATOM 44 CA ALA A 44 232.220 224.664 248.352 1.00 0.00 C +ATOM 45 CA SER A 45 231.059 227.978 249.830 1.00 0.00 C +ATOM 46 CA PRO A 46 228.106 229.720 251.492 1.00 0.00 C +ATOM 47 CA SER A 47 229.330 230.887 254.906 1.00 0.00 C +ATOM 48 CA SER A 48 228.031 233.808 256.979 1.00 0.00 C +ATOM 49 CA GLY A 49 228.538 234.154 260.739 1.00 0.00 C +ATOM 50 CA GLY A 50 230.411 237.003 262.439 1.00 0.00 C +ATOM 51 CA PRO A 51 231.510 238.061 265.931 1.00 0.00 C +ATOM 52 CA PHE A 52 233.444 236.654 268.897 1.00 0.00 C +ATOM 53 CA SER A 53 237.192 236.942 269.518 1.00 0.00 C +TER 54 SER A 53 +END diff --git a/Plants/Q8W332/Q8W332.dcd b/Plants/Q8W332/Q8W332.dcd new file mode 100644 index 0000000000000000000000000000000000000000..a882f53c62842a20f1ae8c781629ded154f04775 --- /dev/null +++ b/Plants/Q8W332/Q8W332.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:0ae60ae65d4d432b773b640b88c21c65310eca79d58ce2f68456a1858cd393ca +size 13760276 diff --git a/Plants/Q8W332/top.pdb b/Plants/Q8W332/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..f2d77a39c99c2167913da49fc0e344eb3a43d70e --- /dev/null +++ b/Plants/Q8W332/top.pdb @@ -0,0 +1,112 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 214.215 248.613 305.395 1.00 0.00 C +ATOM 2 CA ALA A 2 215.391 250.515 302.311 1.00 0.00 C +ATOM 3 CA ARG A 3 214.779 252.766 299.298 1.00 0.00 C +ATOM 4 CA TRP A 4 211.058 253.155 298.581 1.00 0.00 C +ATOM 5 CA SER A 5 210.347 253.214 294.838 1.00 0.00 C +ATOM 6 CA GLU A 6 211.776 256.061 292.748 1.00 0.00 C +ATOM 7 CA GLY A 7 210.400 257.052 289.336 1.00 0.00 C +ATOM 8 CA GLU A 8 212.994 256.055 286.730 1.00 0.00 C +ATOM 9 CA TRP A 9 211.574 254.699 283.465 1.00 0.00 C +ATOM 10 CA GLU A 10 212.416 254.512 279.754 1.00 0.00 C +ATOM 11 CA ARG A 11 215.567 254.131 277.647 1.00 0.00 C +ATOM 12 CA LYS A 12 216.753 253.277 274.129 1.00 0.00 C +ATOM 13 CA GLY A 13 219.885 255.336 273.443 1.00 0.00 C +ATOM 14 CA ARG A 14 221.101 258.793 274.484 1.00 0.00 C +ATOM 15 CA GLY A 15 224.277 259.810 272.640 1.00 0.00 C +ATOM 16 CA GLY A 16 223.542 261.498 269.304 1.00 0.00 C +ATOM 17 CA ALA A 17 225.166 260.117 266.146 1.00 0.00 C +ATOM 18 CA TRP A 18 223.680 257.212 264.180 1.00 0.00 C +ATOM 19 CA VAL A 19 223.477 253.903 262.301 1.00 0.00 C +ATOM 20 CA TYR A 20 221.596 250.611 262.670 1.00 0.00 C +ATOM 21 CA MET A 21 223.537 247.857 260.891 1.00 0.00 C +ATOM 22 CA GLY A 22 226.141 249.385 258.567 1.00 0.00 C +ATOM 23 CA ASP A 23 227.449 251.584 255.744 1.00 0.00 C +ATOM 24 CA ASN A 24 224.329 252.548 253.781 1.00 0.00 C +ATOM 25 CA VAL A 25 221.840 251.826 250.988 1.00 0.00 C +ATOM 26 CA GLY A 26 221.658 250.011 247.643 1.00 0.00 C +ATOM 27 CA ARG A 27 224.557 251.151 245.450 1.00 0.00 C +ATOM 28 CA ARG A 28 226.916 248.293 244.563 1.00 0.00 C +ATOM 29 CA GLY A 29 229.702 246.208 246.113 1.00 0.00 C +ATOM 30 CA MET A 30 229.458 244.888 249.679 1.00 0.00 C +ATOM 31 CA THR A 31 230.764 242.716 252.523 1.00 0.00 C +ATOM 32 CA PRO A 32 232.800 239.742 251.288 1.00 0.00 C +ATOM 33 CA ALA A 33 232.197 236.875 248.853 1.00 0.00 C +ATOM 34 CA GLU A 34 231.518 234.058 246.378 1.00 0.00 C +ATOM 35 CA GLU A 35 234.041 234.075 243.523 1.00 0.00 C +ATOM 36 CA GLU A 36 237.067 231.847 244.149 1.00 0.00 C +ATOM 37 CA LYS A 37 240.567 231.169 245.493 1.00 0.00 C +ATOM 38 CA GLU A 38 242.330 230.064 248.685 1.00 0.00 C +ATOM 39 CA ARG A 39 245.189 228.003 250.134 1.00 0.00 C +ATOM 40 CA LYS A 40 246.164 226.495 253.494 1.00 0.00 C +ATOM 41 CA ARG A 41 245.836 227.143 257.234 1.00 0.00 C +ATOM 42 CA LYS A 42 247.343 228.012 260.623 1.00 0.00 C +ATOM 43 CA GLU A 43 247.656 230.413 263.565 1.00 0.00 C +ATOM 44 CA GLU A 44 249.988 233.339 262.844 1.00 0.00 C +ATOM 45 CA MET A 45 251.352 236.272 264.858 1.00 0.00 C +ATOM 46 CA GLY A 46 249.625 236.481 268.247 1.00 0.00 C +ATOM 47 CA LEU A 47 250.793 233.993 270.887 1.00 0.00 C +ATOM 48 CA ALA A 48 254.523 234.622 271.339 1.00 0.00 C +ATOM 49 CA PRO A 49 256.354 236.257 268.425 1.00 0.00 C +ATOM 50 CA CYS A 50 259.675 236.446 266.568 1.00 0.00 C +ATOM 51 CA HIS A 51 259.499 233.646 263.990 1.00 0.00 C +ATOM 52 CA PHE A 52 260.265 230.254 262.433 1.00 0.00 C +ATOM 53 CA GLY A 53 261.373 229.444 258.879 1.00 0.00 C +ATOM 54 CA LYS A 54 258.171 229.148 256.835 1.00 0.00 C +ATOM 55 CA ARG A 55 257.291 227.117 253.734 1.00 0.00 C +ATOM 56 CA ARG A 56 254.138 228.695 252.290 1.00 0.00 C +ATOM 57 CA GLU A 57 254.746 230.551 249.019 1.00 0.00 C +ATOM 58 CA ARG A 58 258.531 230.506 248.586 1.00 0.00 C +ATOM 59 CA GLY A 59 260.674 231.421 245.571 1.00 0.00 C +ATOM 60 CA ARG A 60 261.607 229.669 242.320 1.00 0.00 C +ATOM 61 CA ARG A 61 264.223 231.601 240.335 1.00 0.00 C +ATOM 62 CA GLY A 62 264.356 234.380 237.731 1.00 0.00 C +ATOM 63 CA ARG A 63 260.968 234.642 236.008 1.00 0.00 C +ATOM 64 CA GLY A 64 260.478 237.604 233.662 1.00 0.00 C +ATOM 65 CA ARG A 65 261.808 241.115 234.312 1.00 0.00 C +ATOM 66 CA ARG A 66 262.416 242.898 231.001 1.00 0.00 C +ATOM 67 CA SER A 67 259.318 244.529 229.498 1.00 0.00 C +ATOM 68 CA SER A 68 257.861 247.208 227.213 1.00 0.00 C +ATOM 69 CA ALA A 69 258.301 250.929 227.902 1.00 0.00 C +ATOM 70 CA SER A 70 259.658 252.359 224.642 1.00 0.00 C +ATOM 71 CA VAL A 71 259.287 251.569 220.933 1.00 0.00 C +ATOM 72 CA PRO A 72 257.318 253.245 218.135 1.00 0.00 C +ATOM 73 CA TRP A 73 258.616 253.668 214.578 1.00 0.00 C +ATOM 74 CA ARG A 74 262.356 252.970 214.778 1.00 0.00 C +ATOM 75 CA LEU A 75 265.555 250.914 214.536 1.00 0.00 C +ATOM 76 CA ALA A 76 268.846 252.480 215.645 1.00 0.00 C +ATOM 77 CA SER A 77 271.374 253.028 218.442 1.00 0.00 C +ATOM 78 CA ALA A 78 273.564 251.950 221.367 1.00 0.00 C +ATOM 79 CA ARG A 79 277.210 253.054 221.432 1.00 0.00 C +ATOM 80 CA SER A 80 279.365 254.084 224.401 1.00 0.00 C +ATOM 81 CA GLY A 81 278.069 257.466 225.583 1.00 0.00 C +ATOM 82 CA GLY A 82 278.987 259.878 228.386 1.00 0.00 C +ATOM 83 CA GLY A 83 276.825 261.359 231.152 1.00 0.00 C +ATOM 84 CA ARG A 84 275.838 263.405 234.210 1.00 0.00 C +ATOM 85 CA VAL A 85 272.084 263.926 233.823 1.00 0.00 C +ATOM 86 CA ASP A 86 269.951 261.730 231.555 1.00 0.00 C +ATOM 87 CA ASP A 87 266.161 262.012 231.833 1.00 0.00 C +ATOM 88 CA ASP A 88 264.952 264.008 234.844 1.00 0.00 C +ATOM 89 CA GLY A 89 264.610 267.748 235.485 1.00 0.00 C +ATOM 90 CA ASP A 90 262.474 270.877 235.886 1.00 0.00 C +ATOM 91 CA ASP A 91 263.456 273.307 238.651 1.00 0.00 C +ATOM 92 CA TYR A 92 264.214 273.053 242.376 1.00 0.00 C +ATOM 93 CA GLY A 93 267.282 271.758 244.227 1.00 0.00 C +ATOM 94 CA GLY A 94 269.088 268.498 245.020 1.00 0.00 C +ATOM 95 CA ASP A 95 271.073 265.925 243.030 1.00 0.00 C +ATOM 96 CA LEU A 96 274.222 264.114 244.176 1.00 0.00 C +ATOM 97 CA GLU A 97 276.817 261.947 245.933 1.00 0.00 C +ATOM 98 CA ARG A 98 279.261 263.732 248.247 1.00 0.00 C +ATOM 99 CA SER A 99 279.997 267.230 249.567 1.00 0.00 C +ATOM 100 CA ASP A 100 282.728 269.351 247.968 1.00 0.00 C +ATOM 101 CA ASP A 101 282.038 272.960 246.961 1.00 0.00 C +ATOM 102 CA THR A 102 283.024 273.431 243.311 1.00 0.00 C +ATOM 103 CA GLY A 103 279.939 274.741 241.499 1.00 0.00 C +ATOM 104 CA ARG A 104 278.067 274.497 238.189 1.00 0.00 C +ATOM 105 CA ARG A 105 275.577 271.619 238.001 1.00 0.00 C +ATOM 106 CA GLY A 106 273.016 270.201 235.563 1.00 0.00 C +ATOM 107 CA ARG A 107 271.318 271.429 232.381 1.00 0.00 C +ATOM 108 CA ARG A 108 268.397 272.015 230.005 1.00 0.00 C +TER 109 ARG A 108 +END diff --git a/Plants/Q8W391/Q8W391.dcd b/Plants/Q8W391/Q8W391.dcd new file mode 100644 index 0000000000000000000000000000000000000000..b361862d9f1532926d7cf6914e7036c50da65384 --- /dev/null +++ b/Plants/Q8W391/Q8W391.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:21a87c6b271b4bd929748224a07efe8fa783819c95f5022c001ffb92993651ca +size 13760276 diff --git a/Plants/Q8W391/top.pdb b/Plants/Q8W391/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..2f5c5ed78e9d3daf906d64e22e3512a37de065cc --- /dev/null +++ b/Plants/Q8W391/top.pdb @@ -0,0 +1,112 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 272.904 246.473 271.915 1.00 0.00 C +ATOM 2 CA SER A 2 273.390 245.517 268.259 1.00 0.00 C +ATOM 3 CA VAL A 3 276.679 245.972 266.391 1.00 0.00 C +ATOM 4 CA TRP A 4 276.506 248.869 263.922 1.00 0.00 C +ATOM 5 CA LYS A 5 278.663 251.958 263.357 1.00 0.00 C +ATOM 6 CA PRO A 6 279.734 254.126 266.301 1.00 0.00 C +ATOM 7 CA THR A 7 283.370 255.261 266.382 1.00 0.00 C +ATOM 8 CA LEU A 8 285.054 254.729 263.006 1.00 0.00 C +ATOM 9 CA GLY A 9 284.281 255.349 259.327 1.00 0.00 C +ATOM 10 CA GLY A 10 283.191 258.732 257.955 1.00 0.00 C +ATOM 11 CA GLN A 11 280.610 259.996 260.456 1.00 0.00 C +ATOM 12 CA GLY A 12 279.373 263.483 261.368 1.00 0.00 C +ATOM 13 CA ALA A 13 278.396 267.067 262.214 1.00 0.00 C +ATOM 14 CA SER A 14 279.238 269.593 259.489 1.00 0.00 C +ATOM 15 CA TRP A 15 281.596 272.582 259.324 1.00 0.00 C +ATOM 16 CA ARG A 16 280.043 275.925 260.287 1.00 0.00 C +ATOM 17 CA SER A 17 279.616 278.542 257.551 1.00 0.00 C +ATOM 18 CA ALA A 18 277.279 279.847 254.840 1.00 0.00 C +ATOM 19 CA LEU A 19 274.344 281.804 256.280 1.00 0.00 C +ATOM 20 CA ALA A 20 273.372 282.385 259.918 1.00 0.00 C +ATOM 21 CA SER A 21 271.843 279.452 261.810 1.00 0.00 C +ATOM 22 CA LYS A 22 269.239 280.793 264.246 1.00 0.00 C +ATOM 23 CA SER A 23 265.780 280.923 262.654 1.00 0.00 C +ATOM 24 CA ALA A 24 262.345 282.237 261.659 1.00 0.00 C +ATOM 25 CA THR A 25 259.955 283.259 264.445 1.00 0.00 C +ATOM 26 CA GLY A 26 258.300 286.553 265.405 1.00 0.00 C +ATOM 27 CA ARG A 27 254.636 287.404 266.015 1.00 0.00 C +ATOM 28 CA ARG A 28 252.214 290.211 266.891 1.00 0.00 C +ATOM 29 CA GLU A 29 248.976 290.175 264.883 1.00 0.00 C +ATOM 30 CA ASP A 30 246.021 291.522 262.890 1.00 0.00 C +ATOM 31 CA ASP A 31 244.276 289.775 259.989 1.00 0.00 C +ATOM 32 CA ALA A 32 244.105 285.987 260.360 1.00 0.00 C +ATOM 33 CA GLY A 33 247.405 284.185 259.745 1.00 0.00 C +ATOM 34 CA GLY A 34 249.934 284.407 262.586 1.00 0.00 C +ATOM 35 CA ARG A 35 253.086 282.666 261.342 1.00 0.00 C +ATOM 36 CA LYS A 36 254.075 281.266 257.940 1.00 0.00 C +ATOM 37 CA ARG A 37 257.709 280.122 257.958 1.00 0.00 C +ATOM 38 CA GLY A 38 259.835 277.145 256.892 1.00 0.00 C +ATOM 39 CA LYS A 39 263.451 277.689 255.824 1.00 0.00 C +ATOM 40 CA GLY A 40 266.139 275.640 254.067 1.00 0.00 C +ATOM 41 CA GLY A 41 268.084 273.027 256.044 1.00 0.00 C +ATOM 42 CA ARG A 42 267.073 270.050 258.196 1.00 0.00 C +ATOM 43 CA GLU A 43 263.431 268.944 258.018 1.00 0.00 C +ATOM 44 CA MET A 44 261.228 269.601 254.979 1.00 0.00 C +ATOM 45 CA GLY A 45 258.357 268.474 252.744 1.00 0.00 C +ATOM 46 CA ALA A 46 256.273 271.080 250.905 1.00 0.00 C +ATOM 47 CA ARG A 47 256.146 270.768 247.110 1.00 0.00 C +ATOM 48 CA PRO A 48 255.202 273.502 244.630 1.00 0.00 C +ATOM 49 CA LEU A 49 251.994 275.317 243.663 1.00 0.00 C +ATOM 50 CA LEU A 50 252.288 275.779 239.892 1.00 0.00 C +ATOM 51 CA LEU A 51 250.096 274.659 236.985 1.00 0.00 C +ATOM 52 CA TRP A 52 248.682 271.186 236.308 1.00 0.00 C +ATOM 53 CA GLU A 53 245.245 270.604 237.846 1.00 0.00 C +ATOM 54 CA LYS A 54 244.573 266.902 237.248 1.00 0.00 C +ATOM 55 CA GLU A 55 243.357 264.102 239.528 1.00 0.00 C +ATOM 56 CA GLU A 56 240.728 262.308 241.621 1.00 0.00 C +ATOM 57 CA GLY A 57 237.655 261.191 243.577 1.00 0.00 C +ATOM 58 CA SER A 58 238.500 259.161 246.688 1.00 0.00 C +ATOM 59 CA GLY A 59 238.519 256.669 249.570 1.00 0.00 C +ATOM 60 CA GLY A 60 239.651 253.031 249.605 1.00 0.00 C +ATOM 61 CA ASP A 61 238.571 249.564 250.760 1.00 0.00 C +ATOM 62 CA ALA A 62 240.397 246.338 249.879 1.00 0.00 C +ATOM 63 CA ALA A 63 242.005 242.886 249.786 1.00 0.00 C +ATOM 64 CA GLU A 64 242.729 239.982 252.144 1.00 0.00 C +ATOM 65 CA GLY A 65 243.591 236.467 253.335 1.00 0.00 C +ATOM 66 CA GLY A 66 244.641 233.362 251.393 1.00 0.00 C +ATOM 67 CA GLY A 67 243.999 229.625 251.022 1.00 0.00 C +ATOM 68 CA ALA A 68 243.929 225.984 252.144 1.00 0.00 C +ATOM 69 CA LEU A 69 240.988 225.083 254.392 1.00 0.00 C +ATOM 70 CA PRO A 70 238.079 223.256 252.744 1.00 0.00 C +ATOM 71 CA PRO A 71 235.597 224.402 250.090 1.00 0.00 C +ATOM 72 CA SER A 72 232.349 222.444 249.723 1.00 0.00 C +ATOM 73 CA LEU A 73 231.202 219.257 251.467 1.00 0.00 C +ATOM 74 CA GLY A 74 228.252 217.341 252.932 1.00 0.00 C +ATOM 75 CA GLY A 75 225.080 215.325 253.559 1.00 0.00 C +ATOM 76 CA LEU A 76 222.686 215.243 250.597 1.00 0.00 C +ATOM 77 CA ARG A 77 221.255 212.804 248.044 1.00 0.00 C +ATOM 78 CA SER A 78 218.770 213.997 245.414 1.00 0.00 C +ATOM 79 CA GLU A 79 220.031 212.846 242.007 1.00 0.00 C +ATOM 80 CA TRP A 80 223.462 211.194 241.879 1.00 0.00 C +ATOM 81 CA ARG A 81 226.254 213.562 242.933 1.00 0.00 C +ATOM 82 CA GLY A 82 226.350 217.219 241.867 1.00 0.00 C +ATOM 83 CA ARG A 83 223.363 219.539 241.413 1.00 0.00 C +ATOM 84 CA GLY A 84 222.760 223.299 241.290 1.00 0.00 C +ATOM 85 CA ASP A 85 224.864 226.475 241.324 1.00 0.00 C +ATOM 86 CA ASP A 86 226.993 228.344 238.777 1.00 0.00 C +ATOM 87 CA ASP A 87 225.104 230.424 236.203 1.00 0.00 C +ATOM 88 CA GLY A 88 226.647 229.913 232.757 1.00 0.00 C +ATOM 89 CA ASP A 89 227.148 226.161 232.322 1.00 0.00 C +ATOM 90 CA ASP A 90 226.143 223.114 230.269 1.00 0.00 C +ATOM 91 CA GLY A 91 229.325 221.862 228.589 1.00 0.00 C +ATOM 92 CA GLY A 92 232.521 223.382 230.000 1.00 0.00 C +ATOM 93 CA ALA A 93 232.721 223.939 233.764 1.00 0.00 C +ATOM 94 CA VAL A 94 234.404 225.680 236.705 1.00 0.00 C +ATOM 95 CA TRP A 95 236.971 224.472 239.249 1.00 0.00 C +ATOM 96 CA SER A 96 240.003 222.695 237.778 1.00 0.00 C +ATOM 97 CA GLU A 97 240.947 222.139 234.129 1.00 0.00 C +ATOM 98 CA ALA A 98 242.150 223.634 230.837 1.00 0.00 C +ATOM 99 CA VAL A 99 244.307 221.573 228.468 1.00 0.00 C +ATOM 100 CA THR A 100 248.071 221.887 228.968 1.00 0.00 C +ATOM 101 CA ARG A 101 248.914 223.637 232.246 1.00 0.00 C +ATOM 102 CA ALA A 102 248.837 224.857 235.854 1.00 0.00 C +ATOM 103 CA THR A 103 246.961 222.815 238.467 1.00 0.00 C +ATOM 104 CA GLY A 104 245.876 219.599 236.737 1.00 0.00 C +ATOM 105 CA VAL A 105 244.109 216.666 238.409 1.00 0.00 C +ATOM 106 CA GLY A 106 242.877 213.289 239.670 1.00 0.00 C +ATOM 107 CA ARG A 107 241.295 209.944 238.761 1.00 0.00 C +ATOM 108 CA ARG A 108 242.430 206.498 237.599 1.00 0.00 C +TER 109 ARG A 108 +END diff --git a/Plants/Q8W3B0/Q8W3B0.dcd b/Plants/Q8W3B0/Q8W3B0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..b6f018627c0fbde9bfb1ed5256b863e95bc9c1b7 --- /dev/null +++ b/Plants/Q8W3B0/Q8W3B0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:3628c798d2a0d2eb0ad749a2fe8284587c1cdc78c3192507dde1897433c1f5da +size 16760276 diff --git a/Plants/Q8W3B0/top.pdb b/Plants/Q8W3B0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..5cb43f3f1ea444c095fb8f0c787f6c4fd3ee4f25 --- /dev/null +++ b/Plants/Q8W3B0/top.pdb @@ -0,0 +1,137 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 299.453 242.522 246.801 1.00 0.00 C +ATOM 2 CA VAL A 2 298.746 241.526 250.410 1.00 0.00 C +ATOM 3 CA ALA A 3 301.364 242.036 253.130 1.00 0.00 C +ATOM 4 CA GLY A 4 302.879 241.096 256.497 1.00 0.00 C +ATOM 5 CA GLY A 5 301.253 238.300 258.511 1.00 0.00 C +ATOM 6 CA ASP A 6 299.848 235.450 256.409 1.00 0.00 C +ATOM 7 CA LEU A 7 296.070 235.937 256.322 1.00 0.00 C +ATOM 8 CA ARG A 8 293.444 235.805 253.564 1.00 0.00 C +ATOM 9 CA ARG A 9 290.743 238.247 252.444 1.00 0.00 C +ATOM 10 CA ASP A 10 289.063 240.876 254.631 1.00 0.00 C +ATOM 11 CA GLY A 11 289.487 241.629 258.341 1.00 0.00 C +ATOM 12 CA ALA A 12 286.475 241.542 260.672 1.00 0.00 C +ATOM 13 CA ALA A 13 286.611 238.521 262.990 1.00 0.00 C +ATOM 14 CA PRO A 14 290.012 237.964 264.616 1.00 0.00 C +ATOM 15 CA GLU A 15 292.585 237.609 267.403 1.00 0.00 C +ATOM 16 CA ARG A 16 296.193 238.589 268.136 1.00 0.00 C +ATOM 17 CA GLY A 17 299.232 237.585 266.069 1.00 0.00 C +ATOM 18 CA GLU A 18 302.136 240.047 265.920 1.00 0.00 C +ATOM 19 CA GLY A 19 303.467 243.564 265.306 1.00 0.00 C +ATOM 20 CA ARG A 20 300.868 246.349 265.238 1.00 0.00 C +ATOM 21 CA ARG A 21 299.940 247.454 261.712 1.00 0.00 C +ATOM 22 CA LYS A 22 300.866 249.675 258.757 1.00 0.00 C +ATOM 23 CA ARG A 23 299.790 248.448 255.315 1.00 0.00 C +ATOM 24 CA ASP A 24 301.299 248.517 251.817 1.00 0.00 C +ATOM 25 CA GLY A 25 302.748 251.255 249.600 1.00 0.00 C +ATOM 26 CA GLY A 26 299.860 252.475 247.435 1.00 0.00 C +ATOM 27 CA PRO A 27 297.232 253.860 249.820 1.00 0.00 C +ATOM 28 CA ARG A 28 293.691 254.867 248.836 1.00 0.00 C +ATOM 29 CA LEU A 29 289.917 254.713 248.337 1.00 0.00 C +ATOM 30 CA THR A 30 286.486 253.088 248.015 1.00 0.00 C +ATOM 31 CA PRO A 31 283.494 255.288 248.868 1.00 0.00 C +ATOM 32 CA GLY A 32 280.200 257.111 249.450 1.00 0.00 C +ATOM 33 CA ARG A 33 277.426 255.424 247.455 1.00 0.00 C +ATOM 34 CA ARG A 34 274.373 253.214 248.015 1.00 0.00 C +ATOM 35 CA ARG A 35 274.673 249.980 250.007 1.00 0.00 C +ATOM 36 CA ARG A 36 271.114 249.152 251.086 1.00 0.00 C +ATOM 37 CA ARG A 37 271.150 245.759 252.819 1.00 0.00 C +ATOM 38 CA LYS A 38 271.321 242.522 250.817 1.00 0.00 C +ATOM 39 CA ARG A 39 269.228 240.861 248.101 1.00 0.00 C +ATOM 40 CA ARG A 40 269.821 241.180 244.351 1.00 0.00 C +ATOM 41 CA PRO A 41 269.615 243.119 241.078 1.00 0.00 C +ATOM 42 CA LYS A 42 269.533 240.596 238.224 1.00 0.00 C +ATOM 43 CA ARG A 43 268.317 241.530 234.736 1.00 0.00 C +ATOM 44 CA ARG A 44 267.387 238.597 232.489 1.00 0.00 C +ATOM 45 CA GLU A 45 266.208 236.829 229.326 1.00 0.00 C +ATOM 46 CA ALA A 46 262.882 238.315 228.208 1.00 0.00 C +ATOM 47 CA ALA A 47 261.427 241.495 229.719 1.00 0.00 C +ATOM 48 CA ALA A 48 260.103 245.041 229.286 1.00 0.00 C +ATOM 49 CA ARG A 49 258.811 246.425 232.593 1.00 0.00 C +ATOM 50 CA LEU A 50 255.578 247.107 234.490 1.00 0.00 C +ATOM 51 CA GLY A 51 254.119 250.623 234.637 1.00 0.00 C +ATOM 52 CA SER A 52 250.395 251.257 234.140 1.00 0.00 C +ATOM 53 CA THR A 53 247.906 248.428 233.573 1.00 0.00 C +ATOM 54 CA ARG A 54 244.983 246.477 235.043 1.00 0.00 C +ATOM 55 CA THR A 55 244.073 243.722 237.512 1.00 0.00 C +ATOM 56 CA ALA A 56 243.677 240.313 239.167 1.00 0.00 C +ATOM 57 CA ALA A 57 242.265 237.064 237.765 1.00 0.00 C +ATOM 58 CA PHE A 58 241.073 233.456 237.488 1.00 0.00 C +ATOM 59 CA ARG A 59 237.771 231.893 238.572 1.00 0.00 C +ATOM 60 CA ARG A 60 234.351 230.973 237.169 1.00 0.00 C +ATOM 61 CA SER A 61 231.414 230.807 239.591 1.00 0.00 C +ATOM 62 CA ALA A 62 232.080 232.618 242.876 1.00 0.00 C +ATOM 63 CA GLY A 63 235.390 234.190 243.920 1.00 0.00 C +ATOM 64 CA GLU A 64 236.275 237.565 242.391 1.00 0.00 C +ATOM 65 CA THR A 65 237.114 240.978 243.861 1.00 0.00 C +ATOM 66 CA LYS A 66 234.379 243.048 245.519 1.00 0.00 C +ATOM 67 CA GLY A 67 231.486 241.202 247.174 1.00 0.00 C +ATOM 68 CA TRP A 68 228.725 238.581 247.022 1.00 0.00 C +ATOM 69 CA THR A 69 227.051 239.155 243.648 1.00 0.00 C +ATOM 70 CA ARG A 70 229.548 238.296 240.902 1.00 0.00 C +ATOM 71 CA SER A 71 231.769 238.523 237.814 1.00 0.00 C +ATOM 72 CA THR A 72 234.102 241.422 236.997 1.00 0.00 C +ATOM 73 CA GLY A 73 234.623 245.048 235.947 1.00 0.00 C +ATOM 74 CA THR A 74 234.995 248.498 234.375 1.00 0.00 C +ATOM 75 CA ARG A 75 237.301 251.359 235.384 1.00 0.00 C +ATOM 76 CA ARG A 76 239.436 251.559 238.533 1.00 0.00 C +ATOM 77 CA SER A 77 238.014 252.855 241.822 1.00 0.00 C +ATOM 78 CA ARG A 78 234.582 254.224 242.750 1.00 0.00 C +ATOM 79 CA ARG A 79 231.858 254.126 240.088 1.00 0.00 C +ATOM 80 CA ARG A 80 229.648 252.222 237.637 1.00 0.00 C +ATOM 81 CA ARG A 81 229.402 254.303 234.455 1.00 0.00 C +ATOM 82 CA CYS A 82 230.920 254.738 230.988 1.00 0.00 C +ATOM 83 CA ARG A 83 230.972 258.294 229.621 1.00 0.00 C +ATOM 84 CA SER A 84 232.889 260.214 226.945 1.00 0.00 C +ATOM 85 CA GLY A 85 230.494 260.751 224.031 1.00 0.00 C +ATOM 86 CA ARG A 86 227.412 262.776 223.073 1.00 0.00 C +ATOM 87 CA ARG A 87 227.096 266.538 222.558 1.00 0.00 C +ATOM 88 CA THR A 88 227.252 268.078 226.039 1.00 0.00 C +ATOM 89 CA GLY A 89 224.717 269.474 228.517 1.00 0.00 C +ATOM 90 CA ALA A 90 221.971 270.502 230.949 1.00 0.00 C +ATOM 91 CA THR A 91 219.043 272.361 229.371 1.00 0.00 C +ATOM 92 CA THR A 92 215.690 270.582 229.705 1.00 0.00 C +ATOM 93 CA ALA A 93 214.607 267.847 232.126 1.00 0.00 C +ATOM 94 CA ALA A 94 216.418 268.346 235.441 1.00 0.00 C +ATOM 95 CA ASP A 95 217.012 271.396 237.645 1.00 0.00 C +ATOM 96 CA ARG A 96 216.004 272.439 241.168 1.00 0.00 C +ATOM 97 CA SER A 97 212.236 272.596 241.706 1.00 0.00 C +ATOM 98 CA LEU A 98 209.829 269.848 242.790 1.00 0.00 C +ATOM 99 CA ALA A 99 211.231 267.201 245.145 1.00 0.00 C +ATOM 100 CA ALA A 100 213.161 264.230 246.547 1.00 0.00 C +ATOM 101 CA THR A 101 214.490 260.668 246.799 1.00 0.00 C +ATOM 102 CA ALA A 102 217.074 258.371 248.400 1.00 0.00 C +ATOM 103 CA GLU A 103 216.423 255.140 250.310 1.00 0.00 C +ATOM 104 CA ARG A 104 218.024 254.572 253.720 1.00 0.00 C +ATOM 105 CA GLU A 105 219.382 256.440 256.750 1.00 0.00 C +ATOM 106 CA ASP A 106 220.522 259.944 257.720 1.00 0.00 C +ATOM 107 CA ASP A 107 222.552 263.050 256.853 1.00 0.00 C +ATOM 108 CA GLY A 108 222.496 266.768 257.682 1.00 0.00 C +ATOM 109 CA ALA A 109 219.882 269.462 258.333 1.00 0.00 C +ATOM 110 CA SER A 110 218.924 270.844 261.752 1.00 0.00 C +ATOM 111 CA SER A 111 221.360 271.854 264.502 1.00 0.00 C +ATOM 112 CA ILE A 112 223.846 270.002 266.718 1.00 0.00 C +ATOM 113 CA PRO A 113 222.691 267.722 269.544 1.00 0.00 C +ATOM 114 CA THR A 114 218.894 267.456 269.380 1.00 0.00 C +ATOM 115 CA GLY A 115 218.105 263.889 268.298 1.00 0.00 C +ATOM 116 CA ARG A 116 221.268 261.908 269.063 1.00 0.00 C +ATOM 117 CA ALA A 117 223.996 259.292 269.546 1.00 0.00 C +ATOM 118 CA SER A 118 226.533 260.473 272.131 1.00 0.00 C +ATOM 119 CA GLY A 119 226.688 259.517 275.816 1.00 0.00 C +ATOM 120 CA GLU A 120 230.183 260.068 277.228 1.00 0.00 C +ATOM 121 CA ARG A 121 233.036 257.856 278.445 1.00 0.00 C +ATOM 122 CA ARG A 122 235.991 255.496 278.911 1.00 0.00 C +ATOM 123 CA LYS A 123 238.013 252.662 280.459 1.00 0.00 C +ATOM 124 CA ARG A 124 238.230 249.235 282.110 1.00 0.00 C +ATOM 125 CA ARG A 125 236.699 246.266 283.943 1.00 0.00 C +ATOM 126 CA ARG A 126 233.396 245.091 282.453 1.00 0.00 C +ATOM 127 CA GLU A 127 230.399 242.868 281.682 1.00 0.00 C +ATOM 128 CA ALA A 128 228.231 240.838 279.295 1.00 0.00 C +ATOM 129 CA ARG A 129 225.895 241.105 276.297 1.00 0.00 C +ATOM 130 CA GLY A 130 225.473 237.610 274.840 1.00 0.00 C +ATOM 131 CA ALA A 131 227.570 234.434 275.035 1.00 0.00 C +ATOM 132 CA ILE A 132 229.862 234.024 278.051 1.00 0.00 C +ATOM 133 CA ILE A 133 230.697 232.988 281.621 1.00 0.00 C +TER 134 ILE A 133 +END diff --git a/Plants/Q8W3B8/Q8W3B8.dcd b/Plants/Q8W3B8/Q8W3B8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..3ed13472b8116728d615355d7e76cfd98ef1771d --- /dev/null +++ b/Plants/Q8W3B8/Q8W3B8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:7e39fdc123d5e1a22cb02a483292b216489ad4f8070245ceb5eab2f860f06324 +size 11000276 diff --git a/Plants/Q8W3B8/top.pdb b/Plants/Q8W3B8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..c0e58d9c6eceef7eccec9ab202cfcf8a29698320 --- /dev/null +++ b/Plants/Q8W3B8/top.pdb @@ -0,0 +1,89 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 249.960 256.033 257.464 1.00 0.00 C +ATOM 2 CA ALA A 2 246.345 254.865 257.749 1.00 0.00 C +ATOM 3 CA THR A 3 243.350 253.901 259.898 1.00 0.00 C +ATOM 4 CA ARG A 4 240.843 252.462 257.416 1.00 0.00 C +ATOM 5 CA GLY A 5 237.170 252.688 256.430 1.00 0.00 C +ATOM 6 CA ASP A 6 234.636 250.015 255.454 1.00 0.00 C +ATOM 7 CA ALA A 7 232.527 247.767 253.215 1.00 0.00 C +ATOM 8 CA THR A 8 233.513 248.015 249.543 1.00 0.00 C +ATOM 9 CA VAL A 9 232.162 249.934 246.541 1.00 0.00 C +ATOM 10 CA THR A 10 230.156 250.988 243.479 1.00 0.00 C +ATOM 11 CA VAL A 11 228.560 254.262 242.361 1.00 0.00 C +ATOM 12 CA THR A 12 228.573 257.650 240.618 1.00 0.00 C +ATOM 13 CA ALA A 13 231.930 258.727 239.173 1.00 0.00 C +ATOM 14 CA ARG A 14 234.111 259.548 242.187 1.00 0.00 C +ATOM 15 CA GLN A 15 237.701 258.296 242.434 1.00 0.00 C +ATOM 16 CA ARG A 16 240.443 260.921 242.766 1.00 0.00 C +ATOM 17 CA ARG A 17 239.597 263.762 245.160 1.00 0.00 C +ATOM 18 CA GLY A 18 237.345 266.533 243.830 1.00 0.00 C +ATOM 19 CA ALA A 19 235.480 267.121 240.561 1.00 0.00 C +ATOM 20 CA ARG A 20 232.046 265.489 240.804 1.00 0.00 C +ATOM 21 CA ARG A 21 230.302 266.043 244.146 1.00 0.00 C +ATOM 22 CA GLY A 22 229.478 266.594 247.825 1.00 0.00 C +ATOM 23 CA GLY A 23 229.625 266.282 251.619 1.00 0.00 C +ATOM 24 CA GLY A 24 232.636 267.179 253.774 1.00 0.00 C +ATOM 25 CA ASP A 25 236.378 267.403 253.092 1.00 0.00 C +ATOM 26 CA GLY A 26 238.762 269.153 255.493 1.00 0.00 C +ATOM 27 CA ASP A 27 242.236 270.365 256.483 1.00 0.00 C +ATOM 28 CA ALA A 28 244.664 268.221 258.489 1.00 0.00 C +ATOM 29 CA ALA A 29 245.332 264.511 259.043 1.00 0.00 C +ATOM 30 CA ALA A 30 248.332 262.663 257.593 1.00 0.00 C +ATOM 31 CA VAL A 31 249.767 261.427 254.287 1.00 0.00 C +ATOM 32 CA ARG A 32 247.838 262.862 251.332 1.00 0.00 C +ATOM 33 CA TRP A 33 248.841 263.863 247.795 1.00 0.00 C +ATOM 34 CA ASP A 34 252.048 264.752 245.940 1.00 0.00 C +ATOM 35 CA GLY A 35 252.146 263.330 242.407 1.00 0.00 C +ATOM 36 CA ALA A 36 250.221 264.152 239.223 1.00 0.00 C +ATOM 37 CA ARG A 37 250.920 266.929 236.710 1.00 0.00 C +ATOM 38 CA HIS A 38 251.014 268.003 233.055 1.00 0.00 C +ATOM 39 CA GLY A 39 254.618 268.635 231.993 1.00 0.00 C +ATOM 40 CA SER A 40 257.040 271.204 233.425 1.00 0.00 C +ATOM 41 CA THR A 41 259.958 271.591 235.844 1.00 0.00 C +ATOM 42 CA ARG A 42 262.933 271.275 238.204 1.00 0.00 C +ATOM 43 CA GLY A 43 264.160 267.685 238.555 1.00 0.00 C +ATOM 44 CA ALA A 44 267.132 267.023 240.846 1.00 0.00 C +ATOM 45 CA ARG A 45 266.337 263.961 242.968 1.00 0.00 C +ATOM 46 CA ALA A 46 267.472 260.614 241.544 1.00 0.00 C +ATOM 47 CA ARG A 47 266.597 256.998 240.726 1.00 0.00 C +ATOM 48 CA ARG A 48 263.559 254.704 240.895 1.00 0.00 C +ATOM 49 CA ARG A 49 263.400 252.107 238.112 1.00 0.00 C +ATOM 50 CA GLN A 50 260.467 249.851 239.020 1.00 0.00 C +ATOM 51 CA GLN A 51 261.666 246.267 238.538 1.00 0.00 C +ATOM 52 CA SER A 52 262.538 243.358 236.237 1.00 0.00 C +ATOM 53 CA THR A 53 263.458 240.075 237.936 1.00 0.00 C +ATOM 54 CA VAL A 54 266.887 240.668 239.488 1.00 0.00 C +ATOM 55 CA ALA A 55 267.810 242.867 242.459 1.00 0.00 C +ATOM 56 CA ALA A 56 270.354 240.859 244.462 1.00 0.00 C +ATOM 57 CA THR A 57 272.201 239.000 247.228 1.00 0.00 C +ATOM 58 CA ALA A 58 275.833 239.057 248.378 1.00 0.00 C +ATOM 59 CA ARG A 59 277.847 242.281 248.134 1.00 0.00 C +ATOM 60 CA GLN A 60 275.699 245.075 249.582 1.00 0.00 C +ATOM 61 CA ARG A 61 273.076 245.379 252.328 1.00 0.00 C +ATOM 62 CA ALA A 62 270.738 242.480 253.132 1.00 0.00 C +ATOM 63 CA ARG A 63 268.325 242.180 256.066 1.00 0.00 C +ATOM 64 CA GLY A 64 266.272 239.765 258.179 1.00 0.00 C +ATOM 65 CA ASP A 65 266.203 236.146 259.369 1.00 0.00 C +ATOM 66 CA GLY A 66 264.231 233.246 257.880 1.00 0.00 C +ATOM 67 CA MET A 67 262.320 230.687 259.958 1.00 0.00 C +ATOM 68 CA ALA A 68 260.643 230.008 263.311 1.00 0.00 C +ATOM 69 CA MET A 69 256.955 229.280 262.686 1.00 0.00 C +ATOM 70 CA ALA A 70 254.136 231.792 263.197 1.00 0.00 C +ATOM 71 CA ARG A 71 252.168 234.764 264.542 1.00 0.00 C +ATOM 72 CA ARG A 72 252.461 234.964 268.335 1.00 0.00 C +ATOM 73 CA ASP A 73 250.511 232.698 270.697 1.00 0.00 C +ATOM 74 CA VAL A 74 246.959 231.338 270.931 1.00 0.00 C +ATOM 75 CA ASP A 75 243.431 232.572 270.194 1.00 0.00 C +ATOM 76 CA GLY A 76 243.703 234.789 267.107 1.00 0.00 C +ATOM 77 CA ASP A 77 243.187 232.690 263.970 1.00 0.00 C +ATOM 78 CA GLY A 78 241.996 229.848 261.730 1.00 0.00 C +ATOM 79 CA SER A 79 242.270 228.039 258.388 1.00 0.00 C +ATOM 80 CA SER A 80 242.198 225.108 255.954 1.00 0.00 C +ATOM 81 CA GLY A 81 240.608 223.125 253.116 1.00 0.00 C +ATOM 82 CA LEU A 82 241.419 219.402 253.062 1.00 0.00 C +ATOM 83 CA LYS A 83 239.014 216.918 254.663 1.00 0.00 C +ATOM 84 CA ALA A 84 237.250 213.543 254.547 1.00 0.00 C +ATOM 85 CA GLY A 85 234.973 211.373 256.697 1.00 0.00 C +TER 86 GLY A 85 +END diff --git a/Plants/Q8W542/Q8W542.dcd b/Plants/Q8W542/Q8W542.dcd new file mode 100644 index 0000000000000000000000000000000000000000..432f942db676b5d542b954ca91c76f6e50618e28 --- /dev/null +++ b/Plants/Q8W542/Q8W542.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:31ecd5d7038e4a0731a850e8829bebac4c4cecdae4ac07509e9d123c1ee4f3c3 +size 8720276 diff --git a/Plants/Q8W542/top.pdb b/Plants/Q8W542/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..0d264e3e1e8792873e85a3ee8210e77c25506e0b --- /dev/null +++ b/Plants/Q8W542/top.pdb @@ -0,0 +1,70 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA LYS A 1 251.529 291.315 262.205 1.00 0.00 C +ATOM 2 CA GLU A 2 252.698 288.441 264.415 1.00 0.00 C +ATOM 3 CA LYS A 3 249.985 285.943 265.373 1.00 0.00 C +ATOM 4 CA LYS A 4 249.922 285.482 269.154 1.00 0.00 C +ATOM 5 CA LYS A 5 249.865 286.186 272.898 1.00 0.00 C +ATOM 6 CA HIS A 6 253.151 285.129 274.512 1.00 0.00 C +ATOM 7 CA GLU A 7 252.272 284.210 278.104 1.00 0.00 C +ATOM 8 CA ASP A 8 251.917 280.419 278.213 1.00 0.00 C +ATOM 9 CA THR A 9 250.447 277.169 276.872 1.00 0.00 C +ATOM 10 CA ALA A 10 248.737 276.475 273.538 1.00 0.00 C +ATOM 11 CA VAL A 11 245.028 275.872 272.911 1.00 0.00 C +ATOM 12 CA PRO A 12 243.628 274.744 276.270 1.00 0.00 C +ATOM 13 CA VAL A 13 244.216 271.678 278.454 1.00 0.00 C +ATOM 14 CA GLU A 14 246.682 269.576 280.459 1.00 0.00 C +ATOM 15 CA LYS A 15 249.206 266.971 279.293 1.00 0.00 C +ATOM 16 CA VAL A 16 249.371 263.168 279.141 1.00 0.00 C +ATOM 17 CA GLU A 17 249.301 259.994 277.035 1.00 0.00 C +ATOM 18 CA VAL A 18 250.328 256.334 277.287 1.00 0.00 C +ATOM 19 CA ASP A 19 247.547 253.731 277.239 1.00 0.00 C +ATOM 20 CA PRO A 20 244.072 252.190 276.973 1.00 0.00 C +ATOM 21 CA GLU A 21 241.152 252.692 274.578 1.00 0.00 C +ATOM 22 CA HIS A 22 240.756 251.142 271.121 1.00 0.00 C +ATOM 23 CA GLN A 23 238.349 249.681 268.554 1.00 0.00 C +ATOM 24 CA LYS A 24 238.219 245.882 268.804 1.00 0.00 C +ATOM 25 CA GLY A 25 239.221 244.140 265.567 1.00 0.00 C +ATOM 26 CA PHE A 26 240.071 245.632 262.166 1.00 0.00 C +ATOM 27 CA LEU A 27 241.639 243.694 259.285 1.00 0.00 C +ATOM 28 CA ASP A 28 244.296 240.988 259.655 1.00 0.00 C +ATOM 29 CA LYS A 29 247.989 240.297 259.023 1.00 0.00 C +ATOM 30 CA ILE A 30 250.920 242.292 257.628 1.00 0.00 C +ATOM 31 CA LYS A 31 251.710 242.190 253.902 1.00 0.00 C +ATOM 32 CA GLU A 32 250.867 238.959 252.068 1.00 0.00 C +ATOM 33 CA LYS A 33 249.680 235.427 252.863 1.00 0.00 C +ATOM 34 CA LEU A 34 249.967 232.660 250.259 1.00 0.00 C +ATOM 35 CA PRO A 35 247.061 231.836 247.937 1.00 0.00 C +ATOM 36 CA SER A 36 246.038 234.468 245.380 1.00 0.00 C +ATOM 37 CA HIS A 37 245.202 237.566 243.325 1.00 0.00 C +ATOM 38 CA HIS A 38 242.027 239.330 242.176 1.00 0.00 C +ATOM 39 CA LYS A 39 239.174 238.583 239.763 1.00 0.00 C +ATOM 40 CA LYS A 40 238.085 236.381 236.851 1.00 0.00 C +ATOM 41 CA THR A 41 238.515 232.610 237.192 1.00 0.00 C +ATOM 42 CA GLU A 42 241.996 231.505 236.107 1.00 0.00 C +ATOM 43 CA GLU A 43 244.122 234.393 234.820 1.00 0.00 C +ATOM 44 CA VAL A 44 247.103 233.532 232.609 1.00 0.00 C +ATOM 45 CA VAL A 45 249.071 234.718 229.570 1.00 0.00 C +ATOM 46 CA VAL A 46 251.219 236.743 227.161 1.00 0.00 C +ATOM 47 CA PRO A 47 251.836 235.420 223.642 1.00 0.00 C +ATOM 48 CA PRO A 48 255.361 236.307 222.499 1.00 0.00 C +ATOM 49 CA THR A 49 258.330 235.794 220.167 1.00 0.00 C +ATOM 50 CA SER A 50 260.603 234.050 217.657 1.00 0.00 C +ATOM 51 CA SER A 51 262.953 232.802 214.930 1.00 0.00 C +ATOM 52 CA THR A 52 265.544 235.533 214.342 1.00 0.00 C +ATOM 53 CA GLU A 53 264.231 239.008 215.188 1.00 0.00 C +ATOM 54 CA TYR A 54 260.962 240.552 216.389 1.00 0.00 C +ATOM 55 CA GLY A 55 261.086 242.790 219.471 1.00 0.00 C +ATOM 56 CA GLY A 56 260.246 243.328 223.148 1.00 0.00 C +ATOM 57 CA HIS A 57 260.936 241.224 226.249 1.00 0.00 C +ATOM 58 CA ALA A 58 259.098 239.815 229.274 1.00 0.00 C +ATOM 59 CA HIS A 59 258.972 236.181 230.409 1.00 0.00 C +ATOM 60 CA THR A 60 255.959 235.471 232.631 1.00 0.00 C +ATOM 61 CA GLU A 61 254.266 236.754 235.794 1.00 0.00 C +ATOM 62 CA THR A 62 252.443 240.099 235.782 1.00 0.00 C +ATOM 63 CA SER A 63 251.957 242.207 232.646 1.00 0.00 C +ATOM 64 CA ALA A 64 254.051 245.235 231.666 1.00 0.00 C +ATOM 65 CA ALA A 65 256.681 246.787 229.388 1.00 0.00 C +ATOM 66 CA VAL A 66 260.132 248.276 230.016 1.00 0.00 C +TER 67 VAL A 66 +END diff --git a/Plants/Q8W5N0/Q8W5N0.dcd b/Plants/Q8W5N0/Q8W5N0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..13e3df289e29fd9925283e09429f9b825f122fbd --- /dev/null +++ b/Plants/Q8W5N0/Q8W5N0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e48228e79e70926adc46a08d69f8fd782f5444201f89599dd799f2914786f96a +size 12200276 diff --git a/Plants/Q8W5N0/top.pdb b/Plants/Q8W5N0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..c4eb293b6c55c0592902c72cf8ccbba0f4cbaae9 --- /dev/null +++ b/Plants/Q8W5N0/top.pdb @@ -0,0 +1,99 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 223.300 262.649 227.668 1.00 0.00 C +ATOM 2 CA GLY A 2 220.479 263.814 225.388 1.00 0.00 C +ATOM 3 CA GLY A 3 219.218 267.195 226.611 1.00 0.00 C +ATOM 4 CA ARG A 4 215.622 268.417 226.312 1.00 0.00 C +ATOM 5 CA GLU A 5 212.669 268.198 223.915 1.00 0.00 C +ATOM 6 CA ARG A 6 209.986 266.178 222.115 1.00 0.00 C +ATOM 7 CA ARG A 7 206.627 265.192 223.619 1.00 0.00 C +ATOM 8 CA THR A 8 205.773 266.396 227.131 1.00 0.00 C +ATOM 9 CA GLU A 9 207.387 267.483 230.407 1.00 0.00 C +ATOM 10 CA GLU A 10 210.440 265.490 231.514 1.00 0.00 C +ATOM 11 CA ARG A 11 214.107 265.121 232.481 1.00 0.00 C +ATOM 12 CA ARG A 12 216.664 267.069 234.526 1.00 0.00 C +ATOM 13 CA GLY A 13 216.863 267.495 238.307 1.00 0.00 C +ATOM 14 CA THR A 14 217.868 265.789 241.562 1.00 0.00 C +ATOM 15 CA SER A 15 219.338 262.276 241.453 1.00 0.00 C +ATOM 16 CA SER A 16 222.154 261.645 238.965 1.00 0.00 C +ATOM 17 CA SER A 17 221.391 258.263 237.385 1.00 0.00 C +ATOM 18 CA PRO A 18 221.330 256.474 234.022 1.00 0.00 C +ATOM 19 CA PRO A 19 221.139 252.677 233.765 1.00 0.00 C +ATOM 20 CA VAL A 20 217.810 250.824 233.770 1.00 0.00 C +ATOM 21 CA GLY A 21 215.060 250.548 231.148 1.00 0.00 C +ATOM 22 CA ALA A 22 214.491 248.404 228.050 1.00 0.00 C +ATOM 23 CA GLU A 23 217.019 245.769 226.964 1.00 0.00 C +ATOM 24 CA GLY A 24 218.944 242.982 228.710 1.00 0.00 C +ATOM 25 CA ARG A 25 219.710 244.013 232.297 1.00 0.00 C +ATOM 26 CA ARG A 26 218.854 244.217 236.004 1.00 0.00 C +ATOM 27 CA GLU A 27 221.058 246.837 237.676 1.00 0.00 C +ATOM 28 CA ARG A 28 223.842 249.264 238.611 1.00 0.00 C +ATOM 29 CA LEU A 29 225.314 252.252 240.460 1.00 0.00 C +ATOM 30 CA THR A 30 227.127 255.322 241.805 1.00 0.00 C +ATOM 31 CA ALA A 31 228.379 257.415 244.732 1.00 0.00 C +ATOM 32 CA GLY A 32 230.050 258.426 248.003 1.00 0.00 C +ATOM 33 CA GLN A 33 231.483 256.703 251.084 1.00 0.00 C +ATOM 34 CA SER A 34 235.168 255.926 250.511 1.00 0.00 C +ATOM 35 CA GLY A 35 238.812 256.706 249.714 1.00 0.00 C +ATOM 36 CA GLY A 36 240.787 259.493 251.402 1.00 0.00 C +ATOM 37 CA VAL A 37 243.054 258.271 254.209 1.00 0.00 C +ATOM 38 CA ALA A 38 245.524 257.207 256.908 1.00 0.00 C +ATOM 39 CA ARG A 39 248.853 255.549 257.737 1.00 0.00 C +ATOM 40 CA ALA A 40 251.064 253.342 259.918 1.00 0.00 C +ATOM 41 CA LYS A 41 254.778 252.511 259.752 1.00 0.00 C +ATOM 42 CA GLY A 42 258.425 253.535 260.161 1.00 0.00 C +ATOM 43 CA ARG A 43 261.789 252.037 259.180 1.00 0.00 C +ATOM 44 CA ARG A 44 263.970 250.282 256.597 1.00 0.00 C +ATOM 45 CA GLU A 45 262.473 248.293 253.713 1.00 0.00 C +ATOM 46 CA GLN A 46 260.603 247.086 250.621 1.00 0.00 C +ATOM 47 CA LEU A 47 258.685 248.035 247.468 1.00 0.00 C +ATOM 48 CA THR A 48 261.294 248.625 244.755 1.00 0.00 C +ATOM 49 CA ASP A 49 263.976 251.156 245.709 1.00 0.00 C +ATOM 50 CA GLY A 50 267.573 252.267 245.118 1.00 0.00 C +ATOM 51 CA GLN A 51 269.918 249.443 246.139 1.00 0.00 C +ATOM 52 CA ALA A 52 271.079 248.818 249.713 1.00 0.00 C +ATOM 53 CA LYS A 53 273.595 246.100 250.607 1.00 0.00 C +ATOM 54 CA TRP A 54 273.283 243.407 253.284 1.00 0.00 C +ATOM 55 CA ARG A 55 275.739 242.754 256.122 1.00 0.00 C +ATOM 56 CA ARG A 56 278.550 241.962 258.569 1.00 0.00 C +ATOM 57 CA GLU A 57 278.034 238.815 260.654 1.00 0.00 C +ATOM 58 CA TRP A 58 275.556 236.107 259.634 1.00 0.00 C +ATOM 59 CA LYS A 59 272.136 234.550 260.262 1.00 0.00 C +ATOM 60 CA GLY A 60 270.948 230.930 260.217 1.00 0.00 C +ATOM 61 CA GLY A 61 272.369 228.113 258.081 1.00 0.00 C +ATOM 62 CA ALA A 62 274.583 225.333 259.453 1.00 0.00 C +ATOM 63 CA ALA A 63 277.098 225.764 262.282 1.00 0.00 C +ATOM 64 CA GLU A 64 279.676 227.575 264.425 1.00 0.00 C +ATOM 65 CA GLY A 65 282.972 228.904 265.799 1.00 0.00 C +ATOM 66 CA GLY A 66 282.112 231.774 268.153 1.00 0.00 C +ATOM 67 CA ARG A 67 279.604 232.273 270.977 1.00 0.00 C +ATOM 68 CA ARG A 68 276.651 234.339 269.742 1.00 0.00 C +ATOM 69 CA ARG A 69 274.309 233.673 266.811 1.00 0.00 C +ATOM 70 CA GLU A 70 270.725 232.716 265.944 1.00 0.00 C +ATOM 71 CA ARG A 71 267.673 231.340 267.764 1.00 0.00 C +ATOM 72 CA PRO A 72 265.565 232.459 270.734 1.00 0.00 C +ATOM 73 CA THR A 73 264.805 235.135 273.338 1.00 0.00 C +ATOM 74 CA LYS A 74 261.781 237.430 273.014 1.00 0.00 C +ATOM 75 CA GLY A 75 261.302 239.874 275.898 1.00 0.00 C +ATOM 76 CA PHE A 76 263.862 242.620 275.248 1.00 0.00 C +ATOM 77 CA PRO A 77 265.579 243.831 272.069 1.00 0.00 C +ATOM 78 CA ASN A 78 266.586 242.111 268.822 1.00 0.00 C +ATOM 79 CA ARG A 79 266.182 239.442 266.133 1.00 0.00 C +ATOM 80 CA ARG A 80 264.197 240.879 263.216 1.00 0.00 C +ATOM 81 CA GLY A 81 264.375 244.458 261.923 1.00 0.00 C +ATOM 82 CA GLN A 82 264.984 247.698 263.833 1.00 0.00 C +ATOM 83 CA GLY A 83 265.394 251.400 264.636 1.00 0.00 C +ATOM 84 CA TYR A 84 269.092 252.131 265.195 1.00 0.00 C +ATOM 85 CA ARG A 85 271.802 253.371 262.822 1.00 0.00 C +ATOM 86 CA ALA A 86 271.673 252.920 259.040 1.00 0.00 C +ATOM 87 CA PRO A 87 269.937 255.663 257.046 1.00 0.00 C +ATOM 88 CA ALA A 88 271.197 258.629 255.013 1.00 0.00 C +ATOM 89 CA VAL A 89 269.347 259.610 251.831 1.00 0.00 C +ATOM 90 CA SER A 90 271.750 261.651 249.692 1.00 0.00 C +ATOM 91 CA THR A 91 275.242 260.636 250.828 1.00 0.00 C +ATOM 92 CA VAL A 92 276.942 258.871 247.911 1.00 0.00 C +ATOM 93 CA THR A 93 277.097 257.836 244.247 1.00 0.00 C +ATOM 94 CA ALA A 94 274.055 256.391 242.465 1.00 0.00 C +ATOM 95 CA GLN A 95 272.320 259.147 240.487 1.00 0.00 C +TER 96 GLN A 95 +END diff --git a/Plants/Q93W96/Q93W96.dcd b/Plants/Q93W96/Q93W96.dcd new file mode 100644 index 0000000000000000000000000000000000000000..ff176df33269b0314c43d8aad8e669df1617587f --- /dev/null +++ b/Plants/Q93W96/Q93W96.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f28dc551c45a884853abe17d1af26025ab8fb91730a3b5b528c38690cecd0977 +size 4640276 diff --git a/Plants/Q93W96/top.pdb b/Plants/Q93W96/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..ad1df83842d419b60b0395f893574811aced0594 --- /dev/null +++ b/Plants/Q93W96/top.pdb @@ -0,0 +1,36 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 242.604 241.234 226.623 1.00 0.00 C +ATOM 2 CA ASP A 2 239.254 239.422 226.515 1.00 0.00 C +ATOM 3 CA PHE A 3 238.330 237.956 229.908 1.00 0.00 C +ATOM 4 CA GLU A 4 240.203 239.549 232.819 1.00 0.00 C +ATOM 5 CA PRO A 5 242.347 242.186 234.541 1.00 0.00 C +ATOM 6 CA SER A 6 245.033 243.792 232.367 1.00 0.00 C +ATOM 7 CA CYS A 7 248.608 244.049 231.076 1.00 0.00 C +ATOM 8 CA ASN A 8 251.816 245.556 232.475 1.00 0.00 C +ATOM 9 CA SER A 9 254.987 247.296 233.673 1.00 0.00 C +ATOM 10 CA PRO A 10 254.659 248.220 237.354 1.00 0.00 C +ATOM 11 CA ASP A 11 255.279 247.853 241.095 1.00 0.00 C +ATOM 12 CA SER A 12 258.794 248.359 242.477 1.00 0.00 C +ATOM 13 CA ASN A 13 262.200 248.699 244.150 1.00 0.00 C +ATOM 14 CA ALA A 14 262.731 250.887 247.224 1.00 0.00 C +ATOM 15 CA ILE A 15 259.415 251.555 248.979 1.00 0.00 C +ATOM 16 CA PRO A 16 258.411 253.796 251.891 1.00 0.00 C +ATOM 17 CA ASN A 17 260.066 255.678 254.761 1.00 0.00 C +ATOM 18 CA SER A 18 260.909 258.728 256.884 1.00 0.00 C +ATOM 19 CA PRO A 19 260.642 262.243 255.437 1.00 0.00 C +ATOM 20 CA ASP A 20 258.465 264.535 257.563 1.00 0.00 C +ATOM 21 CA VAL A 21 255.374 262.890 259.064 1.00 0.00 C +ATOM 22 CA ASP A 22 252.537 260.674 257.815 1.00 0.00 C +ATOM 23 CA PRO A 23 251.450 258.721 260.901 1.00 0.00 C +ATOM 24 CA ALA A 24 247.912 257.471 261.562 1.00 0.00 C +ATOM 25 CA LEU A 25 245.922 257.166 264.797 1.00 0.00 C +ATOM 26 CA GLY A 26 242.830 255.183 265.810 1.00 0.00 C +ATOM 27 CA GLU A 27 242.045 251.680 264.533 1.00 0.00 C +ATOM 28 CA THR A 28 244.171 248.613 265.302 1.00 0.00 C +ATOM 29 CA GLY A 29 242.255 245.420 266.108 1.00 0.00 C +ATOM 30 CA GLY A 30 242.080 244.708 269.847 1.00 0.00 C +ATOM 31 CA SER A 31 241.154 243.491 273.336 1.00 0.00 C +ATOM 32 CA GLU A 32 237.515 242.387 273.112 1.00 0.00 C +TER 33 GLU A 32 +END diff --git a/Plants/Q93WD9/Q93WD9.dcd b/Plants/Q93WD9/Q93WD9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..ee5b19dbea742abadf400bbb6300a1713b0e91a0 --- /dev/null +++ b/Plants/Q93WD9/Q93WD9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:47be658078c01a523b41e2ea8466617d6e7264396ecdc28d0533877ca8cdbd0f +size 4640276 diff --git a/Plants/Q93WD9/top.pdb b/Plants/Q93WD9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..bc7985a75fc4fed9088f066857ecab3803e4a517 --- /dev/null +++ b/Plants/Q93WD9/top.pdb @@ -0,0 +1,36 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 260.473 265.697 264.121 1.00 0.00 C +ATOM 2 CA ASP A 2 259.896 264.035 260.741 1.00 0.00 C +ATOM 3 CA PHE A 3 260.164 266.317 257.702 1.00 0.00 C +ATOM 4 CA THR A 4 260.326 268.081 254.329 1.00 0.00 C +ATOM 5 CA PRO A 5 263.217 266.489 252.424 1.00 0.00 C +ATOM 6 CA SER A 6 266.006 267.956 250.282 1.00 0.00 C +ATOM 7 CA PHE A 7 265.923 266.033 246.994 1.00 0.00 C +ATOM 8 CA ASN A 8 265.441 265.165 243.316 1.00 0.00 C +ATOM 9 CA SER A 9 262.143 263.273 243.077 1.00 0.00 C +ATOM 10 CA LEU A 10 259.304 260.744 243.328 1.00 0.00 C +ATOM 11 CA ASP A 11 257.946 259.398 246.623 1.00 0.00 C +ATOM 12 CA SER A 12 255.951 257.910 249.508 1.00 0.00 C +ATOM 13 CA ASN A 13 253.772 255.057 250.783 1.00 0.00 C +ATOM 14 CA GLY A 14 252.440 251.566 250.035 1.00 0.00 C +ATOM 15 CA ILE A 15 249.983 250.864 247.209 1.00 0.00 C +ATOM 16 CA PRO A 16 248.957 252.691 244.027 1.00 0.00 C +ATOM 17 CA ASN A 17 245.463 252.238 242.577 1.00 0.00 C +ATOM 18 CA SER A 18 244.367 248.921 241.056 1.00 0.00 C +ATOM 19 CA PRO A 19 243.304 245.348 241.841 1.00 0.00 C +ATOM 20 CA ASP A 20 246.534 243.331 241.705 1.00 0.00 C +ATOM 21 CA VAL A 21 247.597 239.816 242.721 1.00 0.00 C +ATOM 22 CA ASP A 22 245.408 238.708 245.636 1.00 0.00 C +ATOM 23 CA PRO A 23 242.343 240.055 247.455 1.00 0.00 C +ATOM 24 CA ALA A 24 243.331 241.189 250.955 1.00 0.00 C +ATOM 25 CA LEU A 25 242.119 239.045 253.862 1.00 0.00 C +ATOM 26 CA GLY A 26 242.702 235.358 253.100 1.00 0.00 C +ATOM 27 CA GLU A 27 241.222 232.175 251.618 1.00 0.00 C +ATOM 28 CA THR A 28 237.427 232.093 251.290 1.00 0.00 C +ATOM 29 CA GLY A 29 235.078 234.532 253.037 1.00 0.00 C +ATOM 30 CA GLY A 30 235.043 233.900 256.794 1.00 0.00 C +ATOM 31 CA SER A 31 233.944 231.204 259.251 1.00 0.00 C +ATOM 32 CA GLU A 32 232.175 230.812 262.603 1.00 0.00 C +TER 33 GLU A 32 +END diff --git a/Plants/Q93WF3/Q93WF3.dcd b/Plants/Q93WF3/Q93WF3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..f318bb59f8f133f7541a2d7d6b3edf36983b4df2 --- /dev/null +++ b/Plants/Q93WF3/Q93WF3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:cfe1eb7306039db45498dd5c078782a5a7bffcdf013cb18d38da4267be5fdb59 +size 7640276 diff --git a/Plants/Q93WF3/top.pdb b/Plants/Q93WF3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..8bb35703d70b567cb955357cd745a7c8e7ab8f67 --- /dev/null +++ b/Plants/Q93WF3/top.pdb @@ -0,0 +1,61 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 252.572 263.795 275.812 1.00 0.00 C +ATOM 2 CA ARG A 2 254.442 266.834 274.477 1.00 0.00 C +ATOM 3 CA GLY A 3 257.524 267.078 272.250 1.00 0.00 C +ATOM 4 CA GLY A 4 259.216 269.634 269.988 1.00 0.00 C +ATOM 5 CA GLU A 5 259.781 271.019 266.484 1.00 0.00 C +ATOM 6 CA ASP A 6 259.982 269.203 263.141 1.00 0.00 C +ATOM 7 CA GLU A 7 261.559 268.711 259.708 1.00 0.00 C +ATOM 8 CA ALA A 8 259.124 268.171 256.828 1.00 0.00 C +ATOM 9 CA ARG A 9 257.029 266.823 253.945 1.00 0.00 C +ATOM 10 CA PRO A 10 255.268 269.150 251.496 1.00 0.00 C +ATOM 11 CA GLY A 11 253.017 271.649 253.286 1.00 0.00 C +ATOM 12 CA GLY A 12 250.055 274.032 253.539 1.00 0.00 C +ATOM 13 CA GLY A 13 246.646 273.645 251.881 1.00 0.00 C +ATOM 14 CA SER A 14 245.317 270.196 250.960 1.00 0.00 C +ATOM 15 CA GLY A 15 243.295 267.257 249.621 1.00 0.00 C +ATOM 16 CA GLY A 16 240.022 267.792 247.745 1.00 0.00 C +ATOM 17 CA GLY A 17 237.997 269.729 245.164 1.00 0.00 C +ATOM 18 CA SER A 18 236.968 268.358 241.761 1.00 0.00 C +ATOM 19 CA LEU A 19 235.328 268.614 238.332 1.00 0.00 C +ATOM 20 CA VAL A 20 237.622 266.959 235.779 1.00 0.00 C +ATOM 21 CA ARG A 21 239.997 264.003 235.414 1.00 0.00 C +ATOM 22 CA ARG A 22 241.904 262.300 238.239 1.00 0.00 C +ATOM 23 CA ILE A 23 243.602 259.009 239.138 1.00 0.00 C +ATOM 24 CA ARG A 24 245.188 256.585 236.663 1.00 0.00 C +ATOM 25 CA GLU A 25 248.825 257.324 235.804 1.00 0.00 C +ATOM 26 CA GLY A 26 252.622 257.019 235.732 1.00 0.00 C +ATOM 27 CA ARG A 27 254.357 255.947 238.950 1.00 0.00 C +ATOM 28 CA ARG A 28 252.370 253.806 241.397 1.00 0.00 C +ATOM 29 CA PRO A 29 253.455 251.161 243.915 1.00 0.00 C +ATOM 30 CA ALA A 30 255.908 248.697 242.356 1.00 0.00 C +ATOM 31 CA ALA A 31 254.963 245.078 243.084 1.00 0.00 C +ATOM 32 CA THR A 32 254.465 241.426 244.046 1.00 0.00 C +ATOM 33 CA GLY A 33 255.720 239.203 246.874 1.00 0.00 C +ATOM 34 CA TYR A 34 254.337 238.114 250.253 1.00 0.00 C +ATOM 35 CA GLU A 35 250.863 239.527 250.923 1.00 0.00 C +ATOM 36 CA GLY A 36 248.213 241.581 252.733 1.00 0.00 C +ATOM 37 CA GLY A 37 245.015 241.791 254.793 1.00 0.00 C +ATOM 38 CA GLY A 38 242.479 244.594 255.272 1.00 0.00 C +ATOM 39 CA GLY A 39 239.205 242.819 256.076 1.00 0.00 C +ATOM 40 CA ARG A 40 238.682 239.248 254.854 1.00 0.00 C +ATOM 41 CA PRO A 41 239.392 236.451 252.366 1.00 0.00 C +ATOM 42 CA ALA A 42 242.149 233.833 252.117 1.00 0.00 C +ATOM 43 CA GLY A 43 245.239 235.210 253.870 1.00 0.00 C +ATOM 44 CA ALA A 44 248.114 234.512 256.271 1.00 0.00 C +ATOM 45 CA GLU A 45 251.529 233.560 257.666 1.00 0.00 C +ATOM 46 CA ALA A 46 252.444 230.521 259.775 1.00 0.00 C +ATOM 47 CA GLY A 47 255.704 228.823 260.777 1.00 0.00 C +ATOM 48 CA ARG A 48 255.963 225.750 258.539 1.00 0.00 C +ATOM 49 CA ASP A 49 256.191 225.991 254.744 1.00 0.00 C +ATOM 50 CA GLY A 50 255.391 226.133 251.022 1.00 0.00 C +ATOM 51 CA ASP A 51 257.113 228.485 248.567 1.00 0.00 C +ATOM 52 CA GLY A 52 255.467 228.662 245.136 1.00 0.00 C +ATOM 53 CA PRO A 53 255.697 227.852 241.420 1.00 0.00 C +ATOM 54 CA SER A 54 252.802 225.743 240.121 1.00 0.00 C +ATOM 55 CA HIS A 55 249.955 223.290 239.497 1.00 0.00 C +ATOM 56 CA ILE A 56 249.915 222.477 235.775 1.00 0.00 C +ATOM 57 CA GLN A 57 252.002 224.827 233.623 1.00 0.00 C +TER 58 GLN A 57 +END diff --git a/Plants/Q93WI4/Q93WI4.dcd b/Plants/Q93WI4/Q93WI4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..9dd9914226c3dc23ec96fbce381552b6517ac804 --- /dev/null +++ b/Plants/Q93WI4/Q93WI4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:4087aba64ff8980714cf54fe4c53f44805b28172a2d3b49b293f9cb486532ce2 +size 18680276 diff --git a/Plants/Q93WI4/top.pdb b/Plants/Q93WI4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..36a781f0784a5c77fe2dc28d89e4871cc4fd5bbf --- /dev/null +++ b/Plants/Q93WI4/top.pdb @@ -0,0 +1,153 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 270.536 228.221 279.202 1.00 0.00 C +ATOM 2 CA GLY A 2 267.558 226.161 278.019 1.00 0.00 C +ATOM 3 CA LYS A 3 266.055 222.892 276.765 1.00 0.00 C +ATOM 4 CA GLU A 4 263.037 222.275 274.523 1.00 0.00 C +ATOM 5 CA ARG A 5 260.027 222.358 272.188 1.00 0.00 C +ATOM 6 CA LYS A 6 257.995 224.380 269.678 1.00 0.00 C +ATOM 7 CA GLY A 7 257.514 226.532 266.571 1.00 0.00 C +ATOM 8 CA GLU A 8 253.949 226.587 265.228 1.00 0.00 C +ATOM 9 CA GLY A 9 250.362 227.369 266.246 1.00 0.00 C +ATOM 10 CA VAL A 10 248.282 228.517 269.225 1.00 0.00 C +ATOM 11 CA LEU A 11 249.866 229.032 272.652 1.00 0.00 C +ATOM 12 CA THR A 12 253.588 229.814 272.872 1.00 0.00 C +ATOM 13 CA GLY A 13 254.244 232.486 270.237 1.00 0.00 C +ATOM 14 CA GLY A 14 252.616 234.692 267.591 1.00 0.00 C +ATOM 15 CA GLY A 15 251.945 238.106 269.143 1.00 0.00 C +ATOM 16 CA GLY A 16 252.653 241.574 267.734 1.00 0.00 C +ATOM 17 CA ASP A 17 255.672 242.439 265.577 1.00 0.00 C +ATOM 18 CA ASP A 18 254.766 244.508 262.509 1.00 0.00 C +ATOM 19 CA ARG A 19 255.869 246.028 259.194 1.00 0.00 C +ATOM 20 CA ARG A 20 259.537 245.224 258.551 1.00 0.00 C +ATOM 21 CA ARG A 21 262.171 244.815 255.828 1.00 0.00 C +ATOM 22 CA GLY A 22 264.779 242.484 257.338 1.00 0.00 C +ATOM 23 CA ALA A 23 265.991 239.116 258.644 1.00 0.00 C +ATOM 24 CA THR A 24 264.155 235.858 259.369 1.00 0.00 C +ATOM 25 CA LYS A 25 260.373 236.291 259.219 1.00 0.00 C +ATOM 26 CA GLY A 26 258.647 239.047 261.204 1.00 0.00 C +ATOM 27 CA GLY A 27 255.022 238.892 260.043 1.00 0.00 C +ATOM 28 CA ARG A 28 254.456 237.200 256.676 1.00 0.00 C +ATOM 29 CA GLN A 29 252.025 234.361 255.938 1.00 0.00 C +ATOM 30 CA ALA A 30 253.208 230.907 254.847 1.00 0.00 C +ATOM 31 CA ALA A 31 255.177 229.279 257.673 1.00 0.00 C +ATOM 32 CA ASP A 32 258.848 230.260 257.956 1.00 0.00 C +ATOM 33 CA GLY A 33 262.081 229.769 259.910 1.00 0.00 C +ATOM 34 CA VAL A 34 265.693 228.944 259.021 1.00 0.00 C +ATOM 35 CA ARG A 35 269.294 229.262 260.225 1.00 0.00 C +ATOM 36 CA ASP A 36 271.802 226.839 258.689 1.00 0.00 C +ATOM 37 CA ASP A 37 275.005 225.084 257.604 1.00 0.00 C +ATOM 38 CA LEU A 38 278.361 223.334 258.042 1.00 0.00 C +ATOM 39 CA LYS A 39 282.047 222.417 258.334 1.00 0.00 C +ATOM 40 CA ASN A 40 285.572 223.037 257.027 1.00 0.00 C +ATOM 41 CA GLU A 41 286.136 220.736 254.043 1.00 0.00 C +ATOM 42 CA LYS A 42 284.378 222.484 251.150 1.00 0.00 C +ATOM 43 CA GLY A 43 285.810 221.920 247.664 1.00 0.00 C +ATOM 44 CA LYS A 44 284.754 222.807 244.112 1.00 0.00 C +ATOM 45 CA ILE A 45 285.856 222.316 240.498 1.00 0.00 C +ATOM 46 CA ARG A 46 283.015 221.612 238.059 1.00 0.00 C +ATOM 47 CA GLU A 47 279.295 220.896 238.466 1.00 0.00 C +ATOM 48 CA GLY A 48 276.784 221.954 241.129 1.00 0.00 C +ATOM 49 CA GLU A 49 275.023 225.183 242.123 1.00 0.00 C +ATOM 50 CA ARG A 50 272.131 227.643 241.803 1.00 0.00 C +ATOM 51 CA GLY A 51 269.471 230.261 241.038 1.00 0.00 C +ATOM 52 CA HIS A 52 266.031 231.000 239.576 1.00 0.00 C +ATOM 53 CA ARG A 53 262.750 229.367 240.616 1.00 0.00 C +ATOM 54 CA ARG A 54 260.931 227.175 243.146 1.00 0.00 C +ATOM 55 CA ARG A 55 258.544 224.714 244.808 1.00 0.00 C +ATOM 56 CA GLU A 56 257.768 221.986 242.264 1.00 0.00 C +ATOM 57 CA ARG A 57 255.664 223.507 239.475 1.00 0.00 C +ATOM 58 CA ARG A 58 253.719 226.301 241.186 1.00 0.00 C +ATOM 59 CA PRO A 59 253.129 230.064 241.118 1.00 0.00 C +ATOM 60 CA LYS A 60 252.996 233.536 242.681 1.00 0.00 C +ATOM 61 CA ALA A 61 252.809 236.998 244.262 1.00 0.00 C +ATOM 62 CA ALA A 62 254.860 237.707 247.393 1.00 0.00 C +ATOM 63 CA ASP A 63 255.147 235.292 250.325 1.00 0.00 C +ATOM 64 CA MET A 64 255.226 231.819 248.760 1.00 0.00 C +ATOM 65 CA ALA A 65 258.553 230.240 249.738 1.00 0.00 C +ATOM 66 CA ALA A 66 260.855 232.546 251.713 1.00 0.00 C +ATOM 67 CA LEU A 67 263.772 232.781 254.152 1.00 0.00 C +ATOM 68 CA THR A 68 267.075 234.673 253.989 1.00 0.00 C +ATOM 69 CA VAL A 69 270.055 236.963 254.614 1.00 0.00 C +ATOM 70 CA ALA A 70 272.958 238.034 252.390 1.00 0.00 C +ATOM 71 CA ARG A 71 275.141 239.521 249.644 1.00 0.00 C +ATOM 72 CA ARG A 72 277.756 237.766 247.501 1.00 0.00 C +ATOM 73 CA GLU A 73 277.209 237.613 243.733 1.00 0.00 C +ATOM 74 CA TRP A 74 275.120 235.926 241.030 1.00 0.00 C +ATOM 75 CA ARG A 75 271.353 236.228 241.512 1.00 0.00 C +ATOM 76 CA SER A 76 269.601 236.331 244.894 1.00 0.00 C +ATOM 77 CA GLY A 77 267.283 239.300 245.465 1.00 0.00 C +ATOM 78 CA GLY A 78 265.000 240.578 248.234 1.00 0.00 C +ATOM 79 CA GLU A 79 263.008 239.623 251.339 1.00 0.00 C +ATOM 80 CA PRO A 80 259.519 241.021 251.958 1.00 0.00 C +ATOM 81 CA ARG A 81 256.468 243.094 251.004 1.00 0.00 C +ATOM 82 CA ARG A 82 256.623 246.676 249.716 1.00 0.00 C +ATOM 83 CA ARG A 83 255.501 250.235 250.484 1.00 0.00 C +ATOM 84 CA ARG A 84 253.817 249.991 253.893 1.00 0.00 C +ATOM 85 CA GLY A 85 254.761 251.903 257.051 1.00 0.00 C +ATOM 86 CA GLY A 86 258.343 253.199 257.033 1.00 0.00 C +ATOM 87 CA ARG A 87 261.554 255.122 257.745 1.00 0.00 C +ATOM 88 CA GLY A 88 262.185 258.186 255.570 1.00 0.00 C +ATOM 89 CA GLY A 89 264.412 257.467 252.563 1.00 0.00 C +ATOM 90 CA SER A 90 264.296 259.820 249.568 1.00 0.00 C +ATOM 91 CA ARG A 91 261.852 262.726 249.873 1.00 0.00 C +ATOM 92 CA PRO A 92 258.307 263.017 251.240 1.00 0.00 C +ATOM 93 CA ARG A 93 256.294 259.785 251.378 1.00 0.00 C +ATOM 94 CA GLU A 94 253.861 257.334 252.987 1.00 0.00 C +ATOM 95 CA PRO A 95 250.196 256.296 253.047 1.00 0.00 C +ATOM 96 CA ASP A 96 246.691 256.927 251.694 1.00 0.00 C +ATOM 97 CA GLY A 97 245.501 260.520 252.134 1.00 0.00 C +ATOM 98 CA SER A 98 242.216 262.290 252.901 1.00 0.00 C +ATOM 99 CA ASP A 99 238.781 263.724 252.087 1.00 0.00 C +ATOM 100 CA GLY A 100 237.408 267.167 251.205 1.00 0.00 C +ATOM 101 CA ALA A 101 235.227 269.899 252.719 1.00 0.00 C +ATOM 102 CA ALA A 102 233.475 273.205 253.438 1.00 0.00 C +ATOM 103 CA ALA A 103 231.873 276.633 252.997 1.00 0.00 C +ATOM 104 CA SER A 104 228.292 276.380 254.271 1.00 0.00 C +ATOM 105 CA LEU A 105 225.416 278.799 254.899 1.00 0.00 C +ATOM 106 CA ALA A 106 224.646 281.220 252.060 1.00 0.00 C +ATOM 107 CA ALA A 107 224.667 285.030 252.100 1.00 0.00 C +ATOM 108 CA ALA A 108 227.103 286.353 254.714 1.00 0.00 C +ATOM 109 CA SER A 109 230.806 286.991 254.082 1.00 0.00 C +ATOM 110 CA GLY A 110 232.253 287.128 250.560 1.00 0.00 C +ATOM 111 CA GLY A 111 233.292 286.923 246.901 1.00 0.00 C +ATOM 112 CA ARG A 112 232.362 289.747 244.518 1.00 0.00 C +ATOM 113 CA SER A 113 233.125 293.462 244.150 1.00 0.00 C +ATOM 114 CA SER A 114 233.923 295.365 240.947 1.00 0.00 C +ATOM 115 CA GLY A 115 233.948 298.598 238.932 1.00 0.00 C +ATOM 116 CA SER A 116 230.420 299.456 237.776 1.00 0.00 C +ATOM 117 CA GLY A 117 228.164 297.383 240.041 1.00 0.00 C +ATOM 118 CA ASP A 118 225.477 297.818 242.706 1.00 0.00 C +ATOM 119 CA GLY A 119 222.072 298.242 244.362 1.00 0.00 C +ATOM 120 CA GLY A 120 218.689 296.817 245.381 1.00 0.00 C +ATOM 121 CA TRP A 121 218.786 293.163 244.304 1.00 0.00 C +ATOM 122 CA VAL A 122 221.450 292.460 241.672 1.00 0.00 C +ATOM 123 CA HIS A 123 222.347 294.142 238.374 1.00 0.00 C +ATOM 124 CA GLY A 124 222.318 291.469 235.658 1.00 0.00 C +ATOM 125 CA ALA A 125 224.990 290.079 233.325 1.00 0.00 C +ATOM 126 CA GLU A 126 227.752 287.808 232.009 1.00 0.00 C +ATOM 127 CA ALA A 127 229.117 284.325 232.728 1.00 0.00 C +ATOM 128 CA MET A 128 226.172 281.962 233.244 1.00 0.00 C +ATOM 129 CA GLY A 129 227.155 279.314 235.800 1.00 0.00 C +ATOM 130 CA SER A 130 229.002 276.472 237.540 1.00 0.00 C +ATOM 131 CA THR A 131 229.575 273.200 235.673 1.00 0.00 C +ATOM 132 CA ARG A 132 232.119 270.457 234.950 1.00 0.00 C +ATOM 133 CA GLU A 133 232.153 266.736 235.769 1.00 0.00 C +ATOM 134 CA PHE A 134 231.025 263.303 236.977 1.00 0.00 C +ATOM 135 CA GLY A 135 228.077 261.009 237.726 1.00 0.00 C +ATOM 136 CA GLU A 136 227.620 257.293 237.020 1.00 0.00 C +ATOM 137 CA MET A 137 224.406 256.390 238.856 1.00 0.00 C +ATOM 138 CA GLY A 138 222.141 258.990 240.476 1.00 0.00 C +ATOM 139 CA LYS A 139 222.032 262.513 241.923 1.00 0.00 C +ATOM 140 CA LYS A 140 222.318 266.235 241.157 1.00 0.00 C +ATOM 141 CA ARG A 141 220.439 268.993 239.319 1.00 0.00 C +ATOM 142 CA GLU A 142 216.796 268.324 238.424 1.00 0.00 C +ATOM 143 CA GLY A 143 214.537 266.073 236.340 1.00 0.00 C +ATOM 144 CA VAL A 144 212.760 263.173 234.623 1.00 0.00 C +ATOM 145 CA ALA A 145 211.838 259.513 235.141 1.00 0.00 C +ATOM 146 CA ALA A 146 212.074 255.979 233.735 1.00 0.00 C +ATOM 147 CA GLU A 147 210.210 252.685 233.297 1.00 0.00 C +ATOM 148 CA LEU A 148 209.777 248.999 234.155 1.00 0.00 C +ATOM 149 CA LYS A 149 209.449 245.203 234.162 1.00 0.00 C +TER 150 LYS A 149 +END diff --git a/Plants/Q93XL5/Q93XL5.dcd b/Plants/Q93XL5/Q93XL5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..783230efee7d076580da8cd96719ef523143a256 --- /dev/null +++ b/Plants/Q93XL5/Q93XL5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e5eafef9e89336f4135aaab4bc1604de4bd1e5168a79092aabbdadacaa0ad2de +size 13880276 diff --git a/Plants/Q93XL5/top.pdb b/Plants/Q93XL5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..42728514b47ace363bc797184c79cd3984aa06a3 --- /dev/null +++ b/Plants/Q93XL5/top.pdb @@ -0,0 +1,113 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 209.699 284.329 283.738 1.00 0.00 C +ATOM 2 CA SER A 2 213.163 283.239 282.586 1.00 0.00 C +ATOM 3 CA ASN A 3 215.775 283.840 279.879 1.00 0.00 C +ATOM 4 CA ILE A 4 216.863 286.972 278.001 1.00 0.00 C +ATOM 5 CA GLN A 5 218.984 289.887 276.766 1.00 0.00 C +ATOM 6 CA GLU A 6 220.018 293.281 278.153 1.00 0.00 C +ATOM 7 CA ASN A 7 221.557 295.497 275.462 1.00 0.00 C +ATOM 8 CA LEU A 8 224.966 296.924 274.535 1.00 0.00 C +ATOM 9 CA LYS A 9 228.108 294.779 274.320 1.00 0.00 C +ATOM 10 CA ALA A 10 229.094 292.174 276.920 1.00 0.00 C +ATOM 11 CA GLY A 11 228.726 288.411 276.453 1.00 0.00 C +ATOM 12 CA GLU A 12 229.374 284.754 277.301 1.00 0.00 C +ATOM 13 CA SER A 13 230.029 281.301 275.830 1.00 0.00 C +ATOM 14 CA GLN A 14 231.255 277.855 276.898 1.00 0.00 C +ATOM 15 CA VAL A 15 234.958 278.278 277.689 1.00 0.00 C +ATOM 16 CA GLN A 16 237.896 278.892 275.342 1.00 0.00 C +ATOM 17 CA GLY A 17 241.464 280.223 275.449 1.00 0.00 C +ATOM 18 CA LYS A 18 245.200 280.768 274.940 1.00 0.00 C +ATOM 19 CA ALA A 19 248.723 279.346 274.648 1.00 0.00 C +ATOM 20 CA GLU A 20 249.898 276.095 276.251 1.00 0.00 C +ATOM 21 CA ASP A 21 253.161 274.522 277.433 1.00 0.00 C +ATOM 22 CA MET A 22 252.764 270.770 276.904 1.00 0.00 C +ATOM 23 CA MET A 23 251.491 269.747 273.462 1.00 0.00 C +ATOM 24 CA GLN A 24 251.745 265.950 273.270 1.00 0.00 C +ATOM 25 CA SER A 25 250.138 262.505 273.525 1.00 0.00 C +ATOM 26 CA THR A 26 247.937 259.430 273.993 1.00 0.00 C +ATOM 27 CA LYS A 27 245.186 257.080 275.186 1.00 0.00 C +ATOM 28 CA ASP A 28 241.973 258.641 276.511 1.00 0.00 C +ATOM 29 CA THR A 29 239.813 260.109 273.737 1.00 0.00 C +ATOM 30 CA ALA A 30 240.275 260.822 270.023 1.00 0.00 C +ATOM 31 CA ASN A 31 238.983 261.676 266.542 1.00 0.00 C +ATOM 32 CA ALA A 32 239.200 262.307 262.791 1.00 0.00 C +ATOM 33 CA ALA A 33 236.021 261.803 260.752 1.00 0.00 C +ATOM 34 CA LYS A 34 236.025 262.995 257.134 1.00 0.00 C +ATOM 35 CA ASN A 35 238.914 262.516 254.696 1.00 0.00 C +ATOM 36 CA LYS A 36 242.099 263.241 256.658 1.00 0.00 C +ATOM 37 CA THR A 37 245.768 263.648 257.602 1.00 0.00 C +ATOM 38 CA ALA A 38 248.277 266.399 256.795 1.00 0.00 C +ATOM 39 CA ASP A 39 251.939 267.450 256.749 1.00 0.00 C +ATOM 40 CA THR A 40 255.333 266.177 257.919 1.00 0.00 C +ATOM 41 CA ALA A 41 255.489 263.291 260.402 1.00 0.00 C +ATOM 42 CA GLN A 42 255.686 259.496 260.127 1.00 0.00 C +ATOM 43 CA SER A 43 257.736 257.285 262.456 1.00 0.00 C +ATOM 44 CA ALA A 44 259.712 258.782 265.349 1.00 0.00 C +ATOM 45 CA LYS A 45 263.126 259.996 264.172 1.00 0.00 C +ATOM 46 CA ASP A 46 266.749 259.204 263.298 1.00 0.00 C +ATOM 47 CA LYS A 47 267.585 255.525 262.768 1.00 0.00 C +ATOM 48 CA THR A 48 266.197 251.977 262.804 1.00 0.00 C +ATOM 49 CA ALA A 49 264.880 248.580 261.691 1.00 0.00 C +ATOM 50 CA ASP A 50 263.126 245.446 262.961 1.00 0.00 C +ATOM 51 CA ALA A 51 259.606 244.432 264.011 1.00 0.00 C +ATOM 52 CA THR A 52 256.856 244.517 261.375 1.00 0.00 C +ATOM 53 CA GLN A 53 257.298 247.910 259.700 1.00 0.00 C +ATOM 54 CA SER A 54 256.203 247.826 256.051 1.00 0.00 C +ATOM 55 CA ALA A 55 258.149 247.765 252.776 1.00 0.00 C +ATOM 56 CA LYS A 56 261.687 246.792 253.801 1.00 0.00 C +ATOM 57 CA ASP A 57 265.360 246.495 254.771 1.00 0.00 C +ATOM 58 CA LYS A 58 267.739 248.528 252.598 1.00 0.00 C +ATOM 59 CA THR A 59 270.467 248.856 249.958 1.00 0.00 C +ATOM 60 CA ALA A 60 270.039 248.331 246.208 1.00 0.00 C +ATOM 61 CA ASP A 61 272.741 250.309 244.391 1.00 0.00 C +ATOM 62 CA ALA A 62 273.703 253.327 242.274 1.00 0.00 C +ATOM 63 CA THR A 63 275.619 253.027 238.994 1.00 0.00 C +ATOM 64 CA GLN A 64 277.106 255.606 236.617 1.00 0.00 C +ATOM 65 CA SER A 65 277.285 256.767 232.993 1.00 0.00 C +ATOM 66 CA THR A 66 277.790 255.196 229.558 1.00 0.00 C +ATOM 67 CA LYS A 67 276.251 251.784 228.848 1.00 0.00 C +ATOM 68 CA GLU A 68 273.232 252.244 226.569 1.00 0.00 C +ATOM 69 CA SER A 69 270.015 253.806 227.883 1.00 0.00 C +ATOM 70 CA ALA A 70 268.273 251.636 230.485 1.00 0.00 C +ATOM 71 CA GLN A 71 265.671 250.938 233.179 1.00 0.00 C +ATOM 72 CA GLN A 72 262.469 249.330 231.883 1.00 0.00 C +ATOM 73 CA GLY A 73 262.184 247.888 228.368 1.00 0.00 C +ATOM 74 CA LYS A 74 262.435 248.725 224.659 1.00 0.00 C +ATOM 75 CA ASP A 75 259.120 248.034 222.914 1.00 0.00 C +ATOM 76 CA GLN A 76 255.468 247.383 222.043 1.00 0.00 C +ATOM 77 CA SER A 77 253.505 244.346 220.843 1.00 0.00 C +ATOM 78 CA ALA A 78 254.606 240.929 219.566 1.00 0.00 C +ATOM 79 CA GLY A 79 256.199 238.462 217.138 1.00 0.00 C +ATOM 80 CA PHE A 80 258.633 235.897 215.720 1.00 0.00 C +ATOM 81 CA LEU A 81 258.338 232.298 216.935 1.00 0.00 C +ATOM 82 CA GLN A 82 256.314 231.887 220.136 1.00 0.00 C +ATOM 83 CA GLN A 83 253.127 231.753 222.221 1.00 0.00 C +ATOM 84 CA THR A 84 250.219 231.711 219.760 1.00 0.00 C +ATOM 85 CA GLY A 85 247.240 230.793 217.569 1.00 0.00 C +ATOM 86 CA GLU A 86 244.420 229.022 219.420 1.00 0.00 C +ATOM 87 CA GLN A 87 243.630 226.976 222.535 1.00 0.00 C +ATOM 88 CA VAL A 88 243.741 228.104 226.173 1.00 0.00 C +ATOM 89 CA LYS A 89 243.030 225.416 228.777 1.00 0.00 C +ATOM 90 CA ASN A 90 242.641 223.296 231.919 1.00 0.00 C +ATOM 91 CA MET A 91 242.768 222.372 235.613 1.00 0.00 C +ATOM 92 CA ALA A 92 240.847 219.193 236.459 1.00 0.00 C +ATOM 93 CA GLN A 93 241.161 215.879 234.606 1.00 0.00 C +ATOM 94 CA GLY A 94 238.874 212.832 234.611 1.00 0.00 C +ATOM 95 CA ALA A 95 239.925 209.172 234.504 1.00 0.00 C +ATOM 96 CA VAL A 96 238.518 205.657 234.072 1.00 0.00 C +ATOM 97 CA GLY A 97 240.307 203.648 231.374 1.00 0.00 C +ATOM 98 CA ASN A 98 244.087 203.178 231.329 1.00 0.00 C +ATOM 99 CA VAL A 99 247.474 204.666 230.415 1.00 0.00 C +ATOM 100 CA LYS A 100 247.509 205.397 226.676 1.00 0.00 C +ATOM 101 CA SER A 101 249.157 206.401 223.391 1.00 0.00 C +ATOM 102 CA THR A 102 252.096 208.429 222.063 1.00 0.00 C +ATOM 103 CA LEU A 103 255.544 208.398 223.685 1.00 0.00 C +ATOM 104 CA GLY A 104 256.990 205.306 225.377 1.00 0.00 C +ATOM 105 CA MET A 105 257.160 204.432 229.082 1.00 0.00 C +ATOM 106 CA GLY A 106 254.883 205.007 232.082 1.00 0.00 C +ATOM 107 CA ASP A 107 252.817 204.567 235.253 1.00 0.00 C +ATOM 108 CA LYS A 108 252.816 205.220 239.007 1.00 0.00 C +ATOM 109 CA LYS A 109 255.577 207.685 239.911 1.00 0.00 C +TER 110 LYS A 109 +END diff --git a/Plants/Q93YQ4/Q93YQ4.dcd b/Plants/Q93YQ4/Q93YQ4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..f0d32e340cab6f052defbf53d11d19e405a70a6f --- /dev/null +++ b/Plants/Q93YQ4/Q93YQ4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e3a62dccee9e1f4d38dd337a47cd453ed7f9690dd6c4bf4b44916c03fc1688d8 +size 88720276 diff --git a/Plants/Q93YQ4/top.pdb b/Plants/Q93YQ4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..8b65770b9a2d6666d16ad2e73a1bca853767cd3c --- /dev/null +++ b/Plants/Q93YQ4/top.pdb @@ -0,0 +1,367 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 920.000 920.000 920.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 397.914 520.702 396.102 1.00 0.00 C +ATOM 2 CA SER A 2 394.460 521.251 394.592 1.00 0.00 C +ATOM 3 CA SER A 3 393.504 524.722 393.346 1.00 0.00 C +ATOM 4 CA ASN A 4 392.816 528.469 393.302 1.00 0.00 C +ATOM 5 CA GLN A 5 394.414 531.646 391.936 1.00 0.00 C +ATOM 6 CA GLU A 6 396.882 534.488 392.525 1.00 0.00 C +ATOM 7 CA ASN A 7 399.604 536.680 394.042 1.00 0.00 C +ATOM 8 CA ALA A 8 403.272 535.663 393.865 1.00 0.00 C +ATOM 9 CA LYS A 9 407.072 535.385 393.839 1.00 0.00 C +ATOM 10 CA GLU A 10 409.744 538.034 393.241 1.00 0.00 C +ATOM 11 CA GLU A 11 413.325 538.340 391.977 1.00 0.00 C +ATOM 12 CA LYS A 12 417.046 539.135 391.782 1.00 0.00 C +ATOM 13 CA LEU A 13 420.115 537.463 393.300 1.00 0.00 C +ATOM 14 CA HIS A 14 419.505 534.056 394.892 1.00 0.00 C +ATOM 15 CA VAL A 15 422.756 532.752 396.390 1.00 0.00 C +ATOM 16 CA LYS A 16 425.190 531.596 399.084 1.00 0.00 C +ATOM 17 CA ILE A 17 428.502 533.377 399.698 1.00 0.00 C +ATOM 18 CA LYS A 18 431.918 534.745 398.711 1.00 0.00 C +ATOM 19 CA THR A 19 434.872 535.115 401.090 1.00 0.00 C +ATOM 20 CA GLN A 20 436.876 534.053 404.151 1.00 0.00 C +ATOM 21 CA GLU A 21 438.843 536.902 405.741 1.00 0.00 C +ATOM 22 CA LEU A 22 441.877 536.592 408.025 1.00 0.00 C +ATOM 23 CA ASP A 23 444.514 538.198 410.256 1.00 0.00 C +ATOM 24 CA PRO A 24 446.011 536.508 413.326 1.00 0.00 C +ATOM 25 CA LYS A 25 447.486 537.871 416.563 1.00 0.00 C +ATOM 26 CA GLU A 26 444.623 538.148 419.061 1.00 0.00 C +ATOM 27 CA LYS A 27 445.501 535.648 421.799 1.00 0.00 C +ATOM 28 CA GLY A 28 445.372 537.636 425.047 1.00 0.00 C +ATOM 29 CA GLU A 29 443.336 539.585 427.610 1.00 0.00 C +ATOM 30 CA ASN A 30 439.744 540.608 426.860 1.00 0.00 C +ATOM 31 CA VAL A 31 436.826 542.384 428.546 1.00 0.00 C +ATOM 32 CA GLU A 32 433.563 543.477 426.910 1.00 0.00 C +ATOM 33 CA VAL A 33 430.151 544.108 425.336 1.00 0.00 C +ATOM 34 CA GLU A 34 428.761 544.771 421.851 1.00 0.00 C +ATOM 35 CA MET A 35 424.973 544.808 422.252 1.00 0.00 C +ATOM 36 CA GLU A 36 421.941 543.442 424.112 1.00 0.00 C +ATOM 37 CA VAL A 37 418.321 544.174 425.049 1.00 0.00 C +ATOM 38 CA LYS A 38 415.784 545.416 427.606 1.00 0.00 C +ATOM 39 CA ALA A 39 416.210 549.140 428.291 1.00 0.00 C +ATOM 40 CA LYS A 40 418.925 550.020 430.815 1.00 0.00 C +ATOM 41 CA SER A 41 419.202 553.820 430.889 1.00 0.00 C +ATOM 42 CA ILE A 42 419.001 555.800 427.641 1.00 0.00 C +ATOM 43 CA GLU A 43 420.573 554.909 424.286 1.00 0.00 C +ATOM 44 CA LYS A 44 422.130 553.841 420.977 1.00 0.00 C +ATOM 45 CA VAL A 45 420.137 551.205 419.081 1.00 0.00 C +ATOM 46 CA LYS A 46 420.216 548.907 416.044 1.00 0.00 C +ATOM 47 CA ALA A 47 418.331 546.071 414.335 1.00 0.00 C +ATOM 48 CA LYS A 48 419.185 542.473 413.418 1.00 0.00 C +ATOM 49 CA LYS A 49 415.858 540.715 412.819 1.00 0.00 C +ATOM 50 CA ASP A 50 416.253 538.370 409.843 1.00 0.00 C +ATOM 51 CA GLU A 51 414.611 538.640 406.416 1.00 0.00 C +ATOM 52 CA GLU A 52 415.901 537.670 402.965 1.00 0.00 C +ATOM 53 CA SER A 53 415.696 533.880 402.637 1.00 0.00 C +ATOM 54 CA SER A 54 415.279 530.144 403.261 1.00 0.00 C +ATOM 55 CA GLY A 55 418.165 528.236 404.855 1.00 0.00 C +ATOM 56 CA LYS A 56 417.356 526.615 408.207 1.00 0.00 C +ATOM 57 CA SER A 57 419.159 524.067 410.391 1.00 0.00 C +ATOM 58 CA LYS A 58 419.298 520.383 409.431 1.00 0.00 C +ATOM 59 CA LYS A 59 418.872 518.018 406.474 1.00 0.00 C +ATOM 60 CA ASP A 60 417.710 514.420 406.945 1.00 0.00 C +ATOM 61 CA LYS A 61 418.266 510.691 407.494 1.00 0.00 C +ATOM 62 CA GLU A 62 419.099 506.981 407.253 1.00 0.00 C +ATOM 63 CA LYS A 63 420.172 503.529 406.049 1.00 0.00 C +ATOM 64 CA LYS A 64 419.138 500.868 408.571 1.00 0.00 C +ATOM 65 CA LYS A 65 417.225 499.583 411.605 1.00 0.00 C +ATOM 66 CA GLY A 66 418.820 496.536 413.245 1.00 0.00 C +ATOM 67 CA LYS A 67 417.182 494.924 416.284 1.00 0.00 C +ATOM 68 CA ASN A 68 418.390 496.415 419.576 1.00 0.00 C +ATOM 69 CA VAL A 69 417.707 497.716 423.092 1.00 0.00 C +ATOM 70 CA ASP A 70 418.309 495.987 426.433 1.00 0.00 C +ATOM 71 CA SER A 71 418.587 492.843 428.567 1.00 0.00 C +ATOM 72 CA GLU A 72 418.415 489.057 428.964 1.00 0.00 C +ATOM 73 CA VAL A 73 417.173 486.106 426.900 1.00 0.00 C +ATOM 74 CA LYS A 74 419.078 482.818 427.182 1.00 0.00 C +ATOM 75 CA GLU A 75 422.846 483.054 426.670 1.00 0.00 C +ATOM 76 CA ASP A 76 424.881 479.874 426.157 1.00 0.00 C +ATOM 77 CA LYS A 77 428.654 480.383 426.008 1.00 0.00 C +ATOM 78 CA ASP A 78 429.914 479.623 429.522 1.00 0.00 C +ATOM 79 CA ASP A 79 430.436 478.804 433.206 1.00 0.00 C +ATOM 80 CA ASP A 80 430.099 477.894 436.890 1.00 0.00 C +ATOM 81 CA LYS A 81 433.383 478.066 438.814 1.00 0.00 C +ATOM 82 CA LYS A 82 433.346 477.455 442.575 1.00 0.00 C +ATOM 83 CA LYS A 83 435.789 477.338 445.496 1.00 0.00 C +ATOM 84 CA ASP A 84 437.163 475.386 448.465 1.00 0.00 C +ATOM 85 CA GLY A 85 439.026 472.116 449.061 1.00 0.00 C +ATOM 86 CA LYS A 86 441.649 470.552 446.783 1.00 0.00 C +ATOM 87 CA MET A 87 444.549 468.127 447.254 1.00 0.00 C +ATOM 88 CA VAL A 88 445.626 468.542 450.885 1.00 0.00 C +ATOM 89 CA SER A 89 448.443 469.382 453.308 1.00 0.00 C +ATOM 90 CA LYS A 90 451.926 470.682 452.475 1.00 0.00 C +ATOM 91 CA LYS A 91 455.386 471.684 453.718 1.00 0.00 C +ATOM 92 CA HIS A 92 457.110 472.827 456.917 1.00 0.00 C +ATOM 93 CA GLU A 93 459.370 471.043 459.412 1.00 0.00 C +ATOM 94 CA GLU A 94 459.644 469.939 463.048 1.00 0.00 C +ATOM 95 CA GLY A 95 458.087 470.201 466.515 1.00 0.00 C +ATOM 96 CA HIS A 96 455.074 470.831 468.761 1.00 0.00 C +ATOM 97 CA GLY A 97 452.042 470.841 466.455 1.00 0.00 C +ATOM 98 CA ASP A 98 449.862 468.937 463.977 1.00 0.00 C +ATOM 99 CA LEU A 99 448.395 468.720 460.468 1.00 0.00 C +ATOM 100 CA GLU A 100 445.822 465.913 460.356 1.00 0.00 C +ATOM 101 CA VAL A 101 444.715 463.843 463.357 1.00 0.00 C +ATOM 102 CA LYS A 102 446.604 460.585 463.938 1.00 0.00 C +ATOM 103 CA GLU A 103 447.998 458.771 460.892 1.00 0.00 C +ATOM 104 CA SER A 104 446.592 457.826 457.479 1.00 0.00 C +ATOM 105 CA ASP A 105 444.408 454.729 457.870 1.00 0.00 C +ATOM 106 CA VAL A 106 444.031 451.125 459.045 1.00 0.00 C +ATOM 107 CA LYS A 107 446.590 448.433 458.196 1.00 0.00 C +ATOM 108 CA VAL A 108 449.851 450.363 457.795 1.00 0.00 C +ATOM 109 CA GLU A 109 451.912 449.968 460.975 1.00 0.00 C +ATOM 110 CA GLU A 110 454.401 447.985 463.070 1.00 0.00 C +ATOM 111 CA HIS A 111 453.560 446.506 466.479 1.00 0.00 C +ATOM 112 CA GLU A 112 453.247 447.332 470.185 1.00 0.00 C +ATOM 113 CA LYS A 113 456.408 447.073 472.295 1.00 0.00 C +ATOM 114 CA GLU A 114 458.297 448.417 475.319 1.00 0.00 C +ATOM 115 CA HIS A 115 456.285 447.584 478.445 1.00 0.00 C +ATOM 116 CA LYS A 116 453.883 448.150 481.348 1.00 0.00 C +ATOM 117 CA LYS A 117 455.471 449.451 484.558 1.00 0.00 C +ATOM 118 CA GLY A 118 453.661 452.052 486.673 1.00 0.00 C +ATOM 119 CA LYS A 119 454.115 451.108 490.336 1.00 0.00 C +ATOM 120 CA GLU A 120 453.302 449.453 493.670 1.00 0.00 C +ATOM 121 CA LYS A 121 454.927 448.226 496.891 1.00 0.00 C +ATOM 122 CA LYS A 122 456.020 447.817 500.517 1.00 0.00 C +ATOM 123 CA HIS A 123 458.285 444.757 500.658 1.00 0.00 C +ATOM 124 CA GLU A 124 461.706 443.499 499.549 1.00 0.00 C +ATOM 125 CA GLU A 125 464.220 443.869 496.710 1.00 0.00 C +ATOM 126 CA LEU A 126 467.916 444.159 495.830 1.00 0.00 C +ATOM 127 CA GLU A 127 471.071 446.284 495.615 1.00 0.00 C +ATOM 128 CA GLU A 128 471.685 449.726 497.128 1.00 0.00 C +ATOM 129 CA GLU A 129 470.789 453.395 497.630 1.00 0.00 C +ATOM 130 CA LYS A 130 470.851 456.856 496.038 1.00 0.00 C +ATOM 131 CA GLU A 131 470.064 458.341 492.619 1.00 0.00 C +ATOM 132 CA GLY A 132 467.179 460.158 490.919 1.00 0.00 C +ATOM 133 CA LYS A 133 466.897 463.512 489.133 1.00 0.00 C +ATOM 134 CA LYS A 134 468.514 466.135 491.375 1.00 0.00 C +ATOM 135 CA LYS A 135 471.110 468.801 492.191 1.00 0.00 C +ATOM 136 CA LYS A 136 471.224 472.140 490.359 1.00 0.00 C +ATOM 137 CA ASN A 137 469.919 473.774 487.174 1.00 0.00 C +ATOM 138 CA LYS A 138 466.843 473.444 484.950 1.00 0.00 C +ATOM 139 CA LYS A 139 463.416 472.632 486.405 1.00 0.00 C +ATOM 140 CA GLU A 140 460.112 470.904 485.624 1.00 0.00 C +ATOM 141 CA LYS A 141 457.833 468.848 483.366 1.00 0.00 C +ATOM 142 CA ASP A 142 459.347 467.490 480.145 1.00 0.00 C +ATOM 143 CA GLU A 143 459.335 469.863 477.164 1.00 0.00 C +ATOM 144 CA SER A 144 459.668 469.728 473.371 1.00 0.00 C +ATOM 145 CA GLY A 145 463.145 469.024 471.982 1.00 0.00 C +ATOM 146 CA PRO A 146 463.524 465.310 471.220 1.00 0.00 C +ATOM 147 CA GLU A 147 463.338 461.534 470.748 1.00 0.00 C +ATOM 148 CA GLU A 148 459.961 459.953 471.532 1.00 0.00 C +ATOM 149 CA LYS A 149 459.303 457.086 473.953 1.00 0.00 C +ATOM 150 CA ASN A 150 461.438 455.973 476.906 1.00 0.00 C +ATOM 151 CA LYS A 151 464.094 458.572 477.746 1.00 0.00 C +ATOM 152 CA LYS A 152 462.980 460.999 480.464 1.00 0.00 C +ATOM 153 CA ALA A 153 463.194 463.044 483.672 1.00 0.00 C +ATOM 154 CA ASP A 154 464.502 466.597 483.248 1.00 0.00 C +ATOM 155 CA LYS A 155 468.310 466.482 483.280 1.00 0.00 C +ATOM 156 CA GLU A 156 469.165 462.897 482.316 1.00 0.00 C +ATOM 157 CA LYS A 157 471.975 462.347 479.802 1.00 0.00 C +ATOM 158 CA LYS A 158 475.569 462.615 481.037 1.00 0.00 C +ATOM 159 CA HIS A 159 478.854 463.982 479.674 1.00 0.00 C +ATOM 160 CA GLU A 160 481.926 462.425 481.302 1.00 0.00 C +ATOM 161 CA ASP A 161 484.781 464.749 480.319 1.00 0.00 C +ATOM 162 CA VAL A 162 488.560 464.300 480.494 1.00 0.00 C +ATOM 163 CA SER A 163 491.290 461.688 480.987 1.00 0.00 C +ATOM 164 CA GLN A 164 494.723 460.042 480.837 1.00 0.00 C +ATOM 165 CA GLU A 165 496.999 460.277 483.884 1.00 0.00 C +ATOM 166 CA LYS A 166 496.957 457.018 485.857 1.00 0.00 C +ATOM 167 CA GLU A 167 499.069 453.850 485.973 1.00 0.00 C +ATOM 168 CA GLU A 168 502.638 453.446 487.243 1.00 0.00 C +ATOM 169 CA LEU A 169 506.023 451.738 487.623 1.00 0.00 C +ATOM 170 CA GLU A 170 509.107 450.589 485.703 1.00 0.00 C +ATOM 171 CA GLU A 171 511.545 449.107 488.229 1.00 0.00 C +ATOM 172 CA GLU A 172 513.528 445.926 487.549 1.00 0.00 C +ATOM 173 CA ASP A 173 512.143 444.385 484.351 1.00 0.00 C +ATOM 174 CA GLY A 174 514.435 441.795 482.754 1.00 0.00 C +ATOM 175 CA LYS A 175 514.158 441.337 478.981 1.00 0.00 C +ATOM 176 CA LYS A 176 514.064 441.978 475.227 1.00 0.00 C +ATOM 177 CA ASN A 177 510.592 440.906 474.084 1.00 0.00 C +ATOM 178 CA LYS A 178 507.813 443.509 474.199 1.00 0.00 C +ATOM 179 CA LYS A 179 508.078 447.084 472.906 1.00 0.00 C +ATOM 180 CA LYS A 180 509.226 449.125 475.911 1.00 0.00 C +ATOM 181 CA GLU A 181 506.993 451.539 477.835 1.00 0.00 C +ATOM 182 CA LYS A 182 506.831 454.397 480.350 1.00 0.00 C +ATOM 183 CA ASP A 183 507.108 457.967 481.652 1.00 0.00 C +ATOM 184 CA GLU A 184 507.186 458.676 485.394 1.00 0.00 C +ATOM 185 CA SER A 185 510.394 460.647 485.977 1.00 0.00 C +ATOM 186 CA GLY A 186 512.941 463.305 486.963 1.00 0.00 C +ATOM 187 CA THR A 187 515.987 465.582 486.751 1.00 0.00 C +ATOM 188 CA GLU A 188 519.642 464.569 486.383 1.00 0.00 C +ATOM 189 CA GLU A 189 521.559 466.820 488.785 1.00 0.00 C +ATOM 190 CA LYS A 190 521.287 469.180 491.764 1.00 0.00 C +ATOM 191 CA LYS A 191 519.047 468.168 494.675 1.00 0.00 C +ATOM 192 CA LYS A 192 517.268 467.818 498.026 1.00 0.00 C +ATOM 193 CA LYS A 193 514.812 464.913 497.818 1.00 0.00 C +ATOM 194 CA PRO A 194 515.665 462.796 494.767 1.00 0.00 C +ATOM 195 CA LYS A 195 513.793 459.794 493.355 1.00 0.00 C +ATOM 196 CA LYS A 196 511.447 456.796 493.510 1.00 0.00 C +ATOM 197 CA GLU A 197 510.677 455.113 490.180 1.00 0.00 C +ATOM 198 CA LYS A 198 513.853 455.387 488.094 1.00 0.00 C +ATOM 199 CA LYS A 199 516.968 455.167 490.276 1.00 0.00 C +ATOM 200 CA GLN A 200 516.768 453.986 493.893 1.00 0.00 C +ATOM 201 CA LYS A 201 517.901 455.234 497.310 1.00 0.00 C +ATOM 202 CA GLU A 202 520.897 456.532 499.273 1.00 0.00 C +ATOM 203 CA GLU A 203 520.391 456.708 503.045 1.00 0.00 C +ATOM 204 CA SER A 204 517.430 455.965 505.325 1.00 0.00 C +ATOM 205 CA LYS A 205 514.062 454.259 505.835 1.00 0.00 C +ATOM 206 CA SER A 206 510.926 452.844 507.473 1.00 0.00 C +ATOM 207 CA ASN A 207 510.435 449.402 509.031 1.00 0.00 C +ATOM 208 CA GLU A 208 509.926 446.349 511.252 1.00 0.00 C +ATOM 209 CA ASP A 209 509.928 443.128 509.217 1.00 0.00 C +ATOM 210 CA LYS A 210 511.694 443.357 505.849 1.00 0.00 C +ATOM 211 CA LYS A 211 509.283 443.295 502.900 1.00 0.00 C +ATOM 212 CA VAL A 212 510.945 443.004 499.484 1.00 0.00 C +ATOM 213 CA LYS A 213 510.504 439.529 497.985 1.00 0.00 C +ATOM 214 CA GLY A 214 509.252 436.294 499.561 1.00 0.00 C +ATOM 215 CA LYS A 215 508.643 433.378 501.936 1.00 0.00 C +ATOM 216 CA LYS A 216 505.421 431.428 501.358 1.00 0.00 C +ATOM 217 CA GLU A 217 504.467 428.727 503.870 1.00 0.00 C +ATOM 218 CA LYS A 218 502.237 427.843 506.830 1.00 0.00 C +ATOM 219 CA GLY A 219 502.272 425.005 509.373 1.00 0.00 C +ATOM 220 CA GLU A 220 503.122 422.489 512.104 1.00 0.00 C +ATOM 221 CA LYS A 221 500.541 421.416 514.693 1.00 0.00 C +ATOM 222 CA GLY A 222 497.199 423.001 515.607 1.00 0.00 C +ATOM 223 CA ASP A 223 493.488 422.139 515.648 1.00 0.00 C +ATOM 224 CA LEU A 224 491.753 420.570 512.641 1.00 0.00 C +ATOM 225 CA GLU A 225 493.443 422.150 509.613 1.00 0.00 C +ATOM 226 CA LYS A 226 494.020 419.453 506.984 1.00 0.00 C +ATOM 227 CA GLU A 227 497.331 417.615 506.569 1.00 0.00 C +ATOM 228 CA ASP A 228 499.547 417.175 503.500 1.00 0.00 C +ATOM 229 CA GLU A 229 497.387 416.560 500.422 1.00 0.00 C +ATOM 230 CA GLU A 230 494.112 417.771 498.898 1.00 0.00 C +ATOM 231 CA LYS A 231 490.324 417.450 498.647 1.00 0.00 C +ATOM 232 CA LYS A 232 486.965 415.749 498.066 1.00 0.00 C +ATOM 233 CA LYS A 233 484.806 414.016 495.448 1.00 0.00 C +ATOM 234 CA GLU A 234 482.303 411.337 496.484 1.00 0.00 C +ATOM 235 CA HIS A 235 480.797 409.892 493.296 1.00 0.00 C +ATOM 236 CA ASP A 236 482.248 406.738 491.726 1.00 0.00 C +ATOM 237 CA GLU A 237 483.342 405.032 488.500 1.00 0.00 C +ATOM 238 CA THR A 238 486.368 402.772 487.997 1.00 0.00 C +ATOM 239 CA ASP A 239 489.828 402.153 486.526 1.00 0.00 C +ATOM 240 CA GLN A 240 492.190 400.974 489.273 1.00 0.00 C +ATOM 241 CA GLU A 241 492.915 403.053 492.382 1.00 0.00 C +ATOM 242 CA MET A 242 489.634 403.989 494.078 1.00 0.00 C +ATOM 243 CA LYS A 243 487.147 405.030 496.770 1.00 0.00 C +ATOM 244 CA GLU A 244 486.371 404.065 500.373 1.00 0.00 C +ATOM 245 CA LYS A 245 482.673 404.623 501.098 1.00 0.00 C +ATOM 246 CA ASP A 246 481.846 406.976 503.978 1.00 0.00 C +ATOM 247 CA SER A 247 484.202 405.926 506.783 1.00 0.00 C +ATOM 248 CA LYS A 248 485.538 406.333 510.328 1.00 0.00 C +ATOM 249 CA LYS A 249 482.711 407.075 512.771 1.00 0.00 C +ATOM 250 CA ASN A 250 482.196 410.808 513.333 1.00 0.00 C +ATOM 251 CA LYS A 251 483.517 414.380 513.243 1.00 0.00 C +ATOM 252 CA LYS A 252 487.273 415.019 513.157 1.00 0.00 C +ATOM 253 CA LYS A 253 489.843 413.428 515.476 1.00 0.00 C +ATOM 254 CA GLU A 254 489.045 412.423 519.063 1.00 0.00 C +ATOM 255 CA LYS A 255 487.427 409.966 521.484 1.00 0.00 C +ATOM 256 CA ASP A 256 484.161 409.459 523.379 1.00 0.00 C +ATOM 257 CA GLU A 257 481.895 411.226 525.881 1.00 0.00 C +ATOM 258 CA SER A 258 478.291 412.171 525.085 1.00 0.00 C +ATOM 259 CA CYS A 259 475.901 414.419 523.148 1.00 0.00 C +ATOM 260 CA ALA A 260 475.191 418.160 523.006 1.00 0.00 C +ATOM 261 CA GLU A 261 474.416 420.589 520.175 1.00 0.00 C +ATOM 262 CA GLU A 262 474.857 420.512 516.391 1.00 0.00 C +ATOM 263 CA LYS A 263 471.885 418.528 515.068 1.00 0.00 C +ATOM 264 CA LYS A 264 471.923 418.802 511.268 1.00 0.00 C +ATOM 265 CA LYS A 265 471.843 415.436 509.485 1.00 0.00 C +ATOM 266 CA LYS A 266 469.552 415.604 506.445 1.00 0.00 C +ATOM 267 CA PRO A 267 471.113 417.973 503.902 1.00 0.00 C +ATOM 268 CA ASP A 268 470.839 420.324 500.916 1.00 0.00 C +ATOM 269 CA LYS A 269 471.840 422.500 497.953 1.00 0.00 C +ATOM 270 CA GLU A 270 474.493 421.839 495.300 1.00 0.00 C +ATOM 271 CA LYS A 271 477.021 419.672 493.448 1.00 0.00 C +ATOM 272 CA LYS A 272 476.036 416.487 491.604 1.00 0.00 C +ATOM 273 CA GLU A 273 472.448 415.369 490.976 1.00 0.00 C +ATOM 274 CA LYS A 274 470.953 415.422 487.472 1.00 0.00 C +ATOM 275 CA ASP A 275 471.761 412.450 485.228 1.00 0.00 C +ATOM 276 CA GLU A 276 469.807 409.410 486.434 1.00 0.00 C +ATOM 277 CA SER A 277 469.371 409.415 490.219 1.00 0.00 C +ATOM 278 CA THR A 278 472.554 408.142 491.882 1.00 0.00 C +ATOM 279 CA GLU A 279 475.541 405.783 491.709 1.00 0.00 C +ATOM 280 CA LYS A 280 477.401 402.535 490.997 1.00 0.00 C +ATOM 281 CA GLU A 281 475.088 399.508 490.939 1.00 0.00 C +ATOM 282 CA ASP A 282 471.329 398.924 490.734 1.00 0.00 C +ATOM 283 CA LYS A 283 469.377 401.971 489.542 1.00 0.00 C +ATOM 284 CA LYS A 284 465.677 402.789 489.933 1.00 0.00 C +ATOM 285 CA LEU A 285 462.851 400.518 488.763 1.00 0.00 C +ATOM 286 CA LYS A 286 459.674 401.282 486.804 1.00 0.00 C +ATOM 287 CA GLY A 287 456.428 402.258 485.064 1.00 0.00 C +ATOM 288 CA LYS A 288 456.454 405.765 483.573 1.00 0.00 C +ATOM 289 CA LYS A 289 453.879 408.203 482.180 1.00 0.00 C +ATOM 290 CA GLY A 290 450.188 408.999 481.668 1.00 0.00 C +ATOM 291 CA LYS A 291 448.756 412.255 483.033 1.00 0.00 C +ATOM 292 CA GLY A 292 450.435 415.066 481.086 1.00 0.00 C +ATOM 293 CA GLU A 293 453.928 414.595 479.638 1.00 0.00 C +ATOM 294 CA LYS A 294 454.733 411.708 477.285 1.00 0.00 C +ATOM 295 CA PRO A 295 456.035 409.884 474.204 1.00 0.00 C +ATOM 296 CA GLU A 296 457.433 411.081 470.868 1.00 0.00 C +ATOM 297 CA LYS A 297 456.539 413.681 468.230 1.00 0.00 C +ATOM 298 CA GLU A 298 454.253 415.778 466.018 1.00 0.00 C +ATOM 299 CA ASP A 299 454.450 418.259 463.133 1.00 0.00 C +ATOM 300 CA GLU A 300 452.305 419.431 460.211 1.00 0.00 C +ATOM 301 CA GLY A 301 452.766 422.912 458.732 1.00 0.00 C +ATOM 302 CA LYS A 302 449.678 423.929 456.746 1.00 0.00 C +ATOM 303 CA LYS A 303 447.118 424.372 453.959 1.00 0.00 C +ATOM 304 CA THR A 304 445.648 427.851 453.457 1.00 0.00 C +ATOM 305 CA LYS A 305 447.636 430.378 451.412 1.00 0.00 C +ATOM 306 CA GLU A 306 447.920 432.089 448.020 1.00 0.00 C +ATOM 307 CA HIS A 307 449.809 435.031 446.505 1.00 0.00 C +ATOM 308 CA ASP A 308 451.684 438.210 447.451 1.00 0.00 C +ATOM 309 CA ALA A 309 450.544 440.947 445.059 1.00 0.00 C +ATOM 310 CA THR A 310 450.538 441.687 441.321 1.00 0.00 C +ATOM 311 CA GLU A 311 452.696 438.964 439.760 1.00 0.00 C +ATOM 312 CA GLN A 312 456.383 439.526 438.982 1.00 0.00 C +ATOM 313 CA GLU A 313 457.629 436.086 437.918 1.00 0.00 C +ATOM 314 CA MET A 314 455.572 433.446 436.096 1.00 0.00 C +ATOM 315 CA ASP A 315 453.985 432.781 432.697 1.00 0.00 C +ATOM 316 CA ASP A 316 453.247 435.987 430.776 1.00 0.00 C +ATOM 317 CA GLU A 317 455.232 436.062 427.524 1.00 0.00 C +ATOM 318 CA ALA A 318 454.208 433.793 424.640 1.00 0.00 C +ATOM 319 CA ALA A 319 456.016 431.720 422.003 1.00 0.00 C +ATOM 320 CA ASP A 320 459.237 432.920 420.359 1.00 0.00 C +ATOM 321 CA HIS A 321 458.886 432.631 416.577 1.00 0.00 C +ATOM 322 CA LYS A 322 457.158 435.708 415.142 1.00 0.00 C +ATOM 323 CA GLU A 323 454.285 438.114 414.450 1.00 0.00 C +ATOM 324 CA GLY A 324 451.600 438.227 417.151 1.00 0.00 C +ATOM 325 CA LYS A 325 448.248 438.041 418.952 1.00 0.00 C +ATOM 326 CA LYS A 326 445.556 439.546 421.189 1.00 0.00 C +ATOM 327 CA LYS A 327 443.697 442.337 422.998 1.00 0.00 C +ATOM 328 CA LYS A 328 445.988 444.521 425.118 1.00 0.00 C +ATOM 329 CA ASN A 329 448.426 446.440 422.906 1.00 0.00 C +ATOM 330 CA LYS A 330 448.304 450.036 421.653 1.00 0.00 C +ATOM 331 CA ASP A 331 446.725 453.499 421.475 1.00 0.00 C +ATOM 332 CA LYS A 332 447.169 457.232 420.858 1.00 0.00 C +ATOM 333 CA ALA A 333 448.933 458.107 417.596 1.00 0.00 C +ATOM 334 CA LYS A 334 448.718 457.986 413.794 1.00 0.00 C +ATOM 335 CA LYS A 335 449.085 457.295 410.066 1.00 0.00 C +ATOM 336 CA LYS A 336 449.832 457.390 406.331 1.00 0.00 C +ATOM 337 CA GLU A 337 450.020 454.594 403.750 1.00 0.00 C +ATOM 338 CA THR A 338 447.244 452.691 401.963 1.00 0.00 C +ATOM 339 CA VAL A 339 443.506 451.999 401.718 1.00 0.00 C +ATOM 340 CA ILE A 340 439.802 452.263 402.572 1.00 0.00 C +ATOM 341 CA ASP A 341 438.403 449.196 404.347 1.00 0.00 C +ATOM 342 CA GLU A 342 437.474 445.518 404.701 1.00 0.00 C +ATOM 343 CA VAL A 343 437.124 443.464 407.891 1.00 0.00 C +ATOM 344 CA CYS A 344 439.679 443.006 410.679 1.00 0.00 C +ATOM 345 CA GLU A 345 442.667 445.357 410.427 1.00 0.00 C +ATOM 346 CA LYS A 346 444.473 446.570 413.555 1.00 0.00 C +ATOM 347 CA GLU A 347 442.452 448.447 416.184 1.00 0.00 C +ATOM 348 CA THR A 348 442.448 452.201 415.534 1.00 0.00 C +ATOM 349 CA LYS A 349 439.683 453.140 413.086 1.00 0.00 C +ATOM 350 CA ASP A 350 436.590 451.053 413.856 1.00 0.00 C +ATOM 351 CA LYS A 351 435.916 449.469 417.255 1.00 0.00 C +ATOM 352 CA ASP A 352 436.360 449.622 421.036 1.00 0.00 C +ATOM 353 CA ASP A 353 433.583 451.458 422.888 1.00 0.00 C +ATOM 354 CA ASP A 354 431.216 450.666 425.767 1.00 0.00 C +ATOM 355 CA GLU A 355 428.498 452.409 427.789 1.00 0.00 C +ATOM 356 CA GLY A 356 426.363 455.064 426.083 1.00 0.00 C +ATOM 357 CA GLU A 357 422.604 454.916 426.688 1.00 0.00 C +ATOM 358 CA THR A 358 421.376 451.317 426.465 1.00 0.00 C +ATOM 359 CA LYS A 359 423.119 448.815 424.179 1.00 0.00 C +ATOM 360 CA GLN A 360 424.007 450.084 420.698 1.00 0.00 C +ATOM 361 CA LYS A 361 423.132 451.439 417.247 1.00 0.00 C +ATOM 362 CA LYS A 362 420.681 453.872 415.639 1.00 0.00 C +ATOM 363 CA ASN A 363 417.387 452.589 414.216 1.00 0.00 C +TER 364 ASN A 363 +END diff --git a/Plants/Q941N0/Q941N0.dcd b/Plants/Q941N0/Q941N0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..4f8753c1c416cc70846691e6cbf49c2b7fb6defc --- /dev/null +++ b/Plants/Q941N0/Q941N0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:d067aefe9c1c72997525fd741f495ef052f6c719440c689d6a46ff9721f64d00 +size 14360276 diff --git a/Plants/Q941N0/top.pdb b/Plants/Q941N0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..df6a3901cddad178aa72ba0f3ceff0748ceee101 --- /dev/null +++ b/Plants/Q941N0/top.pdb @@ -0,0 +1,117 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 271.527 205.093 256.560 1.00 0.00 C +ATOM 2 CA ALA A 2 273.284 208.455 256.207 1.00 0.00 C +ATOM 3 CA GLY A 3 276.368 210.691 256.274 1.00 0.00 C +ATOM 4 CA ILE A 4 277.605 212.334 253.066 1.00 0.00 C +ATOM 5 CA ILE A 5 277.549 214.172 249.730 1.00 0.00 C +ATOM 6 CA ASN A 6 277.345 216.358 246.616 1.00 0.00 C +ATOM 7 CA LYS A 7 275.554 216.985 243.312 1.00 0.00 C +ATOM 8 CA ILE A 8 272.983 214.181 243.099 1.00 0.00 C +ATOM 9 CA GLY A 9 270.321 212.132 241.301 1.00 0.00 C +ATOM 10 CA GLU A 10 267.113 213.460 239.733 1.00 0.00 C +ATOM 11 CA THR A 11 265.018 216.232 241.297 1.00 0.00 C +ATOM 12 CA LEU A 12 264.740 217.113 244.993 1.00 0.00 C +ATOM 13 CA HIS A 13 264.229 217.919 248.681 1.00 0.00 C +ATOM 14 CA VAL A 14 262.328 215.434 250.855 1.00 0.00 C +ATOM 15 CA GLY A 15 258.545 215.876 250.968 1.00 0.00 C +ATOM 16 CA GLY A 16 255.342 217.590 249.821 1.00 0.00 C +ATOM 17 CA HIS A 17 252.970 219.214 247.321 1.00 0.00 C +ATOM 18 CA LYS A 18 251.112 222.371 248.369 1.00 0.00 C +ATOM 19 CA LYS A 19 250.836 224.542 245.250 1.00 0.00 C +ATOM 20 CA GLU A 20 253.844 226.500 243.972 1.00 0.00 C +ATOM 21 CA GLU A 21 257.431 226.825 242.730 1.00 0.00 C +ATOM 22 CA GLU A 22 260.378 227.050 240.325 1.00 0.00 C +ATOM 23 CA HIS A 23 261.281 230.328 238.606 1.00 0.00 C +ATOM 24 CA LYS A 24 262.138 232.184 235.391 1.00 0.00 C +ATOM 25 CA GLY A 25 262.207 234.149 232.128 1.00 0.00 C +ATOM 26 CA GLU A 26 261.660 235.348 228.553 1.00 0.00 C +ATOM 27 CA VAL A 27 260.228 234.712 225.080 1.00 0.00 C +ATOM 28 CA HIS A 28 263.013 234.842 222.483 1.00 0.00 C +ATOM 29 CA GLY A 29 264.181 236.760 219.404 1.00 0.00 C +ATOM 30 CA GLU A 30 264.073 239.755 217.053 1.00 0.00 C +ATOM 31 CA TYR A 31 263.397 240.374 213.355 1.00 0.00 C +ATOM 32 CA LYS A 32 262.183 243.686 211.917 1.00 0.00 C +ATOM 33 CA GLY A 33 261.674 247.451 212.212 1.00 0.00 C +ATOM 34 CA GLU A 34 264.448 249.064 214.265 1.00 0.00 C +ATOM 35 CA SER A 35 265.961 246.954 217.053 1.00 0.00 C +ATOM 36 CA HIS A 36 265.157 246.823 220.775 1.00 0.00 C +ATOM 37 CA GLY A 37 266.204 247.694 224.333 1.00 0.00 C +ATOM 38 CA GLU A 38 264.292 249.728 226.926 1.00 0.00 C +ATOM 39 CA TYR A 39 261.190 250.444 229.018 1.00 0.00 C +ATOM 40 CA LYS A 40 257.473 251.277 228.949 1.00 0.00 C +ATOM 41 CA GLY A 41 255.676 251.343 225.589 1.00 0.00 C +ATOM 42 CA GLU A 42 258.306 251.911 222.892 1.00 0.00 C +ATOM 43 CA SER A 43 256.908 254.514 220.486 1.00 0.00 C +ATOM 44 CA HIS A 44 253.104 254.479 220.282 1.00 0.00 C +ATOM 45 CA GLY A 45 249.962 253.122 218.606 1.00 0.00 C +ATOM 46 CA GLU A 46 248.293 249.700 218.488 1.00 0.00 C +ATOM 47 CA HIS A 47 245.106 250.033 220.548 1.00 0.00 C +ATOM 48 CA LYS A 48 245.601 249.181 224.228 1.00 0.00 C +ATOM 49 CA GLY A 49 247.632 247.871 227.173 1.00 0.00 C +ATOM 50 CA GLU A 50 250.427 248.329 229.722 1.00 0.00 C +ATOM 51 CA LEU A 51 252.269 246.799 232.686 1.00 0.00 C +ATOM 52 CA HIS A 52 251.597 245.584 236.234 1.00 0.00 C +ATOM 53 CA GLY A 53 249.524 244.977 239.372 1.00 0.00 C +ATOM 54 CA TYR A 54 248.713 246.700 242.672 1.00 0.00 C +ATOM 55 CA GLY A 55 246.960 246.287 246.030 1.00 0.00 C +ATOM 56 CA GLY A 56 249.557 246.345 248.817 1.00 0.00 C +ATOM 57 CA GLU A 57 251.036 244.739 251.939 1.00 0.00 C +ATOM 58 CA HIS A 58 249.978 244.949 255.593 1.00 0.00 C +ATOM 59 CA LYS A 59 247.174 246.937 257.235 1.00 0.00 C +ATOM 60 CA PRO A 60 248.362 247.947 260.711 1.00 0.00 C +ATOM 61 CA GLU A 61 250.604 251.020 260.497 1.00 0.00 C +ATOM 62 CA HIS A 62 248.580 253.961 259.167 1.00 0.00 C +ATOM 63 CA HIS A 63 250.398 255.386 256.137 1.00 0.00 C +ATOM 64 CA GLY A 64 248.378 257.660 253.843 1.00 0.00 C +ATOM 65 CA GLU A 65 246.785 255.509 251.132 1.00 0.00 C +ATOM 66 CA GLU A 66 244.435 253.155 249.274 1.00 0.00 C +ATOM 67 CA HIS A 67 240.990 252.510 247.781 1.00 0.00 C +ATOM 68 CA LYS A 68 240.562 254.635 244.647 1.00 0.00 C +ATOM 69 CA GLU A 69 240.224 258.339 245.473 1.00 0.00 C +ATOM 70 CA GLY A 70 241.543 261.793 246.394 1.00 0.00 C +ATOM 71 CA PHE A 71 241.763 265.161 248.161 1.00 0.00 C +ATOM 72 CA VAL A 72 240.519 268.499 249.514 1.00 0.00 C +ATOM 73 CA ASP A 73 237.023 269.964 249.136 1.00 0.00 C +ATOM 74 CA LYS A 74 234.539 271.248 246.547 1.00 0.00 C +ATOM 75 CA ILE A 75 232.247 274.166 245.684 1.00 0.00 C +ATOM 76 CA LYS A 76 232.009 276.569 248.631 1.00 0.00 C +ATOM 77 CA ASP A 77 234.521 278.726 250.516 1.00 0.00 C +ATOM 78 CA LYS A 78 233.289 278.936 254.115 1.00 0.00 C +ATOM 79 CA ILE A 79 231.350 280.404 257.048 1.00 0.00 C +ATOM 80 CA HIS A 80 229.475 283.631 256.282 1.00 0.00 C +ATOM 81 CA GLY A 81 226.652 284.671 258.621 1.00 0.00 C +ATOM 82 CA ASP A 82 225.135 282.223 261.115 1.00 0.00 C +ATOM 83 CA GLY A 83 221.537 281.909 262.327 1.00 0.00 C +ATOM 84 CA GLU A 84 220.518 278.330 261.510 1.00 0.00 C +ATOM 85 CA GLY A 85 220.517 274.548 261.972 1.00 0.00 C +ATOM 86 CA GLY A 86 220.975 270.886 262.919 1.00 0.00 C +ATOM 87 CA GLU A 87 220.702 267.251 264.026 1.00 0.00 C +ATOM 88 CA LYS A 88 222.878 266.469 267.055 1.00 0.00 C +ATOM 89 CA LYS A 89 225.127 264.102 269.018 1.00 0.00 C +ATOM 90 CA LYS A 90 225.346 261.397 271.692 1.00 0.00 C +ATOM 91 CA LYS A 91 226.981 262.318 275.007 1.00 0.00 C +ATOM 92 CA LYS A 92 229.442 260.174 276.972 1.00 0.00 C +ATOM 93 CA ASP A 93 230.731 256.665 277.708 1.00 0.00 C +ATOM 94 CA LYS A 94 233.662 254.244 277.450 1.00 0.00 C +ATOM 95 CA LYS A 95 236.733 256.486 277.696 1.00 0.00 C +ATOM 96 CA LYS A 96 240.191 257.777 276.751 1.00 0.00 C +ATOM 97 CA HIS A 97 242.446 258.538 273.776 1.00 0.00 C +ATOM 98 CA GLU A 98 243.775 262.040 273.082 1.00 0.00 C +ATOM 99 CA HIS A 99 246.378 264.093 274.961 1.00 0.00 C +ATOM 100 CA GLY A 100 246.932 267.770 275.790 1.00 0.00 C +ATOM 101 CA HIS A 101 246.746 269.189 279.321 1.00 0.00 C +ATOM 102 CA GLU A 102 245.192 269.545 282.782 1.00 0.00 C +ATOM 103 CA HIS A 103 245.189 273.031 284.319 1.00 0.00 C +ATOM 104 CA GLY A 104 247.180 274.075 287.395 1.00 0.00 C +ATOM 105 CA HIS A 105 250.394 275.394 288.959 1.00 0.00 C +ATOM 106 CA ASP A 106 253.541 274.166 287.196 1.00 0.00 C +ATOM 107 CA SER A 107 256.349 275.472 284.976 1.00 0.00 C +ATOM 108 CA SER A 108 256.722 276.219 281.259 1.00 0.00 C +ATOM 109 CA SER A 109 256.605 273.071 279.115 1.00 0.00 C +ATOM 110 CA SER A 110 255.958 269.347 278.638 1.00 0.00 C +ATOM 111 CA ASP A 111 253.399 266.699 277.659 1.00 0.00 C +ATOM 112 CA SER A 112 251.469 265.264 280.614 1.00 0.00 C +ATOM 113 CA ASP A 113 251.992 261.516 281.060 1.00 0.00 C +TER 114 ASP A 113 +END diff --git a/Plants/Q943B8/Q943B8.dcd b/Plants/Q943B8/Q943B8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..55fbdeab5d5294dd82a2e8fa7efa0d11dece89ee --- /dev/null +++ b/Plants/Q943B8/Q943B8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:42205601a68496751a37d261a7a6fb50fdb29662a29a9bc98fd8d050ec47a270 +size 8240276 diff --git a/Plants/Q943B8/top.pdb b/Plants/Q943B8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..9da6c4a8640c9152095a6e40188b212a37a43b7a --- /dev/null +++ b/Plants/Q943B8/top.pdb @@ -0,0 +1,66 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 211.956 253.725 259.033 1.00 0.00 C +ATOM 2 CA GLU A 2 211.805 250.564 256.910 1.00 0.00 C +ATOM 3 CA VAL A 3 210.522 247.878 254.532 1.00 0.00 C +ATOM 4 CA ALA A 4 212.183 244.530 255.268 1.00 0.00 C +ATOM 5 CA ALA A 5 215.618 242.980 254.706 1.00 0.00 C +ATOM 6 CA VAL A 6 219.267 242.213 253.924 1.00 0.00 C +ATOM 7 CA ASP A 7 222.367 242.425 256.130 1.00 0.00 C +ATOM 8 CA ARG A 8 222.975 241.612 259.802 1.00 0.00 C +ATOM 9 CA GLY A 9 223.130 244.888 261.741 1.00 0.00 C +ATOM 10 CA ALA A 10 224.613 247.524 264.059 1.00 0.00 C +ATOM 11 CA ALA A 11 225.806 247.057 267.647 1.00 0.00 C +ATOM 12 CA ALA A 12 227.826 249.476 269.787 1.00 0.00 C +ATOM 13 CA PRO A 13 231.197 251.250 269.869 1.00 0.00 C +ATOM 14 CA ASP A 14 232.786 254.678 269.381 1.00 0.00 C +ATOM 15 CA GLU A 15 233.994 254.659 265.767 1.00 0.00 C +ATOM 16 CA GLY A 16 235.677 255.054 262.372 1.00 0.00 C +ATOM 17 CA GLY A 17 235.845 258.482 260.716 1.00 0.00 C +ATOM 18 CA ASP A 18 234.195 260.394 257.864 1.00 0.00 C +ATOM 19 CA GLY A 19 235.384 263.920 257.045 1.00 0.00 C +ATOM 20 CA GLY A 20 237.150 266.779 258.841 1.00 0.00 C +ATOM 21 CA SER A 21 237.179 266.489 262.640 1.00 0.00 C +ATOM 22 CA SER A 22 239.115 263.676 264.329 1.00 0.00 C +ATOM 23 CA SER A 23 242.096 261.337 263.927 1.00 0.00 C +ATOM 24 CA ASP A 24 245.076 263.508 262.966 1.00 0.00 C +ATOM 25 CA SER A 25 248.306 263.254 264.970 1.00 0.00 C +ATOM 26 CA ALA A 26 247.309 261.513 268.209 1.00 0.00 C +ATOM 27 CA GLY A 27 246.478 257.832 267.686 1.00 0.00 C +ATOM 28 CA VAL A 28 247.936 255.094 265.473 1.00 0.00 C +ATOM 29 CA ALA A 29 250.222 253.871 262.682 1.00 0.00 C +ATOM 30 CA THR A 30 253.913 253.027 262.260 1.00 0.00 C +ATOM 31 CA ALA A 31 255.495 249.750 261.132 1.00 0.00 C +ATOM 32 CA ARG A 32 256.698 246.184 260.536 1.00 0.00 C +ATOM 33 CA GLY A 33 259.576 244.600 262.465 1.00 0.00 C +ATOM 34 CA ASP A 34 263.358 244.957 262.171 1.00 0.00 C +ATOM 35 CA THR A 35 266.433 242.922 261.211 1.00 0.00 C +ATOM 36 CA SER A 36 266.284 241.436 257.707 1.00 0.00 C +ATOM 37 CA PRO A 37 266.873 241.407 253.942 1.00 0.00 C +ATOM 38 CA PRO A 38 270.125 243.069 252.857 1.00 0.00 C +ATOM 39 CA THR A 39 270.563 246.842 252.553 1.00 0.00 C +ATOM 40 CA ARG A 40 271.229 250.582 252.271 1.00 0.00 C +ATOM 41 CA LEU A 41 268.730 252.133 249.849 1.00 0.00 C +ATOM 42 CA LEU A 42 268.721 250.602 246.360 1.00 0.00 C +ATOM 43 CA ALA A 43 266.291 249.157 243.805 1.00 0.00 C +ATOM 44 CA HIS A 44 266.972 248.844 240.069 1.00 0.00 C +ATOM 45 CA SER A 45 268.880 246.494 237.755 1.00 0.00 C +ATOM 46 CA SER A 46 270.999 243.389 238.373 1.00 0.00 C +ATOM 47 CA PRO A 47 274.021 243.739 236.078 1.00 0.00 C +ATOM 48 CA LYS A 48 277.077 245.941 236.648 1.00 0.00 C +ATOM 49 CA SER A 49 279.067 246.555 233.457 1.00 0.00 C +ATOM 50 CA CYS A 50 277.040 248.589 230.954 1.00 0.00 C +ATOM 51 CA ARG A 51 273.505 247.168 230.943 1.00 0.00 C +ATOM 52 CA ASN A 52 271.489 244.106 229.905 1.00 0.00 C +ATOM 53 CA HIS A 53 270.885 240.655 228.408 1.00 0.00 C +ATOM 54 CA PRO A 54 269.039 238.874 225.591 1.00 0.00 C +ATOM 55 CA THR A 55 266.021 238.925 223.267 1.00 0.00 C +ATOM 56 CA LEU A 56 264.174 242.245 223.549 1.00 0.00 C +ATOM 57 CA CYS A 57 263.589 244.750 220.738 1.00 0.00 C +ATOM 58 CA ARG A 58 261.213 246.817 218.594 1.00 0.00 C +ATOM 59 CA GLU A 59 259.390 248.671 215.809 1.00 0.00 C +ATOM 60 CA SER A 60 260.629 252.274 215.858 1.00 0.00 C +ATOM 61 CA ARG A 61 258.748 254.512 218.302 1.00 0.00 C +ATOM 62 CA ARG A 62 254.958 254.127 218.306 1.00 0.00 C +TER 63 ARG A 62 +END diff --git a/Plants/Q943H5/Q943H5.dcd b/Plants/Q943H5/Q943H5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..a1dcc4804549be7b54d7ee6e267bc43325c036b7 --- /dev/null +++ b/Plants/Q943H5/Q943H5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:29c2e7c5290264a9cf203c524a863672062e8e0eeb9042f84788ba44ceec3167 +size 8480276 diff --git a/Plants/Q943H5/top.pdb b/Plants/Q943H5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..2451676dfc36284a661b7e890bf9bc1b1c9db9a7 --- /dev/null +++ b/Plants/Q943H5/top.pdb @@ -0,0 +1,68 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 225.007 248.985 264.650 1.00 0.00 C +ATOM 2 CA THR A 2 221.269 249.058 263.917 1.00 0.00 C +ATOM 3 CA GLY A 3 219.415 251.727 261.928 1.00 0.00 C +ATOM 4 CA GLY A 4 220.974 254.412 259.721 1.00 0.00 C +ATOM 5 CA PRO A 5 222.439 255.031 256.259 1.00 0.00 C +ATOM 6 CA GLY A 6 219.713 256.445 254.004 1.00 0.00 C +ATOM 7 CA GLY A 7 217.047 254.012 252.785 1.00 0.00 C +ATOM 8 CA GLY A 8 214.803 254.509 249.746 1.00 0.00 C +ATOM 9 CA ALA A 9 215.386 252.808 246.387 1.00 0.00 C +ATOM 10 CA ARG A 10 215.934 253.422 242.667 1.00 0.00 C +ATOM 11 CA ALA A 11 214.507 256.135 240.404 1.00 0.00 C +ATOM 12 CA GLN A 12 212.957 259.428 239.278 1.00 0.00 C +ATOM 13 CA ALA A 13 214.755 262.631 240.291 1.00 0.00 C +ATOM 14 CA GLY A 14 216.988 265.006 238.318 1.00 0.00 C +ATOM 15 CA ARG A 15 219.139 267.747 239.859 1.00 0.00 C +ATOM 16 CA LEU A 16 222.454 268.453 238.119 1.00 0.00 C +ATOM 17 CA ASP A 17 225.288 266.205 239.314 1.00 0.00 C +ATOM 18 CA PRO A 18 226.328 262.706 240.407 1.00 0.00 C +ATOM 19 CA PRO A 19 226.313 262.275 244.192 1.00 0.00 C +ATOM 20 CA PRO A 20 227.869 265.432 245.652 1.00 0.00 C +ATOM 21 CA SER A 21 227.358 269.058 244.597 1.00 0.00 C +ATOM 22 CA TYR A 22 227.054 272.836 244.214 1.00 0.00 C +ATOM 23 CA HIS A 23 226.655 276.520 245.099 1.00 0.00 C +ATOM 24 CA ASP A 24 227.463 277.019 248.789 1.00 0.00 C +ATOM 25 CA ASP A 25 229.131 274.009 250.423 1.00 0.00 C +ATOM 26 CA ASP A 26 231.713 271.439 251.539 1.00 0.00 C +ATOM 27 CA SER A 27 233.028 268.730 249.205 1.00 0.00 C +ATOM 28 CA ASP A 28 234.709 265.838 251.028 1.00 0.00 C +ATOM 29 CA HIS A 29 238.487 265.429 251.305 1.00 0.00 C +ATOM 30 CA HIS A 30 239.833 263.720 248.177 1.00 0.00 C +ATOM 31 CA HIS A 31 241.117 264.326 244.641 1.00 0.00 C +ATOM 32 CA HIS A 32 243.435 265.768 241.983 1.00 0.00 C +ATOM 33 CA HIS A 33 246.802 264.152 241.227 1.00 0.00 C +ATOM 34 CA ASP A 34 250.346 262.760 241.341 1.00 0.00 C +ATOM 35 CA ASP A 35 252.691 261.879 244.212 1.00 0.00 C +ATOM 36 CA ASP A 36 255.415 259.216 244.278 1.00 0.00 C +ATOM 37 CA ASP A 37 256.401 255.667 245.253 1.00 0.00 C +ATOM 38 CA ASP A 38 256.704 251.969 246.118 1.00 0.00 C +ATOM 39 CA HIS A 39 259.790 249.880 246.910 1.00 0.00 C +ATOM 40 CA SER A 40 263.175 248.462 247.934 1.00 0.00 C +ATOM 41 CA ASP A 41 264.954 245.178 247.179 1.00 0.00 C +ATOM 42 CA ARG A 42 266.130 241.557 247.314 1.00 0.00 C +ATOM 43 CA SER A 43 264.963 238.022 246.500 1.00 0.00 C +ATOM 44 CA SER A 44 265.900 235.130 248.796 1.00 0.00 C +ATOM 45 CA ARG A 45 263.732 233.614 251.538 1.00 0.00 C +ATOM 46 CA ARG A 46 265.084 232.889 255.025 1.00 0.00 C +ATOM 47 CA GLU A 47 268.113 231.817 257.073 1.00 0.00 C +ATOM 48 CA GLU A 48 270.723 229.108 256.469 1.00 0.00 C +ATOM 49 CA ALA A 49 270.767 226.444 259.193 1.00 0.00 C +ATOM 50 CA ALA A 50 273.017 226.711 262.256 1.00 0.00 C +ATOM 51 CA VAL A 51 276.700 225.925 261.680 1.00 0.00 C +ATOM 52 CA THR A 52 279.798 224.563 263.431 1.00 0.00 C +ATOM 53 CA ALA A 53 282.833 223.537 265.493 1.00 0.00 C +ATOM 54 CA VAL A 54 286.225 225.256 265.254 1.00 0.00 C +ATOM 55 CA ALA A 55 288.477 226.830 262.614 1.00 0.00 C +ATOM 56 CA MET A 56 288.922 228.411 259.176 1.00 0.00 C +ATOM 57 CA ALA A 57 291.377 231.213 258.378 1.00 0.00 C +ATOM 58 CA SER A 58 291.958 232.653 254.899 1.00 0.00 C +ATOM 59 CA GLY A 59 295.062 232.737 252.691 1.00 0.00 C +ATOM 60 CA ARG A 60 295.655 232.155 248.973 1.00 0.00 C +ATOM 61 CA ARG A 61 297.895 230.990 246.119 1.00 0.00 C +ATOM 62 CA ARG A 62 300.724 228.535 246.815 1.00 0.00 C +ATOM 63 CA PHE A 63 304.090 230.218 247.411 1.00 0.00 C +ATOM 64 CA ARG A 64 307.009 231.402 249.554 1.00 0.00 C +TER 65 ARG A 64 +END diff --git a/Plants/Q949K4/Q949K4.dcd b/Plants/Q949K4/Q949K4.dcd new file mode 100644 index 0000000000000000000000000000000000000000..0d8e01f57f85d5bda2b575aa463b307000ad8e6c --- /dev/null +++ b/Plants/Q949K4/Q949K4.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:eadbca8ea2deb838cfd1b541d034e1d209d2aa1b4b80e0e431876a5b5138d569 +size 17000276 diff --git a/Plants/Q949K4/top.pdb b/Plants/Q949K4/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..53aeb49e75753a4e17ce80d2831c4d624878f885 --- /dev/null +++ b/Plants/Q949K4/top.pdb @@ -0,0 +1,139 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 227.627 276.454 206.571 1.00 0.00 C +ATOM 2 CA SER A 2 225.849 277.560 203.388 1.00 0.00 C +ATOM 3 CA LYS A 3 224.627 281.158 203.668 1.00 0.00 C +ATOM 4 CA ARG A 4 221.594 282.584 205.479 1.00 0.00 C +ATOM 5 CA GLY A 5 222.397 286.193 206.400 1.00 0.00 C +ATOM 6 CA ASN A 6 222.139 289.994 206.330 1.00 0.00 C +ATOM 7 CA GLU A 7 225.156 291.590 204.636 1.00 0.00 C +ATOM 8 CA THR A 8 228.343 293.640 205.023 1.00 0.00 C +ATOM 9 CA PRO A 9 229.620 292.896 208.535 1.00 0.00 C +ATOM 10 CA ARG A 10 230.010 292.867 212.325 1.00 0.00 C +ATOM 11 CA LYS A 11 230.030 291.612 215.922 1.00 0.00 C +ATOM 12 CA SER A 12 233.058 291.612 218.235 1.00 0.00 C +ATOM 13 CA ARG A 13 236.342 289.858 219.043 1.00 0.00 C +ATOM 14 CA ARG A 14 238.339 288.661 216.028 1.00 0.00 C +ATOM 15 CA LEU A 15 240.453 286.909 213.386 1.00 0.00 C +ATOM 16 CA ASN A 16 243.763 285.125 212.773 1.00 0.00 C +ATOM 17 CA ASP A 17 246.503 287.162 214.464 1.00 0.00 C +ATOM 18 CA GLU A 18 249.682 286.840 216.539 1.00 0.00 C +ATOM 19 CA ALA A 19 251.805 287.301 219.669 1.00 0.00 C +ATOM 20 CA SER A 20 253.755 289.868 221.700 1.00 0.00 C +ATOM 21 CA SER A 21 253.587 293.061 223.772 1.00 0.00 C +ATOM 22 CA ASP A 22 255.974 294.700 226.249 1.00 0.00 C +ATOM 23 CA ASP A 23 259.744 295.025 225.802 1.00 0.00 C +ATOM 24 CA PHE A 24 263.379 293.908 226.035 1.00 0.00 C +ATOM 25 CA HIS A 25 263.588 290.751 223.913 1.00 0.00 C +ATOM 26 CA ALA A 26 263.674 287.307 225.540 1.00 0.00 C +ATOM 27 CA PRO A 27 264.307 283.551 225.466 1.00 0.00 C +ATOM 28 CA SER A 28 261.784 281.647 223.338 1.00 0.00 C +ATOM 29 CA PHE A 29 259.291 280.463 220.712 1.00 0.00 C +ATOM 30 CA LYS A 30 258.010 277.248 219.119 1.00 0.00 C +ATOM 31 CA ILE A 31 254.622 275.594 219.672 1.00 0.00 C +ATOM 32 CA LEU A 32 254.032 274.602 223.303 1.00 0.00 C +ATOM 33 CA SER A 33 251.848 273.214 226.100 1.00 0.00 C +ATOM 34 CA GLN A 34 248.051 273.011 226.334 1.00 0.00 C +ATOM 35 CA THR A 35 246.685 270.261 224.079 1.00 0.00 C +ATOM 36 CA GLN A 36 247.894 267.105 222.320 1.00 0.00 C +ATOM 37 CA THR A 37 248.117 264.451 225.043 1.00 0.00 C +ATOM 38 CA GLN A 38 249.828 262.424 227.779 1.00 0.00 C +ATOM 39 CA PRO A 39 250.120 263.707 231.354 1.00 0.00 C +ATOM 40 CA SER A 40 251.689 267.150 231.802 1.00 0.00 C +ATOM 41 CA TYR A 41 254.060 267.606 228.855 1.00 0.00 C +ATOM 42 CA VAL A 42 256.253 270.549 229.879 1.00 0.00 C +ATOM 43 CA LYS A 43 259.058 273.021 229.146 1.00 0.00 C +ATOM 44 CA VAL A 44 257.676 276.471 228.307 1.00 0.00 C +ATOM 45 CA LYS A 45 255.496 277.395 231.292 1.00 0.00 C +ATOM 46 CA SER A 46 251.810 278.355 231.375 1.00 0.00 C +ATOM 47 CA ARG A 47 248.521 278.349 233.297 1.00 0.00 C +ATOM 48 CA SER A 48 247.875 275.427 235.655 1.00 0.00 C +ATOM 49 CA GLY A 49 247.835 271.691 234.913 1.00 0.00 C +ATOM 50 CA LYS A 50 248.516 269.921 238.217 1.00 0.00 C +ATOM 51 CA SER A 51 249.572 266.577 239.706 1.00 0.00 C +ATOM 52 CA ASN A 52 251.766 265.760 242.712 1.00 0.00 C +ATOM 53 CA TRP A 53 253.055 266.585 246.201 1.00 0.00 C +ATOM 54 CA LYS A 54 251.978 268.529 249.295 1.00 0.00 C +ATOM 55 CA LYS A 55 249.921 271.413 250.699 1.00 0.00 C +ATOM 56 CA GLN A 56 248.182 270.494 253.963 1.00 0.00 C +ATOM 57 CA THR A 57 244.440 270.521 253.247 1.00 0.00 C +ATOM 58 CA ASN A 58 241.933 272.863 251.589 1.00 0.00 C +ATOM 59 CA LYS A 59 240.598 274.283 248.316 1.00 0.00 C +ATOM 60 CA HIS A 60 240.257 274.267 244.521 1.00 0.00 C +ATOM 61 CA PRO A 61 243.200 272.585 242.782 1.00 0.00 C +ATOM 62 CA LYS A 62 242.295 270.340 239.839 1.00 0.00 C +ATOM 63 CA GLU A 63 241.760 266.684 238.909 1.00 0.00 C +ATOM 64 CA ASN A 64 240.345 265.820 235.479 1.00 0.00 C +ATOM 65 CA GLU A 65 242.936 264.643 232.947 1.00 0.00 C +ATOM 66 CA LYS A 66 243.769 261.155 231.658 1.00 0.00 C +ATOM 67 CA LYS A 67 244.423 259.099 234.798 1.00 0.00 C +ATOM 68 CA ARG A 68 246.191 257.591 237.818 1.00 0.00 C +ATOM 69 CA LYS A 69 247.147 253.951 237.224 1.00 0.00 C +ATOM 70 CA GLY A 70 246.566 250.256 237.950 1.00 0.00 C +ATOM 71 CA LYS A 71 245.683 249.700 241.614 1.00 0.00 C +ATOM 72 CA GLU A 72 245.961 245.960 242.287 1.00 0.00 C +ATOM 73 CA LYS A 73 248.396 244.730 244.946 1.00 0.00 C +ATOM 74 CA LYS A 74 247.804 243.770 248.585 1.00 0.00 C +ATOM 75 CA LYS A 75 251.203 243.511 250.286 1.00 0.00 C +ATOM 76 CA VAL A 76 253.548 244.922 252.937 1.00 0.00 C +ATOM 77 CA ASP A 77 253.025 247.795 255.385 1.00 0.00 C +ATOM 78 CA GLU A 78 250.741 247.583 258.427 1.00 0.00 C +ATOM 79 CA PHE A 79 247.624 245.650 259.459 1.00 0.00 C +ATOM 80 CA GLU A 80 246.804 245.355 263.167 1.00 0.00 C +ATOM 81 CA LYS A 81 247.237 248.269 265.584 1.00 0.00 C +ATOM 82 CA ARG A 82 250.907 249.290 265.538 1.00 0.00 C +ATOM 83 CA ALA A 83 253.039 247.101 267.813 1.00 0.00 C +ATOM 84 CA LYS A 84 255.713 244.427 267.352 1.00 0.00 C +ATOM 85 CA GLU A 85 258.248 241.953 265.948 1.00 0.00 C +ATOM 86 CA ARG A 86 261.502 239.973 265.867 1.00 0.00 C +ATOM 87 CA GLY A 87 263.392 239.159 262.660 1.00 0.00 C +ATOM 88 CA LYS A 88 265.181 235.938 261.689 1.00 0.00 C +ATOM 89 CA LYS A 89 264.888 232.488 263.277 1.00 0.00 C +ATOM 90 CA ARG A 90 265.371 229.840 265.974 1.00 0.00 C +ATOM 91 CA LYS A 91 263.216 226.700 265.862 1.00 0.00 C +ATOM 92 CA GLU A 92 260.454 226.693 263.238 1.00 0.00 C +ATOM 93 CA LYS A 93 258.951 224.922 260.218 1.00 0.00 C +ATOM 94 CA GLU A 94 256.802 224.506 257.099 1.00 0.00 C +ATOM 95 CA ILE A 95 253.348 223.298 258.163 1.00 0.00 C +ATOM 96 CA GLU A 96 252.215 220.047 259.794 1.00 0.00 C +ATOM 97 CA ASP A 97 254.209 219.671 263.019 1.00 0.00 C +ATOM 98 CA SER A 98 254.781 216.604 265.205 1.00 0.00 C +ATOM 99 CA SER A 99 252.944 215.940 268.476 1.00 0.00 C +ATOM 100 CA ASP A 100 250.222 213.998 270.304 1.00 0.00 C +ATOM 101 CA SER A 101 250.657 211.263 272.921 1.00 0.00 C +ATOM 102 CA GLU A 102 247.688 209.185 274.098 1.00 0.00 C +ATOM 103 CA SER A 103 248.043 205.392 274.138 1.00 0.00 C +ATOM 104 CA ASP A 104 247.494 202.046 272.402 1.00 0.00 C +ATOM 105 CA PHE A 105 247.885 198.540 273.841 1.00 0.00 C +ATOM 106 CA VAL A 106 248.029 196.812 277.234 1.00 0.00 C +ATOM 107 CA GLU A 107 246.095 198.697 279.922 1.00 0.00 C +ATOM 108 CA GLU A 108 248.133 200.854 282.312 1.00 0.00 C +ATOM 109 CA LEU A 109 249.472 204.300 281.391 1.00 0.00 C +ATOM 110 CA ILE A 110 251.651 206.951 279.736 1.00 0.00 C +ATOM 111 CA LYS A 111 251.100 210.562 280.819 1.00 0.00 C +ATOM 112 CA SER A 112 250.178 211.175 284.465 1.00 0.00 C +ATOM 113 CA LYS A 113 253.233 210.433 286.618 1.00 0.00 C +ATOM 114 CA SER A 114 254.687 211.153 290.065 1.00 0.00 C +ATOM 115 CA LYS A 115 254.071 210.228 293.709 1.00 0.00 C +ATOM 116 CA LYS A 116 254.992 211.314 297.243 1.00 0.00 C +ATOM 117 CA PRO A 117 253.941 209.943 300.639 1.00 0.00 C +ATOM 118 CA ARG A 118 254.065 206.151 300.987 1.00 0.00 C +ATOM 119 CA ALA A 119 251.995 203.771 298.849 1.00 0.00 C +ATOM 120 CA SER A 120 251.839 199.968 298.687 1.00 0.00 C +ATOM 121 CA GLU A 121 255.003 198.889 296.859 1.00 0.00 C +ATOM 122 CA ILE A 122 258.285 198.936 294.926 1.00 0.00 C +ATOM 123 CA ASP A 123 260.718 201.094 296.911 1.00 0.00 C +ATOM 124 CA THR A 124 261.825 204.264 298.712 1.00 0.00 C +ATOM 125 CA SER A 125 263.734 206.946 296.795 1.00 0.00 C +ATOM 126 CA HIS A 126 264.799 207.503 293.180 1.00 0.00 C +ATOM 127 CA LEU A 127 262.500 209.835 291.232 1.00 0.00 C +ATOM 128 CA GLN A 128 263.154 210.892 287.631 1.00 0.00 C +ATOM 129 CA ASP A 129 262.237 214.486 286.761 1.00 0.00 C +ATOM 130 CA ARG A 130 258.577 215.465 286.361 1.00 0.00 C +ATOM 131 CA TYR A 131 255.468 217.089 287.850 1.00 0.00 C +ATOM 132 CA MET A 132 252.409 216.675 285.618 1.00 0.00 C +ATOM 133 CA LYS A 133 253.036 218.979 282.650 1.00 0.00 C +ATOM 134 CA HIS A 134 252.710 222.766 282.386 1.00 0.00 C +ATOM 135 CA VAL A 135 252.138 226.381 283.446 1.00 0.00 C +TER 136 VAL A 135 +END diff --git a/Plants/Q94AY9/Q94AY9.dcd b/Plants/Q94AY9/Q94AY9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..fa4e97c5c49472085e1e1b98d8e8d39dc6bf9852 --- /dev/null +++ b/Plants/Q94AY9/Q94AY9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:fb43f65975469cead36d53a0e2fc8ce4c6e192a621bde0a2dee491ab57e7503c +size 20240276 diff --git a/Plants/Q94AY9/top.pdb b/Plants/Q94AY9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..4937ef11a7bd55fa919e8d94804d2f49b535f45c --- /dev/null +++ b/Plants/Q94AY9/top.pdb @@ -0,0 +1,166 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 294.486 302.721 246.016 1.00 0.00 C +ATOM 2 CA ALA A 2 292.891 301.230 242.894 1.00 0.00 C +ATOM 3 CA GLU A 3 293.259 303.752 240.061 1.00 0.00 C +ATOM 4 CA GLU A 4 293.850 307.511 239.869 1.00 0.00 C +ATOM 5 CA LYS A 5 294.345 311.260 240.330 1.00 0.00 C +ATOM 6 CA LYS A 6 296.820 312.491 242.952 1.00 0.00 C +ATOM 7 CA ASN A 7 296.462 315.906 244.603 1.00 0.00 C +ATOM 8 CA LYS A 8 294.669 316.367 247.933 1.00 0.00 C +ATOM 9 CA LYS A 9 291.576 314.298 248.751 1.00 0.00 C +ATOM 10 CA LYS A 10 290.415 311.581 251.157 1.00 0.00 C +ATOM 11 CA LYS A 11 291.670 307.984 251.198 1.00 0.00 C +ATOM 12 CA SER A 12 289.191 305.481 249.748 1.00 0.00 C +ATOM 13 CA ASP A 13 285.413 305.413 250.237 1.00 0.00 C +ATOM 14 CA ALA A 14 284.681 308.561 252.253 1.00 0.00 C +ATOM 15 CA LYS A 15 281.636 309.510 254.338 1.00 0.00 C +ATOM 16 CA VAL A 16 280.704 308.578 257.913 1.00 0.00 C +ATOM 17 CA ASP A 17 278.560 310.715 260.227 1.00 0.00 C +ATOM 18 CA SER A 18 276.022 312.305 262.582 1.00 0.00 C +ATOM 19 CA GLU A 19 272.464 312.453 263.936 1.00 0.00 C +ATOM 20 CA GLU A 20 269.114 311.643 265.562 1.00 0.00 C +ATOM 21 CA THR A 21 266.045 311.960 267.797 1.00 0.00 C +ATOM 22 CA GLY A 22 265.333 308.693 269.622 1.00 0.00 C +ATOM 23 CA GLU A 23 264.699 304.974 269.092 1.00 0.00 C +ATOM 24 CA GLU A 24 265.263 302.720 266.072 1.00 0.00 C +ATOM 25 CA PHE A 25 262.694 301.912 263.378 1.00 0.00 C +ATOM 26 CA ILE A 26 261.586 305.185 261.771 1.00 0.00 C +ATOM 27 CA SER A 27 258.427 307.302 262.009 1.00 0.00 C +ATOM 28 CA GLU A 28 255.282 305.186 262.390 1.00 0.00 C +ATOM 29 CA HIS A 29 254.565 304.879 266.119 1.00 0.00 C +ATOM 30 CA SER A 30 252.556 301.802 267.126 1.00 0.00 C +ATOM 31 CA SER A 31 251.780 299.221 264.433 1.00 0.00 C +ATOM 32 CA MET A 32 249.876 296.356 262.796 1.00 0.00 C +ATOM 33 CA LYS A 33 246.206 295.484 263.331 1.00 0.00 C +ATOM 34 CA ASP A 34 244.290 295.924 260.068 1.00 0.00 C +ATOM 35 CA LYS A 35 241.726 297.143 257.527 1.00 0.00 C +ATOM 36 CA GLU A 36 238.088 298.188 257.091 1.00 0.00 C +ATOM 37 CA LYS A 37 234.888 297.175 255.287 1.00 0.00 C +ATOM 38 CA LYS A 38 231.738 299.262 255.768 1.00 0.00 C +ATOM 39 CA ARG A 39 229.831 298.283 258.917 1.00 0.00 C +ATOM 40 CA LYS A 40 229.172 294.642 259.827 1.00 0.00 C +ATOM 41 CA LYS A 41 227.689 291.661 261.679 1.00 0.00 C +ATOM 42 CA ASN A 42 224.310 290.295 262.790 1.00 0.00 C +ATOM 43 CA LYS A 43 221.819 292.752 264.296 1.00 0.00 C +ATOM 44 CA ARG A 44 218.071 293.261 263.835 1.00 0.00 C +ATOM 45 CA GLU A 45 215.398 294.502 266.249 1.00 0.00 C +ATOM 46 CA ASN A 46 215.191 293.451 269.905 1.00 0.00 C +ATOM 47 CA LYS A 47 217.042 292.447 273.080 1.00 0.00 C +ATOM 48 CA ASP A 48 217.955 288.964 274.324 1.00 0.00 C +ATOM 49 CA GLY A 49 221.411 288.240 275.756 1.00 0.00 C +ATOM 50 CA PHE A 50 224.964 288.757 274.480 1.00 0.00 C +ATOM 51 CA THR A 51 225.150 292.407 273.406 1.00 0.00 C +ATOM 52 CA GLY A 52 228.860 293.245 273.641 1.00 0.00 C +ATOM 53 CA GLU A 53 230.090 296.579 275.012 1.00 0.00 C +ATOM 54 CA ASP A 54 233.703 296.679 276.217 1.00 0.00 C +ATOM 55 CA MET A 55 236.721 294.506 277.047 1.00 0.00 C +ATOM 56 CA GLU A 56 238.085 292.785 273.933 1.00 0.00 C +ATOM 57 CA ILE A 57 236.686 289.515 272.567 1.00 0.00 C +ATOM 58 CA THR A 58 236.929 289.283 268.772 1.00 0.00 C +ATOM 59 CA GLY A 59 234.465 286.770 267.312 1.00 0.00 C +ATOM 60 CA ARG A 60 234.526 283.218 268.691 1.00 0.00 C +ATOM 61 CA GLU A 61 232.866 283.256 272.120 1.00 0.00 C +ATOM 62 CA SER A 62 232.902 279.823 273.773 1.00 0.00 C +ATOM 63 CA GLU A 63 234.904 276.854 272.471 1.00 0.00 C +ATOM 64 CA LYS A 64 238.188 275.018 273.066 1.00 0.00 C +ATOM 65 CA LEU A 65 238.120 271.392 274.233 1.00 0.00 C +ATOM 66 CA GLY A 66 235.825 268.403 273.668 1.00 0.00 C +ATOM 67 CA ASP A 67 234.270 265.053 272.733 1.00 0.00 C +ATOM 68 CA GLU A 68 232.006 262.094 273.529 1.00 0.00 C +ATOM 69 CA VAL A 69 228.412 261.436 274.610 1.00 0.00 C +ATOM 70 CA PHE A 70 227.605 260.437 278.197 1.00 0.00 C +ATOM 71 CA ILE A 71 226.102 257.634 280.293 1.00 0.00 C +ATOM 72 CA VAL A 72 228.770 255.822 282.322 1.00 0.00 C +ATOM 73 CA LYS A 73 231.344 254.431 279.881 1.00 0.00 C +ATOM 74 CA LYS A 74 234.785 252.848 280.289 1.00 0.00 C +ATOM 75 CA LYS A 75 235.907 253.670 283.836 1.00 0.00 C +ATOM 76 CA LYS A 76 238.293 252.197 286.416 1.00 0.00 C +ATOM 77 CA LYS A 77 241.590 250.343 285.960 1.00 0.00 C +ATOM 78 CA SER A 78 244.358 248.199 287.462 1.00 0.00 C +ATOM 79 CA LYS A 79 244.913 244.430 287.480 1.00 0.00 C +ATOM 80 CA LYS A 80 242.369 241.697 286.718 1.00 0.00 C +ATOM 81 CA PRO A 81 240.754 238.364 285.826 1.00 0.00 C +ATOM 82 CA ILE A 82 240.791 235.181 283.733 1.00 0.00 C +ATOM 83 CA ARG A 83 243.976 234.152 281.912 1.00 0.00 C +ATOM 84 CA ILE A 84 244.604 230.509 280.990 1.00 0.00 C +ATOM 85 CA ASP A 85 244.479 227.924 278.193 1.00 0.00 C +ATOM 86 CA SER A 86 244.342 225.660 275.132 1.00 0.00 C +ATOM 87 CA GLU A 87 247.344 224.270 273.243 1.00 0.00 C +ATOM 88 CA ALA A 88 250.206 226.446 271.981 1.00 0.00 C +ATOM 89 CA VAL A 89 248.609 229.368 270.130 1.00 0.00 C +ATOM 90 CA ASP A 90 245.536 231.384 269.127 1.00 0.00 C +ATOM 91 CA ALA A 91 245.639 231.498 265.321 1.00 0.00 C +ATOM 92 CA VAL A 92 244.891 230.428 261.741 1.00 0.00 C +ATOM 93 CA LYS A 93 244.246 226.673 261.811 1.00 0.00 C +ATOM 94 CA LYS A 94 243.520 224.749 265.018 1.00 0.00 C +ATOM 95 CA LYS A 95 241.586 223.675 268.120 1.00 0.00 C +ATOM 96 CA SER A 96 238.030 224.656 269.073 1.00 0.00 C +ATOM 97 CA LYS A 97 235.624 222.941 271.478 1.00 0.00 C +ATOM 98 CA LYS A 98 234.075 219.496 271.981 1.00 0.00 C +ATOM 99 CA ARG A 99 232.799 215.959 271.370 1.00 0.00 C +ATOM 100 CA SER A 100 232.859 212.493 272.950 1.00 0.00 C +ATOM 101 CA LYS A 101 234.629 210.147 270.525 1.00 0.00 C +ATOM 102 CA GLU A 102 233.324 209.389 267.026 1.00 0.00 C +ATOM 103 CA THR A 103 232.873 211.559 263.928 1.00 0.00 C +ATOM 104 CA LYS A 104 231.208 212.873 260.762 1.00 0.00 C +ATOM 105 CA ALA A 105 230.521 212.216 257.073 1.00 0.00 C +ATOM 106 CA ASP A 106 230.552 210.349 253.751 1.00 0.00 C +ATOM 107 CA SER A 107 234.209 209.525 253.070 1.00 0.00 C +ATOM 108 CA GLU A 108 236.228 207.493 250.558 1.00 0.00 C +ATOM 109 CA ALA A 109 235.438 207.883 246.851 1.00 0.00 C +ATOM 110 CA GLU A 110 236.790 209.360 243.610 1.00 0.00 C +ATOM 111 CA ASP A 111 239.524 211.902 244.372 1.00 0.00 C +ATOM 112 CA ASP A 112 242.712 213.920 244.902 1.00 0.00 C +ATOM 113 CA GLY A 113 246.512 213.760 244.671 1.00 0.00 C +ATOM 114 CA VAL A 114 247.420 212.193 241.319 1.00 0.00 C +ATOM 115 CA GLU A 115 245.000 209.689 239.774 1.00 0.00 C +ATOM 116 CA LYS A 116 243.912 206.156 240.696 1.00 0.00 C +ATOM 117 CA LYS A 117 243.165 202.610 239.521 1.00 0.00 C +ATOM 118 CA SER A 118 242.939 202.131 235.748 1.00 0.00 C +ATOM 119 CA LYS A 119 240.503 201.426 232.904 1.00 0.00 C +ATOM 120 CA GLU A 120 240.532 199.638 229.540 1.00 0.00 C +ATOM 121 CA LYS A 121 243.757 198.989 227.617 1.00 0.00 C +ATOM 122 CA SER A 122 245.333 200.366 224.433 1.00 0.00 C +ATOM 123 CA LYS A 123 242.815 202.482 222.510 1.00 0.00 C +ATOM 124 CA GLU A 124 244.333 202.937 219.045 1.00 0.00 C +ATOM 125 CA THR A 125 246.254 200.900 216.461 1.00 0.00 C +ATOM 126 CA LYS A 126 247.672 202.489 213.302 1.00 0.00 C +ATOM 127 CA VAL A 127 247.669 203.163 209.552 1.00 0.00 C +ATOM 128 CA ASP A 128 246.211 206.489 208.399 1.00 0.00 C +ATOM 129 CA SER A 129 244.014 209.595 208.189 1.00 0.00 C +ATOM 130 CA GLU A 130 241.938 210.137 211.337 1.00 0.00 C +ATOM 131 CA ALA A 131 242.916 211.341 214.817 1.00 0.00 C +ATOM 132 CA HIS A 132 246.627 211.989 215.387 1.00 0.00 C +ATOM 133 CA ASP A 133 250.175 212.008 213.999 1.00 0.00 C +ATOM 134 CA GLY A 134 253.059 209.546 214.369 1.00 0.00 C +ATOM 135 CA VAL A 135 252.334 207.450 217.467 1.00 0.00 C +ATOM 136 CA LYS A 136 250.945 208.996 220.660 1.00 0.00 C +ATOM 137 CA ARG A 137 252.277 212.189 222.257 1.00 0.00 C +ATOM 138 CA LYS A 138 255.673 213.363 223.524 1.00 0.00 C +ATOM 139 CA LYS A 139 257.660 210.412 224.887 1.00 0.00 C +ATOM 140 CA LYS A 140 259.540 207.143 224.341 1.00 0.00 C +ATOM 141 CA LYS A 141 260.242 204.462 221.727 1.00 0.00 C +ATOM 142 CA SER A 142 262.259 205.973 218.870 1.00 0.00 C +ATOM 143 CA LYS A 143 265.982 205.183 218.704 1.00 0.00 C +ATOM 144 CA LYS A 144 267.555 201.851 219.673 1.00 0.00 C +ATOM 145 CA GLU A 145 266.017 198.382 219.319 1.00 0.00 C +ATOM 146 CA SER A 146 265.390 197.723 215.620 1.00 0.00 C +ATOM 147 CA GLY A 147 268.320 197.483 213.195 1.00 0.00 C +ATOM 148 CA GLY A 148 268.455 194.809 210.484 1.00 0.00 C +ATOM 149 CA ASP A 149 270.475 195.697 207.378 1.00 0.00 C +ATOM 150 CA VAL A 150 270.254 199.412 206.562 1.00 0.00 C +ATOM 151 CA ILE A 151 269.555 199.682 202.827 1.00 0.00 C +ATOM 152 CA GLU A 152 270.598 197.174 200.155 1.00 0.00 C +ATOM 153 CA ASN A 153 273.122 196.955 197.310 1.00 0.00 C +ATOM 154 CA THR A 154 276.259 195.353 195.857 1.00 0.00 C +ATOM 155 CA GLU A 155 276.135 193.718 192.418 1.00 0.00 C +ATOM 156 CA SER A 156 275.584 196.361 189.730 1.00 0.00 C +ATOM 157 CA SER A 157 272.359 197.474 188.033 1.00 0.00 C +ATOM 158 CA LYS A 158 269.641 200.141 188.163 1.00 0.00 C +ATOM 159 CA VAL A 159 266.830 199.144 190.533 1.00 0.00 C +ATOM 160 CA SER A 160 267.333 201.324 193.617 1.00 0.00 C +ATOM 161 CA ASP A 161 268.792 203.092 196.660 1.00 0.00 C +ATOM 162 CA ARG A 162 270.879 206.174 195.849 1.00 0.00 C +TER 163 ARG A 162 +END diff --git a/Plants/Q94CR6/Q94CR6.dcd b/Plants/Q94CR6/Q94CR6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..19263b09eab8be29b467c68511a8d83e99f1cbb8 --- /dev/null +++ b/Plants/Q94CR6/Q94CR6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:a59cc3198de8b49370f179a44f84203af831e36f11b76b093b3550f338d05766 +size 8120276 diff --git a/Plants/Q94CR6/top.pdb b/Plants/Q94CR6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..fcfeaf07bd728a709c4fa4d83b3f602cf97d68a3 --- /dev/null +++ b/Plants/Q94CR6/top.pdb @@ -0,0 +1,65 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 225.504 253.453 224.655 1.00 0.00 C +ATOM 2 CA SER A 2 223.017 253.252 227.534 1.00 0.00 C +ATOM 3 CA ALA A 3 223.992 251.545 230.797 1.00 0.00 C +ATOM 4 CA ALA A 4 221.415 251.351 233.596 1.00 0.00 C +ATOM 5 CA LYS A 5 220.331 249.343 236.648 1.00 0.00 C +ATOM 6 CA ARG A 6 223.179 249.259 239.177 1.00 0.00 C +ATOM 7 CA LEU A 7 226.301 251.373 238.627 1.00 0.00 C +ATOM 8 CA PRO A 8 229.659 252.382 237.136 1.00 0.00 C +ATOM 9 CA ALA A 9 233.176 251.447 236.006 1.00 0.00 C +ATOM 10 CA ALA A 10 234.283 248.076 237.395 1.00 0.00 C +ATOM 11 CA ALA A 11 235.439 245.300 239.734 1.00 0.00 C +ATOM 12 CA GLY A 12 232.639 244.827 242.274 1.00 0.00 C +ATOM 13 CA ILE A 13 229.928 247.495 242.061 1.00 0.00 C +ATOM 14 CA GLY A 14 227.657 248.342 245.000 1.00 0.00 C +ATOM 15 CA GLN A 15 227.258 252.033 245.855 1.00 0.00 C +ATOM 16 CA SER A 16 225.579 254.942 247.654 1.00 0.00 C +ATOM 17 CA GLY A 17 226.069 258.026 245.471 1.00 0.00 C +ATOM 18 CA ARG A 18 229.205 259.997 246.363 1.00 0.00 C +ATOM 19 CA GLN A 19 232.163 261.539 248.205 1.00 0.00 C +ATOM 20 CA GLN A 20 235.684 262.556 247.163 1.00 0.00 C +ATOM 21 CA HIS A 21 238.807 260.444 246.613 1.00 0.00 C +ATOM 22 CA GLY A 22 239.493 258.891 250.024 1.00 0.00 C +ATOM 23 CA CYS A 23 240.475 256.632 252.930 1.00 0.00 C +ATOM 24 CA THR A 24 244.137 256.640 253.983 1.00 0.00 C +ATOM 25 CA ALA A 25 247.236 256.823 256.192 1.00 0.00 C +ATOM 26 CA ALA A 26 249.052 253.500 256.617 1.00 0.00 C +ATOM 27 CA GLY A 27 252.671 253.416 255.429 1.00 0.00 C +ATOM 28 CA GLY A 28 255.681 253.784 253.122 1.00 0.00 C +ATOM 29 CA ALA A 29 257.609 253.141 249.900 1.00 0.00 C +ATOM 30 CA ARG A 30 257.242 253.656 246.143 1.00 0.00 C +ATOM 31 CA ARG A 31 260.396 252.236 244.545 1.00 0.00 C +ATOM 32 CA ASP A 32 260.889 249.051 242.514 1.00 0.00 C +ATOM 33 CA GLY A 33 258.302 246.253 242.503 1.00 0.00 C +ATOM 34 CA ARG A 34 255.539 244.548 244.496 1.00 0.00 C +ATOM 35 CA THR A 35 254.367 240.937 244.174 1.00 0.00 C +ATOM 36 CA GLU A 36 255.178 238.889 247.283 1.00 0.00 C +ATOM 37 CA GLY A 37 258.528 239.068 249.088 1.00 0.00 C +ATOM 38 CA GLN A 38 259.220 242.794 249.479 1.00 0.00 C +ATOM 39 CA HIS A 39 260.604 245.283 252.011 1.00 0.00 C +ATOM 40 CA ALA A 40 261.614 245.119 255.681 1.00 0.00 C +ATOM 41 CA GLY A 41 260.534 247.306 258.608 1.00 0.00 C +ATOM 42 CA SER A 42 260.994 250.944 257.574 1.00 0.00 C +ATOM 43 CA SER A 43 260.265 253.054 260.661 1.00 0.00 C +ATOM 44 CA ALA A 44 258.895 250.847 263.448 1.00 0.00 C +ATOM 45 CA ARG A 45 258.028 247.282 264.474 1.00 0.00 C +ATOM 46 CA ALA A 46 259.926 244.045 263.816 1.00 0.00 C +ATOM 47 CA VAL A 47 263.603 243.485 264.644 1.00 0.00 C +ATOM 48 CA PRO A 48 266.894 242.626 266.360 1.00 0.00 C +ATOM 49 CA ARG A 49 268.967 245.813 266.125 1.00 0.00 C +ATOM 50 CA ARG A 50 272.740 245.283 266.109 1.00 0.00 C +ATOM 51 CA ARG A 51 276.437 245.462 265.204 1.00 0.00 C +ATOM 52 CA GLY A 52 277.306 247.813 262.335 1.00 0.00 C +ATOM 53 CA ASN A 53 275.542 250.700 260.583 1.00 0.00 C +ATOM 54 CA ALA A 54 272.731 253.047 261.636 1.00 0.00 C +ATOM 55 CA ASP A 55 269.044 252.313 261.013 1.00 0.00 C +ATOM 56 CA GLU A 56 267.647 248.769 260.947 1.00 0.00 C +ATOM 57 CA PRO A 57 269.187 246.873 258.023 1.00 0.00 C +ATOM 58 CA THR A 58 272.270 246.100 255.922 1.00 0.00 C +ATOM 59 CA ARG A 59 271.415 245.139 252.335 1.00 0.00 C +ATOM 60 CA LEU A 60 270.028 246.434 249.032 1.00 0.00 C +ATOM 61 CA GLY A 61 268.032 249.022 247.074 1.00 0.00 C +TER 62 GLY A 61 +END diff --git a/Plants/Q94DT0/Q94DT0.dcd b/Plants/Q94DT0/Q94DT0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..3be9495410f70732b92a02bc8cba3e9ad85aa4b0 --- /dev/null +++ b/Plants/Q94DT0/Q94DT0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:9cedec21877466d450ffcfc803075fd122f94f060553bfba4b3eb023228c3f5b +size 15560276 diff --git a/Plants/Q94DT0/top.pdb b/Plants/Q94DT0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..55bf0cb9d01db8fd771ecd66ff2f1cee5a7182c1 --- /dev/null +++ b/Plants/Q94DT0/top.pdb @@ -0,0 +1,127 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 244.538 207.356 241.250 1.00 0.00 C +ATOM 2 CA TRP A 2 242.837 210.192 239.357 1.00 0.00 C +ATOM 3 CA ARG A 3 239.800 211.131 241.457 1.00 0.00 C +ATOM 4 CA GLY A 4 237.102 213.746 240.826 1.00 0.00 C +ATOM 5 CA SER A 5 233.687 212.291 239.969 1.00 0.00 C +ATOM 6 CA GLY A 6 231.045 215.030 239.781 1.00 0.00 C +ATOM 7 CA GLN A 7 229.827 217.512 237.160 1.00 0.00 C +ATOM 8 CA LEU A 8 229.321 215.496 233.967 1.00 0.00 C +ATOM 9 CA ASP A 9 226.320 216.208 231.729 1.00 0.00 C +ATOM 10 CA PRO A 10 223.921 213.474 230.594 1.00 0.00 C +ATOM 11 CA LYS A 11 220.428 213.689 229.087 1.00 0.00 C +ATOM 12 CA ARG A 12 218.058 212.684 231.895 1.00 0.00 C +ATOM 13 CA GLY A 13 218.398 213.334 235.634 1.00 0.00 C +ATOM 14 CA ARG A 14 216.318 212.065 238.563 1.00 0.00 C +ATOM 15 CA PRO A 15 215.514 215.066 240.769 1.00 0.00 C +ATOM 16 CA PRO A 16 213.681 218.394 241.052 1.00 0.00 C +ATOM 17 CA PRO A 17 212.759 222.003 241.854 1.00 0.00 C +ATOM 18 CA SER A 18 213.032 222.313 245.642 1.00 0.00 C +ATOM 19 CA SER A 19 216.092 224.346 246.650 1.00 0.00 C +ATOM 20 CA LEU A 20 218.130 225.716 249.563 1.00 0.00 C +ATOM 21 CA GLU A 21 219.793 226.365 252.929 1.00 0.00 C +ATOM 22 CA VAL A 22 217.740 228.064 255.652 1.00 0.00 C +ATOM 23 CA ALA A 23 215.530 228.935 258.631 1.00 0.00 C +ATOM 24 CA ALA A 24 215.757 230.633 262.034 1.00 0.00 C +ATOM 25 CA ALA A 25 218.895 229.638 263.953 1.00 0.00 C +ATOM 26 CA THR A 26 222.691 229.523 264.249 1.00 0.00 C +ATOM 27 CA PRO A 27 224.779 232.412 265.595 1.00 0.00 C +ATOM 28 CA PRO A 28 227.160 233.668 268.291 1.00 0.00 C +ATOM 29 CA ARG A 29 230.334 235.743 267.924 1.00 0.00 C +ATOM 30 CA ALA A 30 231.793 239.254 267.678 1.00 0.00 C +ATOM 31 CA ARG A 31 230.933 241.751 264.933 1.00 0.00 C +ATOM 32 CA PRO A 32 228.081 240.988 262.525 1.00 0.00 C +ATOM 33 CA PRO A 33 228.190 237.536 260.916 1.00 0.00 C +ATOM 34 CA SER A 34 227.084 234.677 258.654 1.00 0.00 C +ATOM 35 CA GLY A 35 229.819 233.493 256.281 1.00 0.00 C +ATOM 36 CA GLU A 36 232.802 235.135 254.571 1.00 0.00 C +ATOM 37 CA ALA A 37 233.858 236.121 251.046 1.00 0.00 C +ATOM 38 CA THR A 38 236.612 238.742 250.790 1.00 0.00 C +ATOM 39 CA TRP A 39 237.034 240.116 247.261 1.00 0.00 C +ATOM 40 CA VAL A 40 235.465 242.697 244.939 1.00 0.00 C +ATOM 41 CA TRP A 41 233.234 245.292 243.264 1.00 0.00 C +ATOM 42 CA ARG A 42 229.666 245.078 244.582 1.00 0.00 C +ATOM 43 CA TRP A 43 228.286 242.346 246.851 1.00 0.00 C +ATOM 44 CA PRO A 44 230.503 241.790 249.899 1.00 0.00 C +ATOM 45 CA ASN A 45 230.905 243.212 253.411 1.00 0.00 C +ATOM 46 CA PRO A 46 233.924 244.810 255.098 1.00 0.00 C +ATOM 47 CA LYS A 47 235.266 246.182 258.389 1.00 0.00 C +ATOM 48 CA LEU A 48 234.656 249.608 259.941 1.00 0.00 C +ATOM 49 CA GLY A 49 232.833 252.235 262.012 1.00 0.00 C +ATOM 50 CA GLY A 50 231.290 255.657 261.359 1.00 0.00 C +ATOM 51 CA GLY A 51 232.450 257.381 258.165 1.00 0.00 C +ATOM 52 CA SER A 52 234.133 260.770 258.610 1.00 0.00 C +ATOM 53 CA ARG A 53 233.834 262.150 262.149 1.00 0.00 C +ATOM 54 CA ARG A 54 235.888 263.253 265.162 1.00 0.00 C +ATOM 55 CA ASN A 55 233.826 265.523 267.422 1.00 0.00 C +ATOM 56 CA THR A 56 230.765 266.974 265.679 1.00 0.00 C +ATOM 57 CA PRO A 57 230.108 270.009 263.472 1.00 0.00 C +ATOM 58 CA GLY A 58 232.784 270.839 260.890 1.00 0.00 C +ATOM 59 CA SER A 59 235.661 273.228 260.159 1.00 0.00 C +ATOM 60 CA THR A 60 238.868 273.942 262.089 1.00 0.00 C +ATOM 61 CA PRO A 61 241.785 276.076 260.883 1.00 0.00 C +ATOM 62 CA LEU A 62 243.260 278.922 262.942 1.00 0.00 C +ATOM 63 CA GLY A 63 242.399 278.662 266.645 1.00 0.00 C +ATOM 64 CA GLU A 64 242.716 276.823 269.967 1.00 0.00 C +ATOM 65 CA SER A 65 242.061 279.393 272.702 1.00 0.00 C +ATOM 66 CA HIS A 66 242.918 279.495 276.413 1.00 0.00 C +ATOM 67 CA LEU A 67 245.851 277.110 276.889 1.00 0.00 C +ATOM 68 CA GLY A 68 248.742 274.798 277.790 1.00 0.00 C +ATOM 69 CA GLY A 69 249.274 271.976 275.286 1.00 0.00 C +ATOM 70 CA GLY A 70 250.056 268.363 274.363 1.00 0.00 C +ATOM 71 CA SER A 71 253.763 267.535 274.064 1.00 0.00 C +ATOM 72 CA HIS A 72 256.322 267.270 271.253 1.00 0.00 C +ATOM 73 CA ARG A 73 259.389 269.095 269.921 1.00 0.00 C +ATOM 74 CA SER A 74 262.702 270.940 270.297 1.00 0.00 C +ATOM 75 CA THR A 75 262.622 273.866 272.735 1.00 0.00 C +ATOM 76 CA SER A 76 262.222 277.638 273.099 1.00 0.00 C +ATOM 77 CA GLY A 77 261.198 280.576 270.900 1.00 0.00 C +ATOM 78 CA LEU A 78 260.665 281.113 267.166 1.00 0.00 C +ATOM 79 CA ILE A 79 259.292 283.773 264.809 1.00 0.00 C +ATOM 80 CA PRO A 80 257.983 281.926 261.744 1.00 0.00 C +ATOM 81 CA SER A 81 256.448 283.547 258.657 1.00 0.00 C +ATOM 82 CA ARG A 82 256.916 281.897 255.255 1.00 0.00 C +ATOM 83 CA GLY A 83 255.466 280.148 252.197 1.00 0.00 C +ATOM 84 CA GLU A 84 258.190 279.984 249.538 1.00 0.00 C +ATOM 85 CA PRO A 85 261.196 281.927 250.843 1.00 0.00 C +ATOM 86 CA ARG A 86 264.486 281.023 252.538 1.00 0.00 C +ATOM 87 CA GLY A 87 266.807 278.424 254.080 1.00 0.00 C +ATOM 88 CA LEU A 88 269.869 277.452 256.129 1.00 0.00 C +ATOM 89 CA GLY A 89 272.081 274.952 257.964 1.00 0.00 C +ATOM 90 CA GLU A 90 274.526 272.362 256.610 1.00 0.00 C +ATOM 91 CA LEU A 91 275.711 269.622 254.243 1.00 0.00 C +ATOM 92 CA PRO A 92 275.756 266.036 255.530 1.00 0.00 C +ATOM 93 CA ASP A 93 277.314 263.325 253.353 1.00 0.00 C +ATOM 94 CA PRO A 94 276.721 260.643 250.713 1.00 0.00 C +ATOM 95 CA LYS A 95 274.632 257.587 251.613 1.00 0.00 C +ATOM 96 CA LEU A 96 271.725 256.683 249.323 1.00 0.00 C +ATOM 97 CA GLY A 97 272.349 256.320 245.582 1.00 0.00 C +ATOM 98 CA GLY A 98 271.683 252.852 244.151 1.00 0.00 C +ATOM 99 CA GLY A 99 273.089 250.719 241.324 1.00 0.00 C +ATOM 100 CA SER A 100 273.227 247.170 239.945 1.00 0.00 C +ATOM 101 CA ARG A 101 274.875 246.143 236.667 1.00 0.00 C +ATOM 102 CA CYS A 102 274.506 242.904 234.695 1.00 0.00 C +ATOM 103 CA ASN A 103 277.449 241.021 233.176 1.00 0.00 C +ATOM 104 CA THR A 104 280.278 242.232 230.929 1.00 0.00 C +ATOM 105 CA PRO A 105 281.784 243.439 227.644 1.00 0.00 C +ATOM 106 CA GLY A 106 280.849 246.734 225.975 1.00 0.00 C +ATOM 107 CA SER A 107 280.632 250.472 226.683 1.00 0.00 C +ATOM 108 CA THR A 108 283.208 252.065 228.995 1.00 0.00 C +ATOM 109 CA PRO A 109 285.419 253.044 231.939 1.00 0.00 C +ATOM 110 CA LEU A 110 288.474 254.676 230.352 1.00 0.00 C +ATOM 111 CA GLY A 111 291.588 256.215 231.917 1.00 0.00 C +ATOM 112 CA GLU A 112 294.031 257.633 229.360 1.00 0.00 C +ATOM 113 CA SER A 113 292.079 258.755 226.287 1.00 0.00 C +ATOM 114 CA HIS A 114 292.870 258.277 222.591 1.00 0.00 C +ATOM 115 CA VAL A 115 291.955 254.972 220.931 1.00 0.00 C +ATOM 116 CA GLY A 116 291.425 252.818 217.834 1.00 0.00 C +ATOM 117 CA LEU A 117 288.858 250.076 217.192 1.00 0.00 C +ATOM 118 CA ARG A 118 288.651 246.705 218.955 1.00 0.00 C +ATOM 119 CA ALA A 119 291.156 243.855 219.300 1.00 0.00 C +ATOM 120 CA ALA A 120 294.690 245.203 219.757 1.00 0.00 C +ATOM 121 CA SER A 121 297.411 242.596 219.196 1.00 0.00 C +ATOM 122 CA SER A 122 300.469 243.198 221.388 1.00 0.00 C +ATOM 123 CA LEU A 123 299.891 241.127 224.533 1.00 0.00 C +TER 124 LEU A 123 +END diff --git a/Plants/Q94E56/Q94E56.dcd b/Plants/Q94E56/Q94E56.dcd new file mode 100644 index 0000000000000000000000000000000000000000..1d3ebdc674ee6175a9cac88bf6d2b2c7b6470fb1 --- /dev/null +++ b/Plants/Q94E56/Q94E56.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e2d0de53db79f1a9eae108c1bd6af5bd4b6813a169615c41aa024d38fcd9c04e +size 11600276 diff --git a/Plants/Q94E56/top.pdb b/Plants/Q94E56/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..b785c8b4d49cf901053441145bf7315a97153f71 --- /dev/null +++ b/Plants/Q94E56/top.pdb @@ -0,0 +1,94 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 278.659 284.692 240.422 1.00 0.00 C +ATOM 2 CA TYR A 2 281.801 283.208 241.986 1.00 0.00 C +ATOM 3 CA LYS A 3 285.385 284.386 242.517 1.00 0.00 C +ATOM 4 CA GLU A 4 287.772 283.861 239.595 1.00 0.00 C +ATOM 5 CA LYS A 5 286.648 281.011 237.330 1.00 0.00 C +ATOM 6 CA THR A 6 287.496 277.551 238.681 1.00 0.00 C +ATOM 7 CA THR A 7 285.399 274.785 240.251 1.00 0.00 C +ATOM 8 CA PRO A 8 283.078 272.398 238.398 1.00 0.00 C +ATOM 9 CA LEU A 9 279.425 272.205 239.464 1.00 0.00 C +ATOM 10 CA PRO A 10 275.668 272.664 239.896 1.00 0.00 C +ATOM 11 CA PRO A 11 274.786 272.505 243.599 1.00 0.00 C +ATOM 12 CA PRO A 12 272.543 273.991 246.297 1.00 0.00 C +ATOM 13 CA PRO A 13 268.814 274.150 247.060 1.00 0.00 C +ATOM 14 CA PRO A 14 265.997 276.587 247.863 1.00 0.00 C +ATOM 15 CA GLY A 15 263.265 277.395 250.393 1.00 0.00 C +ATOM 16 CA ALA A 16 260.770 279.334 252.522 1.00 0.00 C +ATOM 17 CA ALA A 17 257.466 277.525 253.097 1.00 0.00 C +ATOM 18 CA PRO A 18 253.707 277.152 253.588 1.00 0.00 C +ATOM 19 CA PRO A 19 250.651 279.410 253.311 1.00 0.00 C +ATOM 20 CA PRO A 20 248.990 281.748 250.802 1.00 0.00 C +ATOM 21 CA ARG A 21 247.355 285.118 251.498 1.00 0.00 C +ATOM 22 CA PRO A 22 246.429 288.787 251.940 1.00 0.00 C +ATOM 23 CA THR A 23 243.762 291.295 250.885 1.00 0.00 C +ATOM 24 CA ALA A 24 240.385 292.909 251.598 1.00 0.00 C +ATOM 25 CA ALA A 25 236.718 293.455 250.722 1.00 0.00 C +ATOM 26 CA CYS A 26 236.321 292.631 247.023 1.00 0.00 C +ATOM 27 CA HIS A 27 236.184 288.935 246.109 1.00 0.00 C +ATOM 28 CA GLY A 28 233.301 286.707 247.222 1.00 0.00 C +ATOM 29 CA ARG A 29 233.094 282.934 246.734 1.00 0.00 C +ATOM 30 CA ARG A 30 233.877 281.347 243.360 1.00 0.00 C +ATOM 31 CA PRO A 31 230.841 279.214 242.492 1.00 0.00 C +ATOM 32 CA ALA A 32 229.090 276.329 240.723 1.00 0.00 C +ATOM 33 CA THR A 33 229.970 272.631 240.471 1.00 0.00 C +ATOM 34 CA GLY A 34 231.742 271.074 243.463 1.00 0.00 C +ATOM 35 CA HIS A 35 230.267 267.604 244.016 1.00 0.00 C +ATOM 36 CA GLY A 36 228.087 264.491 243.750 1.00 0.00 C +ATOM 37 CA PRO A 37 228.822 261.099 242.178 1.00 0.00 C +ATOM 38 CA ALA A 38 225.897 258.680 242.508 1.00 0.00 C +ATOM 39 CA GLY A 39 225.006 255.492 240.621 1.00 0.00 C +ATOM 40 CA ARG A 40 224.310 252.088 239.057 1.00 0.00 C +ATOM 41 CA ARG A 41 221.437 250.324 240.832 1.00 0.00 C +ATOM 42 CA LEU A 42 221.313 247.055 242.784 1.00 0.00 C +ATOM 43 CA PRO A 43 223.538 244.032 243.440 1.00 0.00 C +ATOM 44 CA ASP A 44 225.469 241.551 241.288 1.00 0.00 C +ATOM 45 CA GLY A 45 229.157 241.035 240.484 1.00 0.00 C +ATOM 46 CA LYS A 46 231.260 240.045 237.465 1.00 0.00 C +ATOM 47 CA GLY A 47 229.462 237.914 234.868 1.00 0.00 C +ATOM 48 CA ARG A 48 231.890 235.125 233.948 1.00 0.00 C +ATOM 49 CA MET A 49 234.011 234.567 237.063 1.00 0.00 C +ATOM 50 CA GLY A 50 233.120 231.814 239.540 1.00 0.00 C +ATOM 51 CA ARG A 51 234.642 232.743 242.908 1.00 0.00 C +ATOM 52 CA LYS A 52 236.193 234.394 245.971 1.00 0.00 C +ATOM 53 CA GLY A 53 239.258 232.534 247.259 1.00 0.00 C +ATOM 54 CA GLU A 54 240.629 232.779 250.806 1.00 0.00 C +ATOM 55 CA ARG A 55 244.365 233.337 250.307 1.00 0.00 C +ATOM 56 CA ARG A 56 247.713 235.140 250.548 1.00 0.00 C +ATOM 57 CA ARG A 57 250.926 237.008 251.387 1.00 0.00 C +ATOM 58 CA TRP A 58 254.476 238.292 251.898 1.00 0.00 C +ATOM 59 CA ARG A 59 257.241 240.333 250.252 1.00 0.00 C +ATOM 60 CA ARG A 60 256.836 242.456 247.114 1.00 0.00 C +ATOM 61 CA GLY A 61 258.943 241.422 244.113 1.00 0.00 C +ATOM 62 CA GLU A 62 259.831 237.786 244.825 1.00 0.00 C +ATOM 63 CA GLU A 63 263.524 237.033 244.271 1.00 0.00 C +ATOM 64 CA GLU A 64 265.587 234.031 243.152 1.00 0.00 C +ATOM 65 CA GLY A 65 263.652 230.749 243.140 1.00 0.00 C +ATOM 66 CA GLU A 66 261.144 229.626 245.778 1.00 0.00 C +ATOM 67 CA GLU A 67 259.910 227.186 248.432 1.00 0.00 C +ATOM 68 CA VAL A 68 259.467 225.726 251.923 1.00 0.00 C +ATOM 69 CA GLU A 69 257.214 227.626 254.338 1.00 0.00 C +ATOM 70 CA GLY A 70 255.198 224.891 256.062 1.00 0.00 C +ATOM 71 CA LYS A 71 251.767 226.222 257.048 1.00 0.00 C +ATOM 72 CA GLY A 72 250.822 224.388 260.250 1.00 0.00 C +ATOM 73 CA ARG A 73 252.888 221.728 262.031 1.00 0.00 C +ATOM 74 CA GLY A 74 255.069 218.935 260.632 1.00 0.00 C +ATOM 75 CA GLY A 75 257.176 217.337 263.375 1.00 0.00 C +ATOM 76 CA GLY A 76 259.073 214.219 264.469 1.00 0.00 C +ATOM 77 CA GLY A 77 259.408 212.280 267.732 1.00 0.00 C +ATOM 78 CA GLU A 78 260.152 211.652 271.415 1.00 0.00 C +ATOM 79 CA GLY A 79 258.701 209.371 274.100 1.00 0.00 C +ATOM 80 CA ARG A 80 255.377 207.516 274.247 1.00 0.00 C +ATOM 81 CA ARG A 81 253.013 208.627 271.473 1.00 0.00 C +ATOM 82 CA TRP A 82 250.713 207.464 268.667 1.00 0.00 C +ATOM 83 CA ARG A 83 251.340 209.160 265.314 1.00 0.00 C +ATOM 84 CA GLY A 84 249.529 211.851 263.315 1.00 0.00 C +ATOM 85 CA TRP A 85 248.544 214.804 265.512 1.00 0.00 C +ATOM 86 CA ILE A 86 246.166 217.643 266.403 1.00 0.00 C +ATOM 87 CA GLY A 87 245.489 217.731 270.152 1.00 0.00 C +ATOM 88 CA LEU A 88 242.591 220.148 270.672 1.00 0.00 C +ATOM 89 CA ARG A 89 243.311 223.791 271.525 1.00 0.00 C +ATOM 90 CA MET A 90 241.695 227.204 272.030 1.00 0.00 C +TER 91 MET A 90 +END diff --git a/Plants/Q94E83/Q94E83.dcd b/Plants/Q94E83/Q94E83.dcd new file mode 100644 index 0000000000000000000000000000000000000000..e1a45bc1e770f9b4815814968a434ed3ca944113 --- /dev/null +++ b/Plants/Q94E83/Q94E83.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:9b566a5aea97ecf72d2e2c33bcc66c7232e505bec0dff0aadbee74b9ae2481ed +size 9680276 diff --git a/Plants/Q94E83/top.pdb b/Plants/Q94E83/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..cf10c43b7bd41b5affc5770ef55f063f0a9cd566 --- /dev/null +++ b/Plants/Q94E83/top.pdb @@ -0,0 +1,78 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 264.064 223.235 236.242 1.00 0.00 C +ATOM 2 CA GLY A 2 260.547 221.975 235.493 1.00 0.00 C +ATOM 3 CA GLY A 3 258.100 222.196 238.404 1.00 0.00 C +ATOM 4 CA ASN A 4 255.295 220.897 240.632 1.00 0.00 C +ATOM 5 CA ALA A 5 253.927 219.626 243.952 1.00 0.00 C +ATOM 6 CA VAL A 6 253.479 222.064 246.846 1.00 0.00 C +ATOM 7 CA ALA A 7 251.993 224.652 249.214 1.00 0.00 C +ATOM 8 CA ALA A 8 248.765 225.109 251.186 1.00 0.00 C +ATOM 9 CA LEU A 9 246.152 223.507 253.449 1.00 0.00 C +ATOM 10 CA LEU A 10 244.448 224.471 256.718 1.00 0.00 C +ATOM 11 CA ASP A 11 242.237 225.218 259.729 1.00 0.00 C +ATOM 12 CA GLY A 12 242.714 222.484 262.339 1.00 0.00 C +ATOM 13 CA GLU A 13 240.639 222.143 265.516 1.00 0.00 C +ATOM 14 CA VAL A 14 238.118 223.240 268.154 1.00 0.00 C +ATOM 15 CA GLU A 15 236.876 226.825 267.802 1.00 0.00 C +ATOM 16 CA GLY A 16 236.968 229.577 270.435 1.00 0.00 C +ATOM 17 CA ASP A 17 238.455 233.030 269.814 1.00 0.00 C +ATOM 18 CA GLU A 18 242.204 233.638 270.110 1.00 0.00 C +ATOM 19 CA ALA A 19 242.979 237.181 268.943 1.00 0.00 C +ATOM 20 CA ALA A 20 245.531 236.900 266.128 1.00 0.00 C +ATOM 21 CA GLY A 21 248.965 236.942 264.479 1.00 0.00 C +ATOM 22 CA GLU A 22 251.049 235.491 261.638 1.00 0.00 C +ATOM 23 CA MET A 23 252.483 236.594 258.285 1.00 0.00 C +ATOM 24 CA GLY A 24 251.331 236.671 254.654 1.00 0.00 C +ATOM 25 CA ASP A 25 253.976 238.186 252.369 1.00 0.00 C +ATOM 26 CA GLU A 26 255.630 240.179 249.575 1.00 0.00 C +ATOM 27 CA ALA A 27 256.439 241.583 246.126 1.00 0.00 C +ATOM 28 CA ALA A 28 255.662 241.990 242.418 1.00 0.00 C +ATOM 29 CA GLY A 29 255.100 238.958 240.181 1.00 0.00 C +ATOM 30 CA ARG A 30 253.488 237.353 237.125 1.00 0.00 C +ATOM 31 CA ALA A 31 252.373 234.243 235.226 1.00 0.00 C +ATOM 32 CA SER A 32 252.266 232.638 231.772 1.00 0.00 C +ATOM 33 CA VAL A 33 255.108 234.156 229.739 1.00 0.00 C +ATOM 34 CA GLY A 34 256.425 237.696 229.235 1.00 0.00 C +ATOM 35 CA GLY A 35 254.975 240.624 231.194 1.00 0.00 C +ATOM 36 CA GLY A 36 252.657 242.399 233.642 1.00 0.00 C +ATOM 37 CA ARG A 37 249.760 244.795 233.023 1.00 0.00 C +ATOM 38 CA ALA A 38 247.841 248.079 233.240 1.00 0.00 C +ATOM 39 CA GLY A 39 247.645 251.863 233.635 1.00 0.00 C +ATOM 40 CA ARG A 40 249.542 253.803 236.310 1.00 0.00 C +ATOM 41 CA ALA A 41 252.868 254.351 238.086 1.00 0.00 C +ATOM 42 CA ALA A 42 253.543 251.890 240.916 1.00 0.00 C +ATOM 43 CA THR A 43 250.884 251.739 243.641 1.00 0.00 C +ATOM 44 CA GLY A 44 247.864 254.058 243.764 1.00 0.00 C +ATOM 45 CA GLU A 45 246.293 256.963 241.863 1.00 0.00 C +ATOM 46 CA GLU A 46 244.742 260.214 243.103 1.00 0.00 C +ATOM 47 CA GLY A 47 244.534 262.393 246.222 1.00 0.00 C +ATOM 48 CA ARG A 48 245.284 264.147 249.520 1.00 0.00 C +ATOM 49 CA ARG A 49 245.245 264.272 253.327 1.00 0.00 C +ATOM 50 CA GLN A 50 247.559 266.357 255.522 1.00 0.00 C +ATOM 51 CA ARG A 51 251.155 265.560 254.547 1.00 0.00 C +ATOM 52 CA LEU A 52 254.947 265.780 254.258 1.00 0.00 C +ATOM 53 CA SER A 53 258.589 266.889 254.406 1.00 0.00 C +ATOM 54 CA LEU A 54 261.690 267.830 252.401 1.00 0.00 C +ATOM 55 CA PRO A 55 263.488 270.069 249.898 1.00 0.00 C +ATOM 56 CA TRP A 56 261.145 271.982 247.581 1.00 0.00 C +ATOM 57 CA ALA A 57 257.815 270.147 247.819 1.00 0.00 C +ATOM 58 CA ARG A 58 254.155 271.157 247.501 1.00 0.00 C +ATOM 59 CA GLU A 59 253.539 274.899 247.876 1.00 0.00 C +ATOM 60 CA GLU A 60 252.643 275.808 251.466 1.00 0.00 C +ATOM 61 CA GLY A 61 250.130 274.514 254.021 1.00 0.00 C +ATOM 62 CA GLU A 62 252.086 273.048 256.943 1.00 0.00 C +ATOM 63 CA LEU A 63 255.352 274.676 258.039 1.00 0.00 C +ATOM 64 CA ALA A 64 255.343 278.455 257.558 1.00 0.00 C +ATOM 65 CA ASP A 65 253.986 281.820 258.719 1.00 0.00 C +ATOM 66 CA GLY A 66 250.717 283.774 258.835 1.00 0.00 C +ATOM 67 CA ARG A 67 247.519 281.928 259.771 1.00 0.00 C +ATOM 68 CA ALA A 68 246.985 278.339 258.608 1.00 0.00 C +ATOM 69 CA ALA A 69 244.139 275.841 258.192 1.00 0.00 C +ATOM 70 CA ALA A 70 243.738 273.856 254.965 1.00 0.00 C +ATOM 71 CA ALA A 71 240.966 275.240 252.748 1.00 0.00 C +ATOM 72 CA GLY A 72 241.168 277.917 250.044 1.00 0.00 C +ATOM 73 CA GLY A 73 238.072 280.129 250.229 1.00 0.00 C +ATOM 74 CA ARG A 74 235.609 281.745 252.646 1.00 0.00 C +TER 75 ARG A 74 +END diff --git a/Plants/Q94EB3/Q94EB3.dcd b/Plants/Q94EB3/Q94EB3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..69dabcbb6a965e32c54f558596db27ffd3251978 --- /dev/null +++ b/Plants/Q94EB3/Q94EB3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:507f66299b510771bf0e3b124c105bfe6a00b9a11d99b1d491e75e266a65dc53 +size 12440276 diff --git a/Plants/Q94EB3/top.pdb b/Plants/Q94EB3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..5893902c7964b353b457b0b0a04d29c9a82e9cb1 --- /dev/null +++ b/Plants/Q94EB3/top.pdb @@ -0,0 +1,101 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 296.991 201.617 241.098 1.00 0.00 C +ATOM 2 CA TRP A 2 295.272 201.204 237.723 1.00 0.00 C +ATOM 3 CA GLU A 3 291.472 201.455 237.610 1.00 0.00 C +ATOM 4 CA VAL A 4 290.088 198.344 235.900 1.00 0.00 C +ATOM 5 CA THR A 5 286.743 198.641 234.101 1.00 0.00 C +ATOM 6 CA VAL A 6 286.266 197.011 230.690 1.00 0.00 C +ATOM 7 CA ALA A 7 282.828 196.928 229.050 1.00 0.00 C +ATOM 8 CA THR A 8 281.072 194.993 226.277 1.00 0.00 C +ATOM 9 CA GLY A 9 277.429 193.893 226.105 1.00 0.00 C +ATOM 10 CA SER A 10 275.352 196.801 227.426 1.00 0.00 C +ATOM 11 CA GLY A 11 277.198 199.945 228.531 1.00 0.00 C +ATOM 12 CA CYS A 12 276.550 203.313 226.871 1.00 0.00 C +ATOM 13 CA GLY A 13 278.668 206.458 227.248 1.00 0.00 C +ATOM 14 CA MET A 14 276.927 209.325 225.441 1.00 0.00 C +ATOM 15 CA PRO A 15 279.180 212.166 224.271 1.00 0.00 C +ATOM 16 CA PRO A 16 280.647 214.269 221.453 1.00 0.00 C +ATOM 17 CA THR A 17 283.564 216.480 222.513 1.00 0.00 C +ATOM 18 CA PRO A 18 284.478 218.263 225.753 1.00 0.00 C +ATOM 19 CA LEU A 19 286.428 221.093 227.397 1.00 0.00 C +ATOM 20 CA ASP A 20 289.784 222.059 228.922 1.00 0.00 C +ATOM 21 CA LEU A 21 293.126 223.657 228.031 1.00 0.00 C +ATOM 22 CA PRO A 22 294.022 227.175 229.189 1.00 0.00 C +ATOM 23 CA ALA A 23 292.633 228.113 232.610 1.00 0.00 C +ATOM 24 CA GLY A 24 289.723 230.515 232.087 1.00 0.00 C +ATOM 25 CA SER A 25 287.565 233.631 231.695 1.00 0.00 C +ATOM 26 CA ARG A 26 287.662 236.522 234.176 1.00 0.00 C +ATOM 27 CA THR A 27 285.395 235.732 237.134 1.00 0.00 C +ATOM 28 CA THR A 28 282.440 238.117 236.824 1.00 0.00 C +ATOM 29 CA PRO A 29 279.984 240.343 238.703 1.00 0.00 C +ATOM 30 CA PRO A 30 277.351 240.009 241.437 1.00 0.00 C +ATOM 31 CA ASP A 31 274.211 241.975 242.327 1.00 0.00 C +ATOM 32 CA PRO A 32 271.154 241.552 240.093 1.00 0.00 C +ATOM 33 CA PRO A 33 267.527 241.863 241.218 1.00 0.00 C +ATOM 34 CA VAL A 34 266.559 245.444 242.086 1.00 0.00 C +ATOM 35 CA GLU A 35 265.817 247.361 238.877 1.00 0.00 C +ATOM 36 CA ALA A 36 263.216 250.061 238.198 1.00 0.00 C +ATOM 37 CA THR A 37 263.461 251.130 234.549 1.00 0.00 C +ATOM 38 CA GLY A 38 260.762 253.586 233.455 1.00 0.00 C +ATOM 39 CA GLY A 39 257.382 252.670 231.953 1.00 0.00 C +ATOM 40 CA ARG A 40 254.079 251.011 232.879 1.00 0.00 C +ATOM 41 CA HIS A 41 250.778 249.373 231.912 1.00 0.00 C +ATOM 42 CA HIS A 42 249.686 246.169 230.164 1.00 0.00 C +ATOM 43 CA SER A 43 246.528 244.612 228.709 1.00 0.00 C +ATOM 44 CA ARG A 44 243.239 245.023 230.588 1.00 0.00 C +ATOM 45 CA TRP A 45 239.607 245.958 231.261 1.00 0.00 C +ATOM 46 CA GLY A 46 238.990 247.795 234.541 1.00 0.00 C +ATOM 47 CA LYS A 47 238.118 251.165 236.091 1.00 0.00 C +ATOM 48 CA GLY A 48 240.818 253.441 237.522 1.00 0.00 C +ATOM 49 CA ALA A 49 239.660 256.774 238.958 1.00 0.00 C +ATOM 50 CA VAL A 50 242.174 258.795 240.985 1.00 0.00 C +ATOM 51 CA THR A 51 242.886 259.435 244.673 1.00 0.00 C +ATOM 52 CA ALA A 52 241.437 257.426 247.568 1.00 0.00 C +ATOM 53 CA SER A 53 239.260 257.570 250.692 1.00 0.00 C +ATOM 54 CA ALA A 54 240.106 260.864 252.409 1.00 0.00 C +ATOM 55 CA ARG A 55 238.260 263.727 250.703 1.00 0.00 C +ATOM 56 CA ALA A 56 235.643 263.592 247.938 1.00 0.00 C +ATOM 57 CA GLU A 57 232.765 261.606 249.452 1.00 0.00 C +ATOM 58 CA GLY A 58 229.803 262.762 251.550 1.00 0.00 C +ATOM 59 CA GLY A 59 227.762 265.690 252.883 1.00 0.00 C +ATOM 60 CA ARG A 60 226.756 269.299 253.577 1.00 0.00 C +ATOM 61 CA ARG A 61 225.301 271.174 256.557 1.00 0.00 C +ATOM 62 CA HIS A 62 223.356 274.316 257.483 1.00 0.00 C +ATOM 63 CA ARG A 63 225.604 277.347 256.960 1.00 0.00 C +ATOM 64 CA ARG A 64 228.221 277.161 254.197 1.00 0.00 C +ATOM 65 CA SER A 65 228.377 276.286 250.492 1.00 0.00 C +ATOM 66 CA ARG A 66 225.914 273.818 248.958 1.00 0.00 C +ATOM 67 CA SER A 67 224.704 275.404 245.712 1.00 0.00 C +ATOM 68 CA GLY A 68 226.968 277.748 243.737 1.00 0.00 C +ATOM 69 CA ARG A 69 227.627 280.907 245.762 1.00 0.00 C +ATOM 70 CA ILE A 70 226.432 282.925 248.764 1.00 0.00 C +ATOM 71 CA THR A 71 228.569 284.612 251.430 1.00 0.00 C +ATOM 72 CA ALA A 72 231.324 284.350 254.048 1.00 0.00 C +ATOM 73 CA GLY A 73 232.997 282.357 256.831 1.00 0.00 C +ATOM 74 CA PRO A 74 231.767 281.892 260.407 1.00 0.00 C +ATOM 75 CA ARG A 75 232.962 282.110 264.018 1.00 0.00 C +ATOM 76 CA LYS A 76 231.950 281.277 267.596 1.00 0.00 C +ATOM 77 CA LEU A 77 230.090 280.895 270.898 1.00 0.00 C +ATOM 78 CA ASN A 78 229.405 277.978 273.252 1.00 0.00 C +ATOM 79 CA GLY A 79 230.051 274.403 274.398 1.00 0.00 C +ATOM 80 CA PRO A 80 227.804 271.980 272.500 1.00 0.00 C +ATOM 81 CA ARG A 81 224.082 272.329 273.233 1.00 0.00 C +ATOM 82 CA ALA A 82 220.784 271.986 275.110 1.00 0.00 C +ATOM 83 CA GLY A 83 220.533 274.581 277.889 1.00 0.00 C +ATOM 84 CA GLN A 84 219.540 276.008 281.279 1.00 0.00 C +ATOM 85 CA TRP A 85 216.458 274.590 283.011 1.00 0.00 C +ATOM 86 CA VAL A 86 215.780 272.240 285.933 1.00 0.00 C +ATOM 87 CA GLN A 87 215.961 272.170 289.738 1.00 0.00 C +ATOM 88 CA HIS A 88 212.656 273.663 290.909 1.00 0.00 C +ATOM 89 CA ASN A 89 212.107 273.159 294.645 1.00 0.00 C +ATOM 90 CA THR A 90 210.648 272.684 298.132 1.00 0.00 C +ATOM 91 CA VAL A 91 212.496 272.302 301.442 1.00 0.00 C +ATOM 92 CA ARG A 92 215.237 274.246 303.237 1.00 0.00 C +ATOM 93 CA GLY A 93 218.462 274.917 305.151 1.00 0.00 C +ATOM 94 CA VAL A 94 221.436 274.414 302.823 1.00 0.00 C +ATOM 95 CA GLU A 95 223.321 273.424 299.664 1.00 0.00 C +ATOM 96 CA GLY A 96 222.045 272.222 296.281 1.00 0.00 C +ATOM 97 CA ARG A 97 223.747 270.326 293.449 1.00 0.00 C +TER 98 ARG A 97 +END diff --git a/Plants/Q94F13/Q94F13.dcd b/Plants/Q94F13/Q94F13.dcd new file mode 100644 index 0000000000000000000000000000000000000000..b1af67838ad424e0d43f98ce6e80aac5325f03c9 --- /dev/null +++ b/Plants/Q94F13/Q94F13.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:0b9ce4c5db3a42fbad3fc841946fec033e9295f6457579b2410389140f3c1b3d +size 5480276 diff --git a/Plants/Q94F13/top.pdb b/Plants/Q94F13/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..b2d238fdd558a4dd2d69cdb5f9f6605eaffcf06f --- /dev/null +++ b/Plants/Q94F13/top.pdb @@ -0,0 +1,43 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 242.843 228.656 229.827 1.00 0.00 C +ATOM 2 CA ALA A 2 242.624 232.335 230.792 1.00 0.00 C +ATOM 3 CA LYS A 3 242.434 233.232 234.490 1.00 0.00 C +ATOM 4 CA SER A 4 239.313 233.219 236.675 1.00 0.00 C +ATOM 5 CA LYS A 5 238.685 232.234 240.302 1.00 0.00 C +ATOM 6 CA ILE A 6 241.974 232.677 242.173 1.00 0.00 C +ATOM 7 CA THR A 7 244.802 234.935 243.364 1.00 0.00 C +ATOM 8 CA ARG A 8 248.535 235.683 243.511 1.00 0.00 C +ATOM 9 CA ARG A 9 250.187 234.896 246.853 1.00 0.00 C +ATOM 10 CA ILE A 10 252.174 237.543 248.740 1.00 0.00 C +ATOM 11 CA THR A 11 254.465 240.318 249.992 1.00 0.00 C +ATOM 12 CA SER A 12 257.302 241.348 252.318 1.00 0.00 C +ATOM 13 CA ARG A 13 259.912 243.800 251.017 1.00 0.00 C +ATOM 14 CA ARG A 14 258.405 247.152 250.015 1.00 0.00 C +ATOM 15 CA LYS A 15 258.741 249.848 247.343 1.00 0.00 C +ATOM 16 CA PRO A 16 258.157 248.627 243.781 1.00 0.00 C +ATOM 17 CA THR A 17 261.419 248.129 241.877 1.00 0.00 C +ATOM 18 CA ARG A 18 262.693 251.659 241.218 1.00 0.00 C +ATOM 19 CA THR A 19 263.788 254.593 243.388 1.00 0.00 C +ATOM 20 CA GLU A 20 261.863 257.455 245.005 1.00 0.00 C +ATOM 21 CA SER A 21 262.866 259.764 247.865 1.00 0.00 C +ATOM 22 CA ARG A 22 263.454 258.494 251.408 1.00 0.00 C +ATOM 23 CA SER A 23 263.617 257.213 254.993 1.00 0.00 C +ATOM 24 CA GLN A 24 263.405 257.408 258.792 1.00 0.00 C +ATOM 25 CA GLY A 25 261.037 258.995 261.319 1.00 0.00 C +ATOM 26 CA ASP A 26 257.771 257.322 262.346 1.00 0.00 C +ATOM 27 CA THR A 27 254.079 257.681 261.477 1.00 0.00 C +ATOM 28 CA VAL A 28 253.527 261.069 259.822 1.00 0.00 C +ATOM 29 CA THR A 29 251.475 261.320 256.622 1.00 0.00 C +ATOM 30 CA PRO A 30 249.379 260.563 253.532 1.00 0.00 C +ATOM 31 CA GLN A 31 245.914 258.988 253.371 1.00 0.00 C +ATOM 32 CA PRO A 32 244.066 256.923 255.986 1.00 0.00 C +ATOM 33 CA GLU A 33 240.338 257.692 256.136 1.00 0.00 C +ATOM 34 CA GLU A 34 237.078 255.748 256.469 1.00 0.00 C +ATOM 35 CA TRP A 35 233.811 256.562 258.251 1.00 0.00 C +ATOM 36 CA THR A 36 232.980 259.258 260.812 1.00 0.00 C +ATOM 37 CA LEU A 37 231.506 262.095 258.740 1.00 0.00 C +ATOM 38 CA SER A 38 232.457 265.784 258.801 1.00 0.00 C +ATOM 39 CA SER A 39 230.921 268.784 260.577 1.00 0.00 C +TER 40 SER A 39 +END diff --git a/Plants/Q94HN1/Q94HN1.dcd b/Plants/Q94HN1/Q94HN1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..caa2f10646f5cf710b3429bd9ceedcc5ed5eddb0 --- /dev/null +++ b/Plants/Q94HN1/Q94HN1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:31197c9899403a8d98db0f9ed59250872cf0118c7dc8031b0c598d5ac81e0558 +size 22400276 diff --git a/Plants/Q94HN1/top.pdb b/Plants/Q94HN1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..f35400e0edd4624bf8f53cbd488f1537841e0951 --- /dev/null +++ b/Plants/Q94HN1/top.pdb @@ -0,0 +1,184 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 271.982 279.352 229.684 1.00 0.00 C +ATOM 2 CA GLY A 2 274.982 280.129 231.900 1.00 0.00 C +ATOM 3 CA THR A 3 276.697 280.941 235.204 1.00 0.00 C +ATOM 4 CA ALA A 4 276.309 278.242 237.865 1.00 0.00 C +ATOM 5 CA ALA A 5 276.536 277.958 241.658 1.00 0.00 C +ATOM 6 CA VAL A 6 276.966 275.222 244.275 1.00 0.00 C +ATOM 7 CA GLN A 7 278.972 271.984 244.309 1.00 0.00 C +ATOM 8 CA GLY A 8 278.959 268.183 244.038 1.00 0.00 C +ATOM 9 CA ASN A 9 277.199 265.495 241.991 1.00 0.00 C +ATOM 10 CA GLY A 10 274.991 266.209 238.970 1.00 0.00 C +ATOM 11 CA ARG A 11 275.249 266.160 235.169 1.00 0.00 C +ATOM 12 CA PRO A 12 276.620 264.667 231.943 1.00 0.00 C +ATOM 13 CA ARG A 13 277.798 261.681 229.891 1.00 0.00 C +ATOM 14 CA SER A 14 275.090 261.164 227.262 1.00 0.00 C +ATOM 15 CA THR A 15 272.053 259.710 229.045 1.00 0.00 C +ATOM 16 CA LEU A 16 271.915 260.889 232.666 1.00 0.00 C +ATOM 17 CA SER A 17 272.432 260.327 236.398 1.00 0.00 C +ATOM 18 CA LYS A 18 272.019 257.512 238.932 1.00 0.00 C +ATOM 19 CA THR A 19 269.676 254.764 237.719 1.00 0.00 C +ATOM 20 CA ASP A 20 266.086 253.686 238.401 1.00 0.00 C +ATOM 21 CA CYS A 21 263.123 255.910 239.290 1.00 0.00 C +ATOM 22 CA ARG A 22 259.661 256.344 240.821 1.00 0.00 C +ATOM 23 CA ASP A 23 256.522 255.146 242.617 1.00 0.00 C +ATOM 24 CA ARG A 24 254.212 252.860 240.627 1.00 0.00 C +ATOM 25 CA THR A 25 254.858 249.637 238.701 1.00 0.00 C +ATOM 26 CA VAL A 26 257.988 247.472 238.521 1.00 0.00 C +ATOM 27 CA HIS A 27 259.367 245.175 241.229 1.00 0.00 C +ATOM 28 CA ASP A 28 260.402 241.684 240.109 1.00 0.00 C +ATOM 29 CA ARG A 29 262.609 238.628 239.555 1.00 0.00 C +ATOM 30 CA LEU A 30 263.197 235.346 241.398 1.00 0.00 C +ATOM 31 CA THR A 31 266.012 235.048 243.948 1.00 0.00 C +ATOM 32 CA GLY A 32 269.681 234.235 243.315 1.00 0.00 C +ATOM 33 CA ASN A 33 271.933 231.300 244.223 1.00 0.00 C +ATOM 34 CA GLY A 34 270.748 227.749 243.511 1.00 0.00 C +ATOM 35 CA ASN A 35 267.200 226.560 244.226 1.00 0.00 C +ATOM 36 CA ASP A 36 263.965 227.354 246.076 1.00 0.00 C +ATOM 37 CA ASP A 37 261.307 229.607 247.616 1.00 0.00 C +ATOM 38 CA VAL A 38 262.034 230.515 251.244 1.00 0.00 C +ATOM 39 CA SER A 39 262.755 230.956 254.959 1.00 0.00 C +ATOM 40 CA ASP A 40 260.526 233.714 256.353 1.00 0.00 C +ATOM 41 CA ASP A 41 258.154 234.775 259.139 1.00 0.00 C +ATOM 42 CA GLY A 42 258.169 232.886 262.448 1.00 0.00 C +ATOM 43 CA SER A 43 259.500 232.087 265.927 1.00 0.00 C +ATOM 44 CA ASP A 44 257.849 234.056 268.741 1.00 0.00 C +ATOM 45 CA ASP A 45 256.071 237.418 268.960 1.00 0.00 C +ATOM 46 CA VAL A 46 253.759 238.616 266.179 1.00 0.00 C +ATOM 47 CA SER A 47 254.601 238.552 262.463 1.00 0.00 C +ATOM 48 CA THR A 48 257.754 240.614 261.894 1.00 0.00 C +ATOM 49 CA GLY A 49 258.015 242.344 258.509 1.00 0.00 C +ATOM 50 CA GLY A 50 257.200 243.951 255.152 1.00 0.00 C +ATOM 51 CA ASP A 51 256.739 244.758 251.457 1.00 0.00 C +ATOM 52 CA SER A 52 256.476 243.889 247.757 1.00 0.00 C +ATOM 53 CA GLY A 53 253.810 242.614 245.352 1.00 0.00 C +ATOM 54 CA GLY A 54 254.483 240.457 242.285 1.00 0.00 C +ATOM 55 CA SER A 55 251.403 238.374 241.455 1.00 0.00 C +ATOM 56 CA ASP A 56 250.670 235.003 243.072 1.00 0.00 C +ATOM 57 CA ALA A 57 251.840 233.870 246.516 1.00 0.00 C +ATOM 58 CA HIS A 58 252.612 230.157 246.148 1.00 0.00 C +ATOM 59 CA ALA A 59 251.542 227.001 247.995 1.00 0.00 C +ATOM 60 CA ARG A 60 249.601 223.786 247.353 1.00 0.00 C +ATOM 61 CA ARG A 61 246.481 223.791 249.540 1.00 0.00 C +ATOM 62 CA ARG A 62 243.568 224.958 247.379 1.00 0.00 C +ATOM 63 CA MET A 63 241.398 226.633 244.733 1.00 0.00 C +ATOM 64 CA THR A 64 237.760 226.521 243.608 1.00 0.00 C +ATOM 65 CA ALA A 65 233.999 226.924 243.148 1.00 0.00 C +ATOM 66 CA ARG A 66 231.808 223.910 243.939 1.00 0.00 C +ATOM 67 CA ARG A 67 232.951 220.510 245.225 1.00 0.00 C +ATOM 68 CA ARG A 68 231.461 217.007 245.063 1.00 0.00 C +ATOM 69 CA GLU A 69 227.965 215.509 245.286 1.00 0.00 C +ATOM 70 CA ARG A 70 227.293 211.998 246.605 1.00 0.00 C +ATOM 71 CA ARG A 71 230.189 209.673 245.753 1.00 0.00 C +ATOM 72 CA ALA A 72 232.149 206.851 247.399 1.00 0.00 C +ATOM 73 CA PRO A 73 235.643 206.907 245.880 1.00 0.00 C +ATOM 74 CA THR A 74 238.482 209.085 247.188 1.00 0.00 C +ATOM 75 CA GLY A 75 238.320 212.802 248.011 1.00 0.00 C +ATOM 76 CA ARG A 76 235.432 214.640 249.684 1.00 0.00 C +ATOM 77 CA GLY A 77 232.074 215.456 251.289 1.00 0.00 C +ATOM 78 CA ARG A 78 230.973 212.911 253.902 1.00 0.00 C +ATOM 79 CA ARG A 79 231.334 214.327 257.421 1.00 0.00 C +ATOM 80 CA GLY A 80 234.036 215.934 259.573 1.00 0.00 C +ATOM 81 CA GLU A 81 235.745 219.116 260.786 1.00 0.00 C +ATOM 82 CA LEU A 82 234.826 222.115 258.623 1.00 0.00 C +ATOM 83 CA THR A 83 233.110 223.829 255.684 1.00 0.00 C +ATOM 84 CA GLY A 84 230.968 226.874 254.873 1.00 0.00 C +ATOM 85 CA ASP A 85 227.188 226.568 255.234 1.00 0.00 C +ATOM 86 CA GLN A 86 224.462 229.158 255.853 1.00 0.00 C +ATOM 87 CA ASN A 87 220.976 229.695 254.413 1.00 0.00 C +ATOM 88 CA ASN A 88 218.466 227.960 252.132 1.00 0.00 C +ATOM 89 CA GLY A 89 218.306 230.129 249.004 1.00 0.00 C +ATOM 90 CA GLY A 90 219.833 233.608 249.292 1.00 0.00 C +ATOM 91 CA LYS A 91 220.791 236.906 247.644 1.00 0.00 C +ATOM 92 CA ALA A 92 222.883 239.501 245.797 1.00 0.00 C +ATOM 93 CA THR A 93 225.587 241.916 244.626 1.00 0.00 C +ATOM 94 CA ASP A 94 224.842 245.557 245.467 1.00 0.00 C +ATOM 95 CA GLY A 95 225.862 249.214 245.145 1.00 0.00 C +ATOM 96 CA ALA A 96 225.660 251.803 242.357 1.00 0.00 C +ATOM 97 CA GLY A 97 224.757 252.093 238.667 1.00 0.00 C +ATOM 98 CA ASP A 98 221.376 251.560 236.994 1.00 0.00 C +ATOM 99 CA GLU A 99 218.706 254.226 236.461 1.00 0.00 C +ATOM 100 CA GLU A 100 217.577 257.811 237.087 1.00 0.00 C +ATOM 101 CA GLU A 101 217.244 260.623 239.636 1.00 0.00 C +ATOM 102 CA ALA A 102 220.233 262.576 240.964 1.00 0.00 C +ATOM 103 CA ALA A 103 222.270 265.455 239.522 1.00 0.00 C +ATOM 104 CA ALA A 104 220.508 268.819 239.211 1.00 0.00 C +ATOM 105 CA GLU A 105 222.037 271.400 236.863 1.00 0.00 C +ATOM 106 CA ILE A 106 223.403 271.812 233.330 1.00 0.00 C +ATOM 107 CA GLY A 107 225.755 274.806 233.178 1.00 0.00 C +ATOM 108 CA SER A 108 224.728 277.732 235.391 1.00 0.00 C +ATOM 109 CA THR A 109 224.648 277.245 239.169 1.00 0.00 C +ATOM 110 CA ALA A 110 228.158 276.542 240.474 1.00 0.00 C +ATOM 111 CA ALA A 111 229.907 273.387 241.699 1.00 0.00 C +ATOM 112 CA THR A 112 228.162 270.038 242.203 1.00 0.00 C +ATOM 113 CA VAL A 113 230.624 267.537 243.684 1.00 0.00 C +ATOM 114 CA LEU A 114 234.200 268.485 244.596 1.00 0.00 C +ATOM 115 CA ARG A 115 237.048 267.920 247.063 1.00 0.00 C +ATOM 116 CA ARG A 116 238.202 270.190 249.897 1.00 0.00 C +ATOM 117 CA SER A 117 235.745 271.711 252.379 1.00 0.00 C +ATOM 118 CA SER A 118 235.659 271.404 256.176 1.00 0.00 C +ATOM 119 CA ALA A 119 234.564 267.819 256.861 1.00 0.00 C +ATOM 120 CA ALA A 120 230.969 267.388 258.045 1.00 0.00 C +ATOM 121 CA ALA A 121 229.504 264.821 255.640 1.00 0.00 C +ATOM 122 CA LYS A 122 230.490 264.426 251.981 1.00 0.00 C +ATOM 123 CA GLY A 123 234.086 263.180 251.805 1.00 0.00 C +ATOM 124 CA ARG A 124 235.771 260.958 249.209 1.00 0.00 C +ATOM 125 CA THR A 125 237.295 260.921 245.718 1.00 0.00 C +ATOM 126 CA GLY A 126 238.961 257.613 244.826 1.00 0.00 C +ATOM 127 CA THR A 127 240.166 255.393 247.677 1.00 0.00 C +ATOM 128 CA ALA A 128 237.930 252.777 249.312 1.00 0.00 C +ATOM 129 CA THR A 129 235.192 254.107 251.604 1.00 0.00 C +ATOM 130 CA THR A 130 233.163 251.841 253.899 1.00 0.00 C +ATOM 131 CA TRP A 131 229.762 252.083 255.598 1.00 0.00 C +ATOM 132 CA ARG A 132 227.444 254.876 256.757 1.00 0.00 C +ATOM 133 CA SER A 133 228.824 258.420 256.989 1.00 0.00 C +ATOM 134 CA ARG A 134 232.059 258.445 254.977 1.00 0.00 C +ATOM 135 CA TRP A 135 234.714 260.062 257.180 1.00 0.00 C +ATOM 136 CA TRP A 136 237.669 257.734 257.780 1.00 0.00 C +ATOM 137 CA PRO A 137 241.471 257.809 258.027 1.00 0.00 C +ATOM 138 CA SER A 138 243.823 259.327 255.444 1.00 0.00 C +ATOM 139 CA ARG A 139 245.294 262.085 253.265 1.00 0.00 C +ATOM 140 CA VAL A 140 248.990 262.679 253.972 1.00 0.00 C +ATOM 141 CA THR A 141 251.079 264.510 256.580 1.00 0.00 C +ATOM 142 CA THR A 142 254.114 266.549 257.651 1.00 0.00 C +ATOM 143 CA THR A 143 253.849 269.943 255.940 1.00 0.00 C +ATOM 144 CA THR A 144 255.640 271.964 253.252 1.00 0.00 C +ATOM 145 CA GLY A 145 257.656 271.696 250.031 1.00 0.00 C +ATOM 146 CA THR A 146 260.306 272.310 247.363 1.00 0.00 C +ATOM 147 CA ALA A 147 264.026 273.093 247.103 1.00 0.00 C +ATOM 148 CA ALA A 148 267.009 271.028 245.943 1.00 0.00 C +ATOM 149 CA ALA A 149 267.767 268.293 248.485 1.00 0.00 C +ATOM 150 CA HIS A 150 268.372 264.586 247.846 1.00 0.00 C +ATOM 151 CA GLY A 151 268.976 261.325 245.970 1.00 0.00 C +ATOM 152 CA TRP A 152 267.245 258.171 247.224 1.00 0.00 C +ATOM 153 CA SER A 153 267.333 255.444 249.883 1.00 0.00 C +ATOM 154 CA ASP A 154 269.914 255.442 252.686 1.00 0.00 C +ATOM 155 CA GLY A 155 269.300 257.374 255.911 1.00 0.00 C +ATOM 156 CA GLY A 156 270.562 258.300 259.385 1.00 0.00 C +ATOM 157 CA ASP A 157 272.382 257.260 262.566 1.00 0.00 C +ATOM 158 CA GLY A 158 274.049 255.954 265.734 1.00 0.00 C +ATOM 159 CA GLY A 159 273.356 253.318 268.396 1.00 0.00 C +ATOM 160 CA ALA A 160 270.218 254.200 270.368 1.00 0.00 C +ATOM 161 CA ARG A 161 267.487 251.545 270.453 1.00 0.00 C +ATOM 162 CA ALA A 162 264.169 253.195 269.566 1.00 0.00 C +ATOM 163 CA HIS A 163 260.429 252.873 270.217 1.00 0.00 C +ATOM 164 CA GLY A 164 256.828 251.804 270.856 1.00 0.00 C +ATOM 165 CA ALA A 165 254.240 254.264 269.528 1.00 0.00 C +ATOM 166 CA ARG A 166 252.808 254.564 266.010 1.00 0.00 C +ATOM 167 CA ALA A 167 254.324 256.171 262.906 1.00 0.00 C +ATOM 168 CA LEU A 168 257.685 257.964 263.001 1.00 0.00 C +ATOM 169 CA ARG A 169 261.359 258.809 263.548 1.00 0.00 C +ATOM 170 CA THR A 170 263.880 259.548 266.308 1.00 0.00 C +ATOM 171 CA THR A 171 267.003 260.858 268.052 1.00 0.00 C +ATOM 172 CA ARG A 172 270.227 262.752 268.786 1.00 0.00 C +ATOM 173 CA GLY A 173 273.727 264.186 269.244 1.00 0.00 C +ATOM 174 CA GLU A 174 274.069 267.862 268.302 1.00 0.00 C +ATOM 175 CA GLY A 175 277.721 268.706 268.985 1.00 0.00 C +ATOM 176 CA GLU A 176 280.546 266.400 270.088 1.00 0.00 C +ATOM 177 CA GLY A 177 284.062 264.987 270.480 1.00 0.00 C +ATOM 178 CA GLY A 178 286.273 266.615 267.838 1.00 0.00 C +ATOM 179 CA GLY A 179 287.149 270.276 267.249 1.00 0.00 C +ATOM 180 CA GLY A 180 290.074 272.709 267.041 1.00 0.00 C +TER 181 GLY A 180 +END diff --git a/Plants/Q94HX9/Q94HX9.dcd b/Plants/Q94HX9/Q94HX9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..79a46aa20932cdd77eb0de6b563244042aad20dd --- /dev/null +++ b/Plants/Q94HX9/Q94HX9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:19391673c5a9964d5414d2b7a5a8b4a85ac2e60994d9970ba5f499f97e78af48 +size 10160276 diff --git a/Plants/Q94HX9/top.pdb b/Plants/Q94HX9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..9b38c58aa1f7e198f0351c6931ba4ece2c6bcdad --- /dev/null +++ b/Plants/Q94HX9/top.pdb @@ -0,0 +1,82 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 258.185 212.777 220.216 1.00 0.00 C +ATOM 2 CA ALA A 2 256.268 215.827 221.455 1.00 0.00 C +ATOM 3 CA ALA A 3 257.198 218.854 223.574 1.00 0.00 C +ATOM 4 CA GLY A 4 256.598 222.263 221.982 1.00 0.00 C +ATOM 5 CA PRO A 5 255.246 225.188 224.016 1.00 0.00 C +ATOM 6 CA PRO A 6 251.984 224.680 225.918 1.00 0.00 C +ATOM 7 CA PRO A 7 251.094 224.541 229.620 1.00 0.00 C +ATOM 8 CA PRO A 8 250.438 227.719 231.617 1.00 0.00 C +ATOM 9 CA ALA A 9 246.864 228.712 230.745 1.00 0.00 C +ATOM 10 CA THR A 10 245.143 228.892 227.351 1.00 0.00 C +ATOM 11 CA ALA A 11 243.750 232.424 227.038 1.00 0.00 C +ATOM 12 CA ALA A 12 244.603 236.040 227.884 1.00 0.00 C +ATOM 13 CA GLY A 13 245.091 238.777 225.279 1.00 0.00 C +ATOM 14 CA PRO A 14 242.956 241.806 224.392 1.00 0.00 C +ATOM 15 CA PRO A 15 242.343 245.159 226.095 1.00 0.00 C +ATOM 16 CA PRO A 16 242.004 245.455 229.878 1.00 0.00 C +ATOM 17 CA GLY A 17 243.240 242.404 231.796 1.00 0.00 C +ATOM 18 CA MET A 18 246.111 240.708 233.638 1.00 0.00 C +ATOM 19 CA ALA A 19 247.816 237.492 234.764 1.00 0.00 C +ATOM 20 CA PRO A 20 245.846 235.779 237.538 1.00 0.00 C +ATOM 21 CA PRO A 21 248.118 235.256 240.552 1.00 0.00 C +ATOM 22 CA ALA A 22 246.792 237.634 243.217 1.00 0.00 C +ATOM 23 CA ALA A 23 243.872 236.114 245.134 1.00 0.00 C +ATOM 24 CA GLY A 24 241.603 234.168 247.498 1.00 0.00 C +ATOM 25 CA CYS A 25 239.559 232.246 250.076 1.00 0.00 C +ATOM 26 CA ARG A 26 237.669 233.268 253.222 1.00 0.00 C +ATOM 27 CA ILE A 27 235.149 236.122 253.366 1.00 0.00 C +ATOM 28 CA GLY A 28 235.147 239.758 254.503 1.00 0.00 C +ATOM 29 CA ARG A 29 236.600 240.626 257.917 1.00 0.00 C +ATOM 30 CA GLY A 30 240.289 239.868 258.494 1.00 0.00 C +ATOM 31 CA GLY A 31 242.816 240.277 255.672 1.00 0.00 C +ATOM 32 CA TRP A 32 241.252 242.480 252.984 1.00 0.00 C +ATOM 33 CA ALA A 33 241.497 240.382 249.813 1.00 0.00 C +ATOM 34 CA GLY A 34 240.831 241.301 246.176 1.00 0.00 C +ATOM 35 CA LYS A 35 242.458 244.710 245.685 1.00 0.00 C +ATOM 36 CA GLY A 36 245.047 245.343 248.408 1.00 0.00 C +ATOM 37 CA ARG A 37 246.500 248.586 249.781 1.00 0.00 C +ATOM 38 CA GLY A 38 246.540 249.300 253.523 1.00 0.00 C +ATOM 39 CA GLY A 39 244.694 252.603 253.966 1.00 0.00 C +ATOM 40 CA GLY A 40 242.787 254.814 256.414 1.00 0.00 C +ATOM 41 CA GLY A 41 239.673 256.739 255.360 1.00 0.00 C +ATOM 42 CA GLY A 42 239.000 256.668 251.610 1.00 0.00 C +ATOM 43 CA GLU A 43 239.759 253.595 249.489 1.00 0.00 C +ATOM 44 CA GLY A 44 241.125 252.815 246.019 1.00 0.00 C +ATOM 45 CA ARG A 45 241.913 254.870 242.909 1.00 0.00 C +ATOM 46 CA GLY A 46 243.577 257.247 240.440 1.00 0.00 C +ATOM 47 CA SER A 47 247.310 257.507 239.721 1.00 0.00 C +ATOM 48 CA ASP A 48 249.714 254.632 240.406 1.00 0.00 C +ATOM 49 CA GLU A 49 252.933 253.454 242.069 1.00 0.00 C +ATOM 50 CA GLU A 50 255.245 252.810 245.028 1.00 0.00 C +ATOM 51 CA GLY A 51 256.247 253.211 248.682 1.00 0.00 C +ATOM 52 CA GLU A 52 258.865 255.369 250.417 1.00 0.00 C +ATOM 53 CA GLU A 53 259.630 255.768 254.128 1.00 0.00 C +ATOM 54 CA VAL A 54 260.124 257.566 257.450 1.00 0.00 C +ATOM 55 CA GLU A 55 258.655 261.065 257.106 1.00 0.00 C +ATOM 56 CA GLY A 56 258.024 264.677 258.141 1.00 0.00 C +ATOM 57 CA MET A 57 254.794 265.921 259.733 1.00 0.00 C +ATOM 58 CA ASP A 58 253.498 265.719 263.310 1.00 0.00 C +ATOM 59 CA ARG A 59 254.503 265.222 266.951 1.00 0.00 C +ATOM 60 CA ASP A 60 255.386 266.345 270.483 1.00 0.00 C +ATOM 61 CA GLU A 61 258.472 268.173 271.769 1.00 0.00 C +ATOM 62 CA ASP A 62 257.248 270.725 274.319 1.00 0.00 C +ATOM 63 CA VAL A 63 258.723 272.922 277.061 1.00 0.00 C +ATOM 64 CA GLY A 64 255.851 275.115 278.266 1.00 0.00 C +ATOM 65 CA SER A 65 252.543 276.643 277.152 1.00 0.00 C +ATOM 66 CA GLY A 66 253.012 279.549 274.733 1.00 0.00 C +ATOM 67 CA GLY A 67 254.897 279.476 271.422 1.00 0.00 C +ATOM 68 CA GLY A 68 256.287 279.280 267.880 1.00 0.00 C +ATOM 69 CA ARG A 69 256.567 276.624 265.163 1.00 0.00 C +ATOM 70 CA GLU A 70 255.913 273.339 266.980 1.00 0.00 C +ATOM 71 CA ARG A 71 256.965 270.414 264.777 1.00 0.00 C +ATOM 72 CA ARG A 72 260.362 268.827 265.451 1.00 0.00 C +ATOM 73 CA GLY A 73 263.088 267.564 267.795 1.00 0.00 C +ATOM 74 CA GLU A 74 266.194 269.043 269.433 1.00 0.00 C +ATOM 75 CA ILE A 75 266.686 268.746 273.200 1.00 0.00 C +ATOM 76 CA ARG A 76 263.910 266.901 275.044 1.00 0.00 C +ATOM 77 CA TYR A 77 264.575 263.241 275.865 1.00 0.00 C +ATOM 78 CA VAL A 78 266.736 261.864 273.045 1.00 0.00 C +TER 79 VAL A 78 +END diff --git a/Plants/Q94I16/Q94I16.dcd b/Plants/Q94I16/Q94I16.dcd new file mode 100644 index 0000000000000000000000000000000000000000..89d4b9810c831cf991587ed45a3cfd1875e49cf3 --- /dev/null +++ b/Plants/Q94I16/Q94I16.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:bf297841a1f35110e979cda46b6d88eee7fd181f7def1ba7932afc1ce5b5d517 +size 43320276 diff --git a/Plants/Q94I16/top.pdb b/Plants/Q94I16/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..19392ccb285d9f2d28933b372ceae172fa312fca --- /dev/null +++ b/Plants/Q94I16/top.pdb @@ -0,0 +1,238 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 292.695 264.909 162.723 1.00 0.00 C +ATOM 2 CA ILE A 2 291.295 266.423 159.520 1.00 0.00 C +ATOM 3 CA ARG A 3 287.711 265.715 158.439 1.00 0.00 C +ATOM 4 CA GLU A 4 284.985 263.090 157.996 1.00 0.00 C +ATOM 5 CA GLY A 5 282.339 260.596 156.857 1.00 0.00 C +ATOM 6 CA THR A 6 279.068 259.277 158.298 1.00 0.00 C +ATOM 7 CA PRO A 7 275.822 257.796 159.635 1.00 0.00 C +ATOM 8 CA GLU A 8 272.278 259.098 160.140 1.00 0.00 C +ATOM 9 CA GLY A 9 270.368 260.881 162.912 1.00 0.00 C +ATOM 10 CA GLY A 10 271.988 263.550 165.096 1.00 0.00 C +ATOM 11 CA LEU A 11 271.011 264.410 168.677 1.00 0.00 C +ATOM 12 CA ALA A 12 271.062 264.838 172.462 1.00 0.00 C +ATOM 13 CA GLY A 13 270.548 268.179 174.220 1.00 0.00 C +ATOM 14 CA THR A 14 269.588 271.070 176.508 1.00 0.00 C +ATOM 15 CA ALA A 15 272.412 272.693 178.485 1.00 0.00 C +ATOM 16 CA ASP A 16 274.945 274.788 176.557 1.00 0.00 C +ATOM 17 CA GLY A 17 278.188 275.488 174.686 1.00 0.00 C +ATOM 18 CA ARG A 18 279.116 278.723 172.899 1.00 0.00 C +ATOM 19 CA GLY A 19 278.582 281.762 170.664 1.00 0.00 C +ATOM 20 CA THR A 20 276.437 284.598 172.032 1.00 0.00 C +ATOM 21 CA ARG A 21 276.526 286.395 175.390 1.00 0.00 C +ATOM 22 CA PRO A 22 275.222 284.645 178.513 1.00 0.00 C +ATOM 23 CA ARG A 23 273.643 281.424 177.229 1.00 0.00 C +ATOM 24 CA PRO A 24 273.045 279.154 180.230 1.00 0.00 C +ATOM 25 CA ASP A 25 273.622 279.352 183.991 1.00 0.00 C +ATOM 26 CA GLY A 26 273.097 277.935 187.488 1.00 0.00 C +ATOM 27 CA HIS A 27 275.416 276.305 190.035 1.00 0.00 C +ATOM 28 CA ARG A 28 274.934 277.619 193.578 1.00 0.00 C +ATOM 29 CA ARG A 29 274.160 274.594 195.761 1.00 0.00 C +ATOM 30 CA ARG A 30 274.589 274.931 199.531 1.00 0.00 C +ATOM 31 CA PRO A 31 271.383 276.385 200.990 1.00 0.00 C +ATOM 32 CA PRO A 32 269.131 277.044 203.992 1.00 0.00 C +ATOM 33 CA ALA A 33 269.922 277.445 207.697 1.00 0.00 C +ATOM 34 CA ARG A 34 271.723 279.710 210.176 1.00 0.00 C +ATOM 35 CA ARG A 35 273.326 278.643 213.464 1.00 0.00 C +ATOM 36 CA SER A 36 274.275 280.349 216.735 1.00 0.00 C +ATOM 37 CA GLY A 37 272.636 280.424 220.174 1.00 0.00 C +ATOM 38 CA THR A 38 272.756 279.122 223.752 1.00 0.00 C +ATOM 39 CA ARG A 39 271.052 275.720 223.552 1.00 0.00 C +ATOM 40 CA GLU A 40 267.724 274.540 224.983 1.00 0.00 C +ATOM 41 CA ARG A 41 264.255 273.007 224.619 1.00 0.00 C +ATOM 42 CA GLY A 42 262.457 270.274 222.666 1.00 0.00 C +ATOM 43 CA GLY A 43 259.134 268.841 221.474 1.00 0.00 C +ATOM 44 CA LYS A 44 258.160 265.159 221.567 1.00 0.00 C +ATOM 45 CA GLY A 45 259.292 263.714 218.228 1.00 0.00 C +ATOM 46 CA GLU A 46 260.557 260.213 217.418 1.00 0.00 C +ATOM 47 CA ALA A 47 261.297 256.657 218.568 1.00 0.00 C +ATOM 48 CA ASN A 48 259.141 253.517 218.505 1.00 0.00 C +ATOM 49 CA GLY A 49 256.471 251.693 216.489 1.00 0.00 C +ATOM 50 CA THR A 50 254.028 248.775 216.306 1.00 0.00 C +ATOM 51 CA VAL A 51 250.314 248.453 217.090 1.00 0.00 C +ATOM 52 CA PHE A 52 248.333 245.286 216.340 1.00 0.00 C +ATOM 53 CA GLY A 53 247.053 242.611 213.947 1.00 0.00 C +ATOM 54 CA SER A 54 245.282 241.295 210.842 1.00 0.00 C +ATOM 55 CA PRO A 55 241.587 240.599 211.460 1.00 0.00 C +ATOM 56 CA ARG A 56 239.274 243.113 209.773 1.00 0.00 C +ATOM 57 CA SER A 57 239.819 246.810 209.032 1.00 0.00 C +ATOM 58 CA THR A 58 242.101 248.987 206.894 1.00 0.00 C +ATOM 59 CA ALA A 59 245.429 250.785 206.440 1.00 0.00 C +ATOM 60 CA THR A 60 248.953 250.396 207.835 1.00 0.00 C +ATOM 61 CA THR A 61 252.117 249.224 209.604 1.00 0.00 C +ATOM 62 CA GLY A 62 255.637 249.592 208.193 1.00 0.00 C +ATOM 63 CA THR A 63 257.715 246.403 208.036 1.00 0.00 C +ATOM 64 CA ALA A 64 260.308 245.336 210.616 1.00 0.00 C +ATOM 65 CA ALA A 65 263.110 244.502 213.059 1.00 0.00 C +ATOM 66 CA GLU A 66 263.009 244.990 216.836 1.00 0.00 C +ATOM 67 CA ALA A 67 262.163 246.909 220.017 1.00 0.00 C +ATOM 68 CA GLU A 68 261.987 246.407 223.789 1.00 0.00 C +ATOM 69 CA GLU A 69 259.436 244.052 225.357 1.00 0.00 C +ATOM 70 CA GLY A 70 257.307 241.026 224.446 1.00 0.00 C +ATOM 71 CA GLY A 71 257.498 237.297 225.202 1.00 0.00 C +ATOM 72 CA GLY A 72 256.826 235.016 222.225 1.00 0.00 C +ATOM 73 CA ALA A 73 256.676 233.224 218.866 1.00 0.00 C +ATOM 74 CA VAL A 74 258.658 235.464 216.505 1.00 0.00 C +ATOM 75 CA ARG A 75 257.513 238.475 214.470 1.00 0.00 C +ATOM 76 CA ASP A 76 253.956 238.956 213.192 1.00 0.00 C +ATOM 77 CA ASP A 77 251.265 238.711 215.878 1.00 0.00 C +ATOM 78 CA ASP A 78 249.542 238.368 219.258 1.00 0.00 C +ATOM 79 CA ASP A 79 246.001 238.565 220.652 1.00 0.00 C +ATOM 80 CA ASP A 80 242.839 240.113 222.107 1.00 0.00 C +ATOM 81 CA GLY A 81 242.278 243.732 223.160 1.00 0.00 C +ATOM 82 CA ALA A 82 239.362 246.157 223.524 1.00 0.00 C +ATOM 83 CA PRO A 83 236.178 247.385 221.830 1.00 0.00 C +ATOM 84 CA ALA A 84 235.060 250.675 223.393 1.00 0.00 C +ATOM 85 CA VAL A 85 238.170 252.517 224.595 1.00 0.00 C +ATOM 86 CA GLY A 86 238.421 252.390 228.395 1.00 0.00 C +ATOM 87 CA GLU A 87 235.196 252.548 230.419 1.00 0.00 C +ATOM 88 CA ARG A 88 235.840 251.359 233.981 1.00 0.00 C +ATOM 89 CA SER A 89 235.670 249.404 237.246 1.00 0.00 C +ATOM 90 CA GLU A 90 237.972 246.418 236.695 1.00 0.00 C +ATOM 91 CA GLY A 91 239.517 245.178 239.949 1.00 0.00 C +ATOM 92 CA ALA A 92 242.840 246.819 240.834 1.00 0.00 C +ATOM 93 CA ASP A 93 242.328 248.451 244.239 1.00 0.00 C +ATOM 94 CA GLY A 94 242.154 248.911 248.017 1.00 0.00 C +ATOM 95 CA VAL A 95 245.498 248.560 249.809 1.00 0.00 C +ATOM 96 CA GLY A 96 247.852 247.220 252.488 1.00 0.00 C +ATOM 97 CA ASP A 97 251.199 248.128 254.065 1.00 0.00 C +ATOM 98 CA ASN A 98 250.988 251.614 255.587 1.00 0.00 C +ATOM 99 CA ALA A 99 250.414 253.778 258.670 1.00 0.00 C +ATOM 100 CA ALA A 100 252.730 254.796 261.519 1.00 0.00 C +ATOM 101 CA LYS A 101 251.531 254.614 265.130 1.00 0.00 C +ATOM 102 CA PRO A 102 250.347 258.076 266.192 1.00 0.00 C +ATOM 103 CA MET A 103 250.766 260.652 268.968 1.00 0.00 C +ATOM 104 CA GLU A 104 253.979 260.183 270.962 1.00 0.00 C +ATOM 105 CA VAL A 105 256.521 262.928 270.242 1.00 0.00 C +ATOM 106 CA ALA A 106 256.302 266.728 270.422 1.00 0.00 C +ATOM 107 CA PRO A 107 256.729 270.498 270.080 1.00 0.00 C +ATOM 108 CA SER A 108 254.127 272.063 267.779 1.00 0.00 C +ATOM 109 CA ARG A 109 255.865 272.423 264.407 1.00 0.00 C +ATOM 110 CA GLU A 110 255.908 269.126 262.498 1.00 0.00 C +ATOM 111 CA GLU A 111 256.711 265.402 262.432 1.00 0.00 C +ATOM 112 CA ASP A 112 259.109 263.503 264.704 1.00 0.00 C +ATOM 113 CA ARG A 113 261.582 261.842 267.080 1.00 0.00 C +ATOM 114 CA SER A 114 262.541 258.404 265.748 1.00 0.00 C +ATOM 115 CA ASP A 115 260.969 256.713 262.717 1.00 0.00 C +ATOM 116 CA ASP A 116 262.163 253.248 261.673 1.00 0.00 C +ATOM 117 CA GLY A 117 265.956 253.233 261.314 1.00 0.00 C +ATOM 118 CA GLY A 118 267.709 251.301 264.090 1.00 0.00 C +ATOM 119 CA GLU A 119 266.359 247.934 265.256 1.00 0.00 C +ATOM 120 CA THR A 120 264.270 245.759 267.584 1.00 0.00 C +ATOM 121 CA GLU A 121 261.475 243.935 265.746 1.00 0.00 C +ATOM 122 CA LEU A 122 260.106 241.325 268.161 1.00 0.00 C +ATOM 123 CA GLY A 123 261.867 239.079 270.684 1.00 0.00 C +ATOM 124 CA GLY A 124 263.381 235.716 269.728 1.00 0.00 C +ATOM 125 CA ASP A 125 263.765 232.822 267.279 1.00 0.00 C +ATOM 126 CA GLY A 126 262.981 229.190 268.119 1.00 0.00 C +ATOM 127 CA GLY A 127 261.462 225.710 267.802 1.00 0.00 C +ATOM 128 CA GLU A 128 259.435 224.481 264.820 1.00 0.00 C +ATOM 129 CA ARG A 129 258.490 221.132 263.267 1.00 0.00 C +ATOM 130 CA GLY A 130 258.993 217.536 262.112 1.00 0.00 C +ATOM 131 CA ALA A 131 258.989 213.852 261.141 1.00 0.00 C +ATOM 132 CA ARG A 132 261.972 211.878 259.831 1.00 0.00 C +ATOM 133 CA ARG A 133 261.437 208.151 259.252 1.00 0.00 C +ATOM 134 CA GLU A 134 257.866 206.848 259.512 1.00 0.00 C +ATOM 135 CA LEU A 135 256.078 203.622 258.556 1.00 0.00 C +ATOM 136 CA ASP A 136 253.100 203.377 256.193 1.00 0.00 C +ATOM 137 CA SER A 137 251.946 199.746 256.195 1.00 0.00 C +ATOM 138 CA ASP A 138 249.371 197.920 258.328 1.00 0.00 C +ATOM 139 CA GLY A 139 250.154 197.997 262.056 1.00 0.00 C +ATOM 140 CA GLU A 140 251.725 200.853 264.029 1.00 0.00 C +ATOM 141 CA SER A 141 251.747 203.795 266.449 1.00 0.00 C +ATOM 142 CA GLU A 142 253.988 206.696 265.411 1.00 0.00 C +ATOM 143 CA ARG A 143 257.203 206.457 267.441 1.00 0.00 C +ATOM 144 CA ARG A 144 258.291 209.042 270.020 1.00 0.00 C +ATOM 145 CA ALA A 145 255.657 211.776 270.336 1.00 0.00 C +ATOM 146 CA ALA A 146 254.473 214.011 273.186 1.00 0.00 C +ATOM 147 CA GLU A 147 254.947 214.980 276.840 1.00 0.00 C +ATOM 148 CA THR A 148 258.418 216.218 277.805 1.00 0.00 C +ATOM 149 CA GLU A 149 261.348 218.628 277.451 1.00 0.00 C +ATOM 150 CA GLU A 150 259.950 222.160 277.161 1.00 0.00 C +ATOM 151 CA ARG A 151 260.365 225.438 275.263 1.00 0.00 C +ATOM 152 CA SER A 152 257.776 227.245 273.131 1.00 0.00 C +ATOM 153 CA THR A 153 256.543 229.558 270.366 1.00 0.00 C +ATOM 154 CA GLY A 154 253.501 231.852 270.360 1.00 0.00 C +ATOM 155 CA ASP A 155 250.588 234.093 269.356 1.00 0.00 C +ATOM 156 CA ASP A 156 247.280 235.069 270.976 1.00 0.00 C +ATOM 157 CA PHE A 157 243.502 234.787 271.380 1.00 0.00 C +ATOM 158 CA ILE A 158 240.603 234.966 268.914 1.00 0.00 C +ATOM 159 CA ALA A 159 239.502 238.603 268.634 1.00 0.00 C +ATOM 160 CA SER A 160 238.979 242.320 269.285 1.00 0.00 C +ATOM 161 CA GLY A 161 237.060 244.963 267.323 1.00 0.00 C +ATOM 162 CA GLY A 162 239.277 246.529 264.649 1.00 0.00 C +ATOM 163 CA ARG A 163 238.530 246.549 260.913 1.00 0.00 C +ATOM 164 CA GLU A 164 234.924 246.075 259.777 1.00 0.00 C +ATOM 165 CA GLY A 165 232.199 245.162 262.278 1.00 0.00 C +ATOM 166 CA GLY A 166 228.777 246.050 260.857 1.00 0.00 C +ATOM 167 CA ARG A 167 227.690 249.489 262.084 1.00 0.00 C +ATOM 168 CA ARG A 168 227.828 253.161 263.093 1.00 0.00 C +ATOM 169 CA GLU A 169 227.523 255.209 259.895 1.00 0.00 C +ATOM 170 CA ARG A 170 229.313 258.571 259.987 1.00 0.00 C +ATOM 171 CA LYS A 171 229.008 262.238 258.997 1.00 0.00 C +ATOM 172 CA PRO A 172 231.712 264.891 259.405 1.00 0.00 C +ATOM 173 CA ALA A 173 233.814 263.947 262.439 1.00 0.00 C +ATOM 174 CA VAL A 174 232.714 263.814 266.085 1.00 0.00 C +ATOM 175 CA GLU A 175 230.012 261.167 266.539 1.00 0.00 C +ATOM 176 CA PHE A 176 226.219 261.484 266.725 1.00 0.00 C +ATOM 177 CA SER A 177 222.492 260.842 266.267 1.00 0.00 C +ATOM 178 CA GLY A 178 220.219 258.148 264.821 1.00 0.00 C +ATOM 179 CA SER A 179 219.624 254.401 264.466 1.00 0.00 C +ATOM 180 CA ILE A 180 220.351 250.665 264.293 1.00 0.00 C +ATOM 181 CA ASP A 181 220.728 247.464 266.324 1.00 0.00 C +ATOM 182 CA ALA A 182 220.720 245.702 269.702 1.00 0.00 C +ATOM 183 CA PRO A 183 222.537 243.876 272.510 1.00 0.00 C +ATOM 184 CA ALA A 184 223.048 240.325 273.792 1.00 0.00 C +ATOM 185 CA GLU A 185 226.289 239.037 275.326 1.00 0.00 C +ATOM 186 CA ILE A 186 225.865 237.133 278.599 1.00 0.00 C +ATOM 187 CA ALA A 187 226.866 239.557 281.363 1.00 0.00 C +ATOM 188 CA GLY A 188 227.991 240.619 284.844 1.00 0.00 C +ATOM 189 CA PHE A 189 227.443 241.001 288.595 1.00 0.00 C +ATOM 190 CA LYS A 190 230.116 242.839 290.593 1.00 0.00 C +ATOM 191 CA SER A 191 233.879 242.307 290.866 1.00 0.00 C +ATOM 192 CA ASP A 192 236.161 244.773 292.662 1.00 0.00 C +ATOM 193 CA GLU A 193 239.238 246.296 294.314 1.00 0.00 C +ATOM 194 CA SER A 194 241.530 249.220 295.159 1.00 0.00 C +ATOM 195 CA GLU A 195 242.049 251.344 298.279 1.00 0.00 C +ATOM 196 CA GLY A 196 245.823 251.732 298.636 1.00 0.00 C +ATOM 197 CA GLU A 197 247.484 253.602 301.510 1.00 0.00 C +ATOM 198 CA ARG A 198 251.016 254.459 302.652 1.00 0.00 C +ATOM 199 CA GLU A 199 254.387 255.756 301.439 1.00 0.00 C +ATOM 200 CA GLY A 200 258.000 256.545 300.523 1.00 0.00 C +ATOM 201 CA LYS A 201 259.511 259.649 298.911 1.00 0.00 C +ATOM 202 CA ALA A 202 261.579 261.968 296.706 1.00 0.00 C +ATOM 203 CA GLY A 203 260.287 265.387 295.629 1.00 0.00 C +ATOM 204 CA GLU A 204 257.624 267.868 294.502 1.00 0.00 C +ATOM 205 CA THR A 205 254.254 266.117 294.202 1.00 0.00 C +ATOM 206 CA GLY A 206 250.908 264.786 292.960 1.00 0.00 C +ATOM 207 CA GLU A 207 247.714 264.031 294.895 1.00 0.00 C +ATOM 208 CA GLY A 208 243.968 263.333 294.930 1.00 0.00 C +ATOM 209 CA ILE A 209 241.937 260.514 296.494 1.00 0.00 C +ATOM 210 CA ALA A 210 243.272 257.491 298.388 1.00 0.00 C +ATOM 211 CA GLY A 211 240.625 256.732 301.021 1.00 0.00 C +ATOM 212 CA SER A 212 238.289 255.917 303.919 1.00 0.00 C +ATOM 213 CA ASN A 213 234.529 256.301 304.396 1.00 0.00 C +ATOM 214 CA SER A 214 231.022 257.744 304.770 1.00 0.00 C +ATOM 215 CA PRO A 215 227.486 256.443 305.332 1.00 0.00 C +ATOM 216 CA LEU A 216 224.841 253.759 305.896 1.00 0.00 C +ATOM 217 CA PHE A 217 222.079 254.898 308.261 1.00 0.00 C +ATOM 218 CA MET A 218 218.961 253.196 309.639 1.00 0.00 C +ATOM 219 CA ALA A 219 216.107 254.566 311.759 1.00 0.00 C +ATOM 220 CA ARG A 220 213.277 257.117 311.758 1.00 0.00 C +ATOM 221 CA GLY A 221 211.048 256.073 314.666 1.00 0.00 C +ATOM 222 CA GLU A 222 213.108 256.236 317.867 1.00 0.00 C +ATOM 223 CA GLY A 223 214.215 254.842 321.236 1.00 0.00 C +ATOM 224 CA GLY A 224 215.203 251.745 323.223 1.00 0.00 C +ATOM 225 CA MET A 225 215.112 248.286 324.817 1.00 0.00 C +ATOM 226 CA ARG A 226 216.515 248.457 328.355 1.00 0.00 C +ATOM 227 CA ARG A 227 217.472 247.752 331.975 1.00 0.00 C +ATOM 228 CA ILE A 228 218.674 246.734 335.444 1.00 0.00 C +ATOM 229 CA ARG A 229 218.532 247.004 339.242 1.00 0.00 C +ATOM 230 CA ARG A 230 220.359 244.736 341.698 1.00 0.00 C +ATOM 231 CA ARG A 231 218.373 241.954 343.382 1.00 0.00 C +ATOM 232 CA ARG A 232 216.460 238.763 344.200 1.00 0.00 C +ATOM 233 CA ARG A 233 212.979 239.316 345.648 1.00 0.00 C +ATOM 234 CA ARG A 234 209.737 237.373 345.162 1.00 0.00 C +TER 235 ARG A 234 +END diff --git a/Plants/Q94IP2/Q94IP2.dcd b/Plants/Q94IP2/Q94IP2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..22d98159cfdd35024090e39ea8f7923f5386afe9 --- /dev/null +++ b/Plants/Q94IP2/Q94IP2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:db4b56e2e5017cb4f0923248e5b95323202044c64ce0be172e50f68923379ef8 +size 4640276 diff --git a/Plants/Q94IP2/top.pdb b/Plants/Q94IP2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..64fbb51a7d7bba91bad0f71ca2363a7320a897b6 --- /dev/null +++ b/Plants/Q94IP2/top.pdb @@ -0,0 +1,36 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 237.238 256.997 259.378 1.00 0.00 C +ATOM 2 CA ALA A 2 239.200 254.352 261.294 1.00 0.00 C +ATOM 3 CA SER A 3 241.789 252.604 263.475 1.00 0.00 C +ATOM 4 CA THR A 4 245.269 254.152 263.362 1.00 0.00 C +ATOM 5 CA LEU A 5 247.443 257.111 264.381 1.00 0.00 C +ATOM 6 CA LYS A 6 250.360 258.107 262.142 1.00 0.00 C +ATOM 7 CA ASP A 7 253.147 260.273 263.576 1.00 0.00 C +ATOM 8 CA GLY A 8 255.857 260.948 260.985 1.00 0.00 C +ATOM 9 CA GLU A 9 254.157 262.506 257.952 1.00 0.00 C +ATOM 10 CA SER A 10 250.895 263.700 256.387 1.00 0.00 C +ATOM 11 CA VAL A 11 247.997 261.589 255.097 1.00 0.00 C +ATOM 12 CA VAL A 12 247.204 259.060 252.360 1.00 0.00 C +ATOM 13 CA ASP A 13 248.577 258.202 248.911 1.00 0.00 C +ATOM 14 CA GLN A 14 247.598 260.058 245.732 1.00 0.00 C +ATOM 15 CA SER A 15 244.088 259.124 244.580 1.00 0.00 C +ATOM 16 CA SER A 16 242.698 255.733 243.540 1.00 0.00 C +ATOM 17 CA ALA A 17 243.433 252.159 244.639 1.00 0.00 C +ATOM 18 CA VAL A 18 244.580 248.548 244.241 1.00 0.00 C +ATOM 19 CA GLY A 19 246.493 248.372 240.950 1.00 0.00 C +ATOM 20 CA GLY A 20 245.188 245.609 238.675 1.00 0.00 C +ATOM 21 CA GLY A 21 246.774 242.427 240.046 1.00 0.00 C +ATOM 22 CA VAL A 22 246.165 241.328 243.643 1.00 0.00 C +ATOM 23 CA ASP A 23 245.021 237.702 243.880 1.00 0.00 C +ATOM 24 CA ASP A 24 246.482 235.580 246.687 1.00 0.00 C +ATOM 25 CA VAL A 25 249.725 237.256 247.779 1.00 0.00 C +ATOM 26 CA TYR A 26 253.232 237.915 246.446 1.00 0.00 C +ATOM 27 CA GLY A 27 255.217 241.167 246.426 1.00 0.00 C +ATOM 28 CA ASP A 28 258.357 240.567 244.353 1.00 0.00 C +ATOM 29 CA ASP A 29 261.310 238.740 242.785 1.00 0.00 C +ATOM 30 CA ARG A 30 264.916 239.757 242.092 1.00 0.00 C +ATOM 31 CA ALA A 31 268.612 240.659 242.297 1.00 0.00 C +ATOM 32 CA SER A 32 270.977 237.697 241.910 1.00 0.00 C +TER 33 SER A 32 +END diff --git a/Plants/Q94IQ8/Q94IQ8.dcd b/Plants/Q94IQ8/Q94IQ8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..0d09d27b2dc12156575b3920ad8c308c4dddc918 --- /dev/null +++ b/Plants/Q94IQ8/Q94IQ8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5a62e9322081f5c296d40d24f1efeba58924bdd2f8ba2b55b3995830a149ffbf +size 104320276 diff --git a/Plants/Q94IQ8/top.pdb b/Plants/Q94IQ8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..e8e65005a3dcab5a034eb2ebc8a47c001377221c --- /dev/null +++ b/Plants/Q94IQ8/top.pdb @@ -0,0 +1,432 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 1050.000 1050.000 1050.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 485.895 525.665 517.925 1.00 0.00 C +ATOM 2 CA PRO A 2 489.237 524.936 516.247 1.00 0.00 C +ATOM 3 CA ALA A 3 491.984 527.524 516.768 1.00 0.00 C +ATOM 4 CA PRO A 4 495.173 527.677 514.688 1.00 0.00 C +ATOM 5 CA ASP A 5 496.345 531.294 514.923 1.00 0.00 C +ATOM 6 CA GLY A 6 499.950 532.429 515.411 1.00 0.00 C +ATOM 7 CA TRP A 7 503.072 530.305 515.916 1.00 0.00 C +ATOM 8 CA THR A 8 502.076 526.730 515.051 1.00 0.00 C +ATOM 9 CA LYS A 9 502.894 523.433 513.326 1.00 0.00 C +ATOM 10 CA LYS A 10 504.188 521.772 510.151 1.00 0.00 C +ATOM 11 CA PHE A 11 506.462 522.113 507.113 1.00 0.00 C +ATOM 12 CA THR A 12 508.009 521.606 503.668 1.00 0.00 C +ATOM 13 CA PRO A 13 510.245 518.550 503.251 1.00 0.00 C +ATOM 14 CA GLN A 14 511.342 514.915 503.575 1.00 0.00 C +ATOM 15 CA ARG A 15 512.306 511.898 505.692 1.00 0.00 C +ATOM 16 CA GLY A 16 512.640 510.820 509.331 1.00 0.00 C +ATOM 17 CA GLY A 17 513.555 511.655 512.934 1.00 0.00 C +ATOM 18 CA ARG A 18 515.178 513.347 515.937 1.00 0.00 C +ATOM 19 CA SER A 19 516.849 516.771 515.908 1.00 0.00 C +ATOM 20 CA GLU A 20 517.441 517.712 512.264 1.00 0.00 C +ATOM 21 CA ILE A 21 519.291 520.112 509.953 1.00 0.00 C +ATOM 22 CA VAL A 22 522.124 522.625 510.365 1.00 0.00 C +ATOM 23 CA PHE A 23 523.618 524.788 513.124 1.00 0.00 C +ATOM 24 CA VAL A 24 523.471 528.593 513.223 1.00 0.00 C +ATOM 25 CA SER A 25 523.689 531.520 515.653 1.00 0.00 C +ATOM 26 CA PRO A 26 524.032 530.542 519.319 1.00 0.00 C +ATOM 27 CA THR A 27 523.950 533.299 521.948 1.00 0.00 C +ATOM 28 CA GLY A 28 526.039 536.460 522.344 1.00 0.00 C +ATOM 29 CA GLU A 29 527.068 539.955 521.229 1.00 0.00 C +ATOM 30 CA GLU A 30 527.497 542.746 518.671 1.00 0.00 C +ATOM 31 CA ILE A 31 528.222 545.145 515.801 1.00 0.00 C +ATOM 32 CA LYS A 32 528.621 544.626 512.048 1.00 0.00 C +ATOM 33 CA ASN A 33 528.172 545.650 508.406 1.00 0.00 C +ATOM 34 CA LYS A 34 527.604 544.956 504.703 1.00 0.00 C +ATOM 35 CA ARG A 35 530.756 545.184 502.575 1.00 0.00 C +ATOM 36 CA GLN A 36 534.035 545.973 504.348 1.00 0.00 C +ATOM 37 CA LEU A 37 535.230 545.586 507.945 1.00 0.00 C +ATOM 38 CA SER A 38 536.665 546.585 511.330 1.00 0.00 C +ATOM 39 CA GLN A 39 536.341 545.147 514.843 1.00 0.00 C +ATOM 40 CA TYR A 40 534.016 542.370 516.025 1.00 0.00 C +ATOM 41 CA LEU A 41 533.768 539.796 513.227 1.00 0.00 C +ATOM 42 CA LYS A 42 532.544 538.497 509.861 1.00 0.00 C +ATOM 43 CA ALA A 43 528.839 537.734 509.402 1.00 0.00 C +ATOM 44 CA HIS A 44 528.459 534.068 510.369 1.00 0.00 C +ATOM 45 CA PRO A 45 530.004 531.684 507.831 1.00 0.00 C +ATOM 46 CA GLY A 46 533.262 532.944 506.311 1.00 0.00 C +ATOM 47 CA GLY A 47 535.791 533.870 503.616 1.00 0.00 C +ATOM 48 CA PRO A 48 534.021 533.039 500.346 1.00 0.00 C +ATOM 49 CA ALA A 49 533.319 531.840 496.799 1.00 0.00 C +ATOM 50 CA ALA A 50 535.198 530.072 493.995 1.00 0.00 C +ATOM 51 CA SER A 51 532.868 530.137 490.981 1.00 0.00 C +ATOM 52 CA ASP A 52 530.007 532.649 491.120 1.00 0.00 C +ATOM 53 CA PHE A 53 526.917 534.713 491.963 1.00 0.00 C +ATOM 54 CA ASP A 54 526.656 537.609 489.501 1.00 0.00 C +ATOM 55 CA TRP A 55 527.846 541.222 489.712 1.00 0.00 C +ATOM 56 CA GLY A 56 526.862 542.316 493.226 1.00 0.00 C +ATOM 57 CA THR A 57 526.221 544.766 496.072 1.00 0.00 C +ATOM 58 CA GLY A 58 524.640 546.969 498.749 1.00 0.00 C +ATOM 59 CA ASP A 59 523.923 550.711 498.712 1.00 0.00 C +ATOM 60 CA THR A 60 524.018 552.646 495.431 1.00 0.00 C +ATOM 61 CA PRO A 61 522.986 556.156 494.369 1.00 0.00 C +ATOM 62 CA ARG A 62 520.699 559.113 495.106 1.00 0.00 C +ATOM 63 CA ARG A 63 517.935 558.170 497.552 1.00 0.00 C +ATOM 64 CA SER A 64 515.756 558.522 500.658 1.00 0.00 C +ATOM 65 CA ALA A 65 513.390 561.410 501.416 1.00 0.00 C +ATOM 66 CA ARG A 66 510.318 561.016 503.635 1.00 0.00 C +ATOM 67 CA ILE A 67 507.325 563.351 503.305 1.00 0.00 C +ATOM 68 CA SER A 68 504.927 561.782 500.795 1.00 0.00 C +ATOM 69 CA GLU A 69 506.602 561.340 497.401 1.00 0.00 C +ATOM 70 CA LYS A 70 507.268 562.283 493.771 1.00 0.00 C +ATOM 71 CA VAL A 71 507.780 565.403 491.644 1.00 0.00 C +ATOM 72 CA LYS A 72 508.142 569.175 491.247 1.00 0.00 C +ATOM 73 CA VAL A 73 510.784 571.834 490.565 1.00 0.00 C +ATOM 74 CA PHE A 74 513.122 573.771 492.866 1.00 0.00 C +ATOM 75 CA ASP A 75 514.571 577.169 493.797 1.00 0.00 C +ATOM 76 CA SER A 76 518.113 577.803 495.050 1.00 0.00 C +ATOM 77 CA PRO A 77 517.734 580.109 498.059 1.00 0.00 C +ATOM 78 CA GLU A 78 520.778 582.313 498.683 1.00 0.00 C +ATOM 79 CA GLY A 79 523.172 584.655 496.868 1.00 0.00 C +ATOM 80 CA GLU A 80 524.329 582.864 493.710 1.00 0.00 C +ATOM 81 CA LYS A 81 525.125 582.092 490.065 1.00 0.00 C +ATOM 82 CA ILE A 82 525.636 579.111 487.748 1.00 0.00 C +ATOM 83 CA PRO A 83 522.956 577.409 485.643 1.00 0.00 C +ATOM 84 CA LYS A 84 520.102 575.902 483.618 1.00 0.00 C +ATOM 85 CA ARG A 85 521.206 573.818 480.626 1.00 0.00 C +ATOM 86 CA SER A 86 523.893 571.214 479.909 1.00 0.00 C +ATOM 87 CA ARG A 87 523.688 567.559 478.851 1.00 0.00 C +ATOM 88 CA ASN A 88 526.401 565.794 476.841 1.00 0.00 C +ATOM 89 CA SER A 89 527.928 565.823 473.351 1.00 0.00 C +ATOM 90 CA SER A 90 527.172 563.885 470.158 1.00 0.00 C +ATOM 91 CA GLY A 91 527.162 562.055 466.817 1.00 0.00 C +ATOM 92 CA ARG A 92 524.502 559.328 466.742 1.00 0.00 C +ATOM 93 CA LYS A 93 523.227 555.738 466.800 1.00 0.00 C +ATOM 94 CA GLY A 94 524.140 554.026 463.522 1.00 0.00 C +ATOM 95 CA ARG A 95 523.444 550.347 462.814 1.00 0.00 C +ATOM 96 CA GLN A 96 523.219 547.320 460.511 1.00 0.00 C +ATOM 97 CA GLY A 97 520.574 544.763 461.501 1.00 0.00 C +ATOM 98 CA LYS A 98 521.297 541.039 461.851 1.00 0.00 C +ATOM 99 CA LYS A 99 523.896 538.780 460.220 1.00 0.00 C +ATOM 100 CA GLU A 100 526.995 536.885 461.369 1.00 0.00 C +ATOM 101 CA ALA A 101 530.460 538.211 460.504 1.00 0.00 C +ATOM 102 CA PRO A 102 534.219 538.684 460.102 1.00 0.00 C +ATOM 103 CA GLU A 103 537.146 536.254 459.893 1.00 0.00 C +ATOM 104 CA THR A 104 539.381 534.156 462.156 1.00 0.00 C +ATOM 105 CA GLU A 105 538.345 533.871 465.812 1.00 0.00 C +ATOM 106 CA GLU A 106 540.522 535.516 468.471 1.00 0.00 C +ATOM 107 CA ALA A 107 544.293 534.990 468.338 1.00 0.00 C +ATOM 108 CA LYS A 108 545.982 536.865 471.193 1.00 0.00 C +ATOM 109 CA ASP A 109 543.180 537.710 473.633 1.00 0.00 C +ATOM 110 CA ALA A 110 544.818 539.429 476.612 1.00 0.00 C +ATOM 111 CA GLU A 111 546.494 542.665 475.502 1.00 0.00 C +ATOM 112 CA THR A 112 549.357 543.963 477.655 1.00 0.00 C +ATOM 113 CA GLY A 113 551.236 547.273 477.815 1.00 0.00 C +ATOM 114 CA GLN A 114 550.351 550.957 478.215 1.00 0.00 C +ATOM 115 CA ASP A 115 547.800 552.328 480.692 1.00 0.00 C +ATOM 116 CA ALA A 116 544.034 552.363 481.265 1.00 0.00 C +ATOM 117 CA PRO A 117 542.360 555.402 479.691 1.00 0.00 C +ATOM 118 CA SER A 118 538.678 555.802 480.582 1.00 0.00 C +ATOM 119 CA GLU A 119 534.989 555.154 481.281 1.00 0.00 C +ATOM 120 CA ASP A 120 534.012 551.904 483.014 1.00 0.00 C +ATOM 121 CA GLY A 121 531.942 549.663 485.296 1.00 0.00 C +ATOM 122 CA THR A 122 532.869 546.636 487.417 1.00 0.00 C +ATOM 123 CA LYS A 123 534.258 543.867 485.199 1.00 0.00 C +ATOM 124 CA GLU A 124 534.252 542.934 481.505 1.00 0.00 C +ATOM 125 CA THR A 125 536.273 540.280 479.665 1.00 0.00 C +ATOM 126 CA ASP A 126 538.097 537.894 477.321 1.00 0.00 C +ATOM 127 CA VAL A 127 537.365 534.232 478.077 1.00 0.00 C +ATOM 128 CA GLU A 128 536.169 531.113 479.908 1.00 0.00 C +ATOM 129 CA MET A 129 536.958 527.556 478.791 1.00 0.00 C +ATOM 130 CA LYS A 130 540.698 527.059 478.264 1.00 0.00 C +ATOM 131 CA PRO A 131 543.725 526.003 480.323 1.00 0.00 C +ATOM 132 CA ALA A 132 546.851 524.308 478.955 1.00 0.00 C +ATOM 133 CA GLU A 133 547.870 521.433 481.237 1.00 0.00 C +ATOM 134 CA GLU A 134 549.937 522.666 484.191 1.00 0.00 C +ATOM 135 CA ALA A 135 552.443 521.630 486.867 1.00 0.00 C +ATOM 136 CA LYS A 136 551.228 521.301 490.462 1.00 0.00 C +ATOM 137 CA GLU A 137 552.647 523.066 493.526 1.00 0.00 C +ATOM 138 CA ALA A 138 555.386 523.819 496.065 1.00 0.00 C +ATOM 139 CA PRO A 139 555.629 526.767 498.467 1.00 0.00 C +ATOM 140 CA THR A 140 553.210 528.916 500.478 1.00 0.00 C +ATOM 141 CA GLU A 141 550.007 530.560 499.232 1.00 0.00 C +ATOM 142 CA THR A 142 548.820 533.657 497.358 1.00 0.00 C +ATOM 143 CA ASP A 143 546.164 535.246 495.136 1.00 0.00 C +ATOM 144 CA ASP A 144 544.009 537.966 493.564 1.00 0.00 C +ATOM 145 CA ALA A 145 541.735 540.945 494.252 1.00 0.00 C +ATOM 146 CA GLU A 146 541.600 543.588 491.511 1.00 0.00 C +ATOM 147 CA LYS A 147 541.226 544.128 487.758 1.00 0.00 C +ATOM 148 CA ALA A 148 540.966 547.892 487.231 1.00 0.00 C +ATOM 149 CA ALA A 149 541.032 551.696 487.027 1.00 0.00 C +ATOM 150 CA ASP A 150 539.615 554.599 489.049 1.00 0.00 C +ATOM 151 CA LYS A 151 539.197 558.075 490.552 1.00 0.00 C +ATOM 152 CA ALA A 152 538.858 561.831 490.013 1.00 0.00 C +ATOM 153 CA ASP A 153 539.828 565.332 491.162 1.00 0.00 C +ATOM 154 CA ASP A 154 536.564 567.293 491.033 1.00 0.00 C +ATOM 155 CA THR A 155 533.808 567.035 493.651 1.00 0.00 C +ATOM 156 CA PRO A 156 532.971 563.758 495.406 1.00 0.00 C +ATOM 157 CA ALA A 157 529.405 562.932 496.465 1.00 0.00 C +ATOM 158 CA PRO A 158 527.589 562.578 499.796 1.00 0.00 C +ATOM 159 CA ALA A 159 528.116 559.790 502.339 1.00 0.00 C +ATOM 160 CA PRO A 160 527.335 557.148 504.972 1.00 0.00 C +ATOM 161 CA MET A 161 525.594 554.008 503.697 1.00 0.00 C +ATOM 162 CA GLU A 162 522.865 551.532 504.665 1.00 0.00 C +ATOM 163 CA GLU A 163 519.846 552.330 506.848 1.00 0.00 C +ATOM 164 CA ASP A 164 516.211 552.301 507.988 1.00 0.00 C +ATOM 165 CA GLU A 165 513.775 551.591 505.146 1.00 0.00 C +ATOM 166 CA LYS A 166 510.591 549.521 505.440 1.00 0.00 C +ATOM 167 CA GLU A 167 509.461 549.603 509.078 1.00 0.00 C +ATOM 168 CA THR A 168 508.213 546.892 511.446 1.00 0.00 C +ATOM 169 CA GLU A 169 506.517 545.153 514.382 1.00 0.00 C +ATOM 170 CA LYS A 170 504.776 542.902 516.915 1.00 0.00 C +ATOM 171 CA PRO A 171 506.533 539.942 518.548 1.00 0.00 C +ATOM 172 CA ALA A 172 508.256 536.843 519.941 1.00 0.00 C +ATOM 173 CA GLU A 173 507.029 533.313 520.685 1.00 0.00 C +ATOM 174 CA ALA A 174 503.587 532.510 522.106 1.00 0.00 C +ATOM 175 CA VAL A 175 500.301 530.618 521.733 1.00 0.00 C +ATOM 176 CA VAL A 176 496.997 528.721 521.782 1.00 0.00 C +ATOM 177 CA ALA A 177 494.077 531.161 521.953 1.00 0.00 C +ATOM 178 CA PRO A 178 493.997 534.782 523.137 1.00 0.00 C +ATOM 179 CA LEU A 179 493.605 536.316 526.602 1.00 0.00 C +ATOM 180 CA ALA A 180 493.508 534.921 530.146 1.00 0.00 C +ATOM 181 CA GLN A 181 491.361 534.382 533.247 1.00 0.00 C +ATOM 182 CA SER A 182 490.286 532.835 536.559 1.00 0.00 C +ATOM 183 CA GLU A 183 492.466 530.777 538.910 1.00 0.00 C +ATOM 184 CA GLU A 184 495.936 530.053 537.513 1.00 0.00 C +ATOM 185 CA LYS A 185 499.007 532.181 538.260 1.00 0.00 C +ATOM 186 CA LYS A 186 498.406 533.600 541.744 1.00 0.00 C +ATOM 187 CA GLU A 187 497.741 531.199 544.627 1.00 0.00 C +ATOM 188 CA ASP A 188 499.734 531.803 547.817 1.00 0.00 C +ATOM 189 CA ALA A 189 497.446 532.877 550.668 1.00 0.00 C +ATOM 190 CA LYS A 190 498.185 532.336 554.366 1.00 0.00 C +ATOM 191 CA PRO A 191 496.471 531.483 557.660 1.00 0.00 C +ATOM 192 CA ASP A 192 493.451 531.717 559.972 1.00 0.00 C +ATOM 193 CA GLU A 193 490.582 534.207 560.259 1.00 0.00 C +ATOM 194 CA PRO A 194 491.112 537.847 559.265 1.00 0.00 C +ATOM 195 CA GLU A 195 494.331 537.930 557.229 1.00 0.00 C +ATOM 196 CA ALA A 196 496.142 541.131 556.236 1.00 0.00 C +ATOM 197 CA VAL A 197 498.224 543.001 558.821 1.00 0.00 C +ATOM 198 CA ALA A 198 497.129 546.503 559.847 1.00 0.00 C +ATOM 199 CA PRO A 199 498.293 549.041 562.439 1.00 0.00 C +ATOM 200 CA ALA A 200 500.608 551.645 560.897 1.00 0.00 C +ATOM 201 CA PRO A 201 502.290 553.407 563.826 1.00 0.00 C +ATOM 202 CA VAL A 202 500.860 552.246 567.161 1.00 0.00 C +ATOM 203 CA SER A 203 500.475 548.992 569.105 1.00 0.00 C +ATOM 204 CA ASN A 204 499.702 546.437 571.824 1.00 0.00 C +ATOM 205 CA PRO A 205 499.496 542.645 572.131 1.00 0.00 C +ATOM 206 CA THR A 206 502.859 541.072 571.272 1.00 0.00 C +ATOM 207 CA GLU A 207 503.136 539.336 567.892 1.00 0.00 C +ATOM 208 CA ASN A 208 504.870 537.503 565.037 1.00 0.00 C +ATOM 209 CA SER A 209 508.455 537.932 563.822 1.00 0.00 C +ATOM 210 CA ALA A 210 512.235 538.346 564.053 1.00 0.00 C +ATOM 211 CA PRO A 211 515.045 535.773 564.037 1.00 0.00 C +ATOM 212 CA ALA A 212 516.743 534.848 560.754 1.00 0.00 C +ATOM 213 CA PRO A 213 515.772 532.075 558.329 1.00 0.00 C +ATOM 214 CA ALA A 214 512.720 531.581 556.101 1.00 0.00 C +ATOM 215 CA GLU A 215 512.490 528.388 554.035 1.00 0.00 C +ATOM 216 CA PRO A 216 512.773 524.657 554.757 1.00 0.00 C +ATOM 217 CA ALA A 217 515.655 523.862 557.117 1.00 0.00 C +ATOM 218 CA ALA A 218 518.519 521.350 557.031 1.00 0.00 C +ATOM 219 CA VAL A 219 518.163 517.605 557.637 1.00 0.00 C +ATOM 220 CA PRO A 220 518.521 513.952 558.657 1.00 0.00 C +ATOM 221 CA ALA A 221 516.077 511.202 559.649 1.00 0.00 C +ATOM 222 CA PRO A 222 512.403 510.363 560.211 1.00 0.00 C +ATOM 223 CA VAL A 223 510.482 512.162 562.966 1.00 0.00 C +ATOM 224 CA PRO A 224 507.674 514.606 562.156 1.00 0.00 C +ATOM 225 CA GLU A 225 504.530 516.332 563.443 1.00 0.00 C +ATOM 226 CA THR A 226 501.128 516.320 561.728 1.00 0.00 C +ATOM 227 CA GLU A 227 498.401 513.903 562.840 1.00 0.00 C +ATOM 228 CA SER A 228 498.554 513.350 566.607 1.00 0.00 C +ATOM 229 CA VAL A 229 498.599 516.604 568.589 1.00 0.00 C +ATOM 230 CA ALA A 230 500.507 519.762 567.641 1.00 0.00 C +ATOM 231 CA GLU A 231 500.916 523.277 569.052 1.00 0.00 C +ATOM 232 CA PRO A 232 500.462 526.114 566.549 1.00 0.00 C +ATOM 233 CA ALA A 233 499.716 524.755 563.068 1.00 0.00 C +ATOM 234 CA ALA A 234 500.303 524.985 559.311 1.00 0.00 C +ATOM 235 CA VAL A 235 500.505 522.897 556.130 1.00 0.00 C +ATOM 236 CA LEU A 236 497.528 522.520 553.782 1.00 0.00 C +ATOM 237 CA ALA A 237 498.577 523.863 550.374 1.00 0.00 C +ATOM 238 CA PRO A 238 496.220 522.564 547.677 1.00 0.00 C +ATOM 239 CA ALA A 239 497.926 519.530 546.129 1.00 0.00 C +ATOM 240 CA PRO A 240 496.094 516.190 546.208 1.00 0.00 C +ATOM 241 CA GLU A 241 493.122 514.071 547.298 1.00 0.00 C +ATOM 242 CA THR A 242 490.154 512.750 545.308 1.00 0.00 C +ATOM 243 CA LYS A 243 488.226 509.487 545.698 1.00 0.00 C +ATOM 244 CA PRO A 244 490.187 506.249 546.129 1.00 0.00 C +ATOM 245 CA ASP A 245 493.821 506.329 547.273 1.00 0.00 C +ATOM 246 CA ALA A 246 496.814 506.541 544.925 1.00 0.00 C +ATOM 247 CA LYS A 247 498.299 503.497 543.181 1.00 0.00 C +ATOM 248 CA PRO A 248 499.622 503.999 539.643 1.00 0.00 C +ATOM 249 CA ALA A 249 498.161 502.811 536.331 1.00 0.00 C +ATOM 250 CA ALA A 250 494.996 504.505 535.055 1.00 0.00 C +ATOM 251 CA VAL A 251 494.795 508.263 534.462 1.00 0.00 C +ATOM 252 CA PRO A 252 491.065 509.037 534.488 1.00 0.00 C +ATOM 253 CA ALA A 253 489.667 509.799 537.949 1.00 0.00 C +ATOM 254 CA PRO A 254 488.421 506.812 539.959 1.00 0.00 C +ATOM 255 CA ALA A 255 487.024 503.585 541.426 1.00 0.00 C +ATOM 256 CA PRO A 256 486.586 499.811 541.147 1.00 0.00 C +ATOM 257 CA GLU A 257 487.226 498.260 537.726 1.00 0.00 C +ATOM 258 CA ASN A 258 490.766 497.395 536.613 1.00 0.00 C +ATOM 259 CA LYS A 259 490.843 494.420 534.234 1.00 0.00 C +ATOM 260 CA PRO A 260 487.311 493.673 533.017 1.00 0.00 C +ATOM 261 CA ASP A 261 486.056 493.452 529.426 1.00 0.00 C +ATOM 262 CA ALA A 262 482.803 495.209 528.505 1.00 0.00 C +ATOM 263 CA GLU A 263 478.995 495.211 528.622 1.00 0.00 C +ATOM 264 CA PRO A 264 476.491 494.026 531.238 1.00 0.00 C +ATOM 265 CA ALA A 265 475.070 491.046 533.141 1.00 0.00 C +ATOM 266 CA ALA A 266 477.505 488.285 534.120 1.00 0.00 C +ATOM 267 CA ALA A 267 478.334 484.841 532.717 1.00 0.00 C +ATOM 268 CA ALA A 268 475.653 482.147 532.977 1.00 0.00 C +ATOM 269 CA ALA A 269 473.666 478.896 532.964 1.00 0.00 C +ATOM 270 CA PRO A 270 470.263 479.668 531.435 1.00 0.00 C +ATOM 271 CA VAL A 271 467.486 481.469 533.322 1.00 0.00 C +ATOM 272 CA PRO A 272 466.777 485.211 533.207 1.00 0.00 C +ATOM 273 CA ASP A 273 465.766 488.003 535.594 1.00 0.00 C +ATOM 274 CA THR A 274 468.094 490.787 536.754 1.00 0.00 C +ATOM 275 CA LYS A 275 471.376 489.325 538.022 1.00 0.00 C +ATOM 276 CA SER A 276 472.188 487.214 541.089 1.00 0.00 C +ATOM 277 CA VAL A 277 470.943 483.689 541.822 1.00 0.00 C +ATOM 278 CA ALA A 278 470.226 480.873 544.287 1.00 0.00 C +ATOM 279 CA GLU A 279 471.326 481.674 547.845 1.00 0.00 C +ATOM 280 CA PRO A 280 471.769 483.544 551.136 1.00 0.00 C +ATOM 281 CA ALA A 281 474.276 484.626 553.793 1.00 0.00 C +ATOM 282 CA ALA A 282 475.939 488.049 553.606 1.00 0.00 C +ATOM 283 CA ALA A 283 478.457 490.687 554.709 1.00 0.00 C +ATOM 284 CA PRO A 284 478.977 492.069 558.221 1.00 0.00 C +ATOM 285 CA ALA A 285 482.510 491.920 559.641 1.00 0.00 C +ATOM 286 CA PRO A 286 485.652 493.630 560.952 1.00 0.00 C +ATOM 287 CA ASP A 287 486.054 497.403 561.301 1.00 0.00 C +ATOM 288 CA THR A 288 484.060 500.516 560.380 1.00 0.00 C +ATOM 289 CA LYS A 289 485.538 504.013 560.696 1.00 0.00 C +ATOM 290 CA SER A 290 484.463 507.244 562.405 1.00 0.00 C +ATOM 291 CA VAL A 291 484.677 507.961 566.141 1.00 0.00 C +ATOM 292 CA ALA A 292 486.031 505.040 568.177 1.00 0.00 C +ATOM 293 CA GLU A 293 487.917 501.909 567.101 1.00 0.00 C +ATOM 294 CA PRO A 294 488.259 498.432 568.623 1.00 0.00 C +ATOM 295 CA ALA A 295 489.999 496.373 571.314 1.00 0.00 C +ATOM 296 CA ALA A 296 492.143 494.027 573.417 1.00 0.00 C +ATOM 297 CA ALA A 297 495.864 493.286 573.768 1.00 0.00 C +ATOM 298 CA ALA A 298 498.659 492.700 576.290 1.00 0.00 C +ATOM 299 CA PRO A 299 501.323 490.587 578.009 1.00 0.00 C +ATOM 300 CA VAL A 300 500.260 488.012 580.609 1.00 0.00 C +ATOM 301 CA PRO A 301 499.858 489.357 584.151 1.00 0.00 C +ATOM 302 CA GLU A 302 497.093 490.889 586.277 1.00 0.00 C +ATOM 303 CA THR A 303 494.786 493.758 587.259 1.00 0.00 C +ATOM 304 CA LYS A 304 493.747 496.592 584.934 1.00 0.00 C +ATOM 305 CA LEU A 305 491.851 495.435 581.838 1.00 0.00 C +ATOM 306 CA VAL A 306 489.513 492.475 582.375 1.00 0.00 C +ATOM 307 CA ALA A 307 488.468 488.886 583.115 1.00 0.00 C +ATOM 308 CA GLU A 308 489.114 486.462 580.248 1.00 0.00 C +ATOM 309 CA SER A 309 492.730 486.772 579.086 1.00 0.00 C +ATOM 310 CA ALA A 310 495.718 486.575 576.731 1.00 0.00 C +ATOM 311 CA ALA A 311 496.069 484.838 573.359 1.00 0.00 C +ATOM 312 CA ASP A 312 492.799 484.546 571.425 1.00 0.00 C +ATOM 313 CA ALA A 313 491.823 485.980 568.032 1.00 0.00 C +ATOM 314 CA VAL A 314 492.651 488.873 565.695 1.00 0.00 C +ATOM 315 CA ALA A 315 491.461 492.058 563.975 1.00 0.00 C +ATOM 316 CA ALA A 316 492.319 495.661 564.867 1.00 0.00 C +ATOM 317 CA PRO A 317 492.127 497.863 561.764 1.00 0.00 C +ATOM 318 CA ALA A 318 495.228 498.923 559.821 1.00 0.00 C +ATOM 319 CA PRO A 319 498.515 500.029 558.244 1.00 0.00 C +ATOM 320 CA GLU A 320 502.301 500.101 557.820 1.00 0.00 C +ATOM 321 CA THR A 321 505.689 501.795 558.223 1.00 0.00 C +ATOM 322 CA LYS A 322 507.555 501.401 554.924 1.00 0.00 C +ATOM 323 CA SER A 323 508.093 498.473 552.547 1.00 0.00 C +ATOM 324 CA ASP A 324 511.361 497.985 550.651 1.00 0.00 C +ATOM 325 CA ALA A 325 514.386 499.519 552.387 1.00 0.00 C +ATOM 326 CA GLU A 326 515.466 501.670 555.340 1.00 0.00 C +ATOM 327 CA PRO A 327 519.052 501.866 556.612 1.00 0.00 C +ATOM 328 CA ALA A 328 519.323 502.036 560.409 1.00 0.00 C +ATOM 329 CA ALA A 329 522.017 503.087 562.889 1.00 0.00 C +ATOM 330 CA ALA A 330 525.729 502.547 563.562 1.00 0.00 C +ATOM 331 CA PRO A 331 526.990 500.026 566.125 1.00 0.00 C +ATOM 332 CA VAL A 332 529.614 497.594 564.814 1.00 0.00 C +ATOM 333 CA PRO A 333 532.807 496.832 562.881 1.00 0.00 C +ATOM 334 CA GLU A 334 532.291 496.143 559.170 1.00 0.00 C +ATOM 335 CA THR A 335 531.914 499.485 557.379 1.00 0.00 C +ATOM 336 CA LYS A 336 530.562 502.123 559.773 1.00 0.00 C +ATOM 337 CA PRO A 337 531.604 505.414 561.385 1.00 0.00 C +ATOM 338 CA VAL A 338 533.995 504.470 564.197 1.00 0.00 C +ATOM 339 CA ALA A 339 537.514 503.350 565.133 1.00 0.00 C +ATOM 340 CA GLU A 340 538.845 500.529 562.944 1.00 0.00 C +ATOM 341 CA SER A 341 542.196 501.811 561.661 1.00 0.00 C +ATOM 342 CA ALA A 342 545.301 502.494 563.761 1.00 0.00 C +ATOM 343 CA ALA A 343 546.007 504.430 566.965 1.00 0.00 C +ATOM 344 CA ASP A 344 547.754 505.471 570.187 1.00 0.00 C +ATOM 345 CA ALA A 345 549.165 509.010 570.186 1.00 0.00 C +ATOM 346 CA VAL A 346 546.885 511.688 571.651 1.00 0.00 C +ATOM 347 CA ALA A 347 548.109 514.966 573.159 1.00 0.00 C +ATOM 348 CA ALA A 348 551.557 515.766 574.568 1.00 0.00 C +ATOM 349 CA PRO A 349 554.902 514.060 573.923 1.00 0.00 C +ATOM 350 CA ALA A 350 555.832 510.368 574.073 1.00 0.00 C +ATOM 351 CA PRO A 351 554.182 507.167 575.316 1.00 0.00 C +ATOM 352 CA GLU A 352 553.162 504.540 572.751 1.00 0.00 C +ATOM 353 CA THR A 353 554.505 501.022 573.328 1.00 0.00 C +ATOM 354 CA LYS A 354 557.108 498.295 573.877 1.00 0.00 C +ATOM 355 CA SER A 355 560.778 498.987 573.119 1.00 0.00 C +ATOM 356 CA ASP A 356 563.546 501.598 573.297 1.00 0.00 C +ATOM 357 CA ALA A 357 563.712 505.142 574.686 1.00 0.00 C +ATOM 358 CA GLU A 358 566.403 507.838 574.597 1.00 0.00 C +ATOM 359 CA PRO A 359 569.739 506.895 573.018 1.00 0.00 C +ATOM 360 CA ALA A 360 571.323 510.250 572.152 1.00 0.00 C +ATOM 361 CA ALA A 361 571.100 510.935 568.410 1.00 0.00 C +ATOM 362 CA ALA A 362 569.045 510.942 565.202 1.00 0.00 C +ATOM 363 CA ALA A 363 570.247 508.211 562.833 1.00 0.00 C +ATOM 364 CA ASP A 364 572.893 508.666 560.130 1.00 0.00 C +ATOM 365 CA PRO A 365 573.103 512.424 559.543 1.00 0.00 C +ATOM 366 CA ALA A 366 575.797 513.529 557.086 1.00 0.00 C +ATOM 367 CA PRO A 367 576.643 511.706 553.849 1.00 0.00 C +ATOM 368 CA GLU A 368 577.825 508.214 552.888 1.00 0.00 C +ATOM 369 CA ILE A 369 577.524 507.091 549.260 1.00 0.00 C +ATOM 370 CA LYS A 370 573.835 506.315 548.709 1.00 0.00 C +ATOM 371 CA SER A 371 571.372 509.135 548.006 1.00 0.00 C +ATOM 372 CA ASP A 372 568.625 511.049 546.188 1.00 0.00 C +ATOM 373 CA ALA A 373 567.849 511.420 542.476 1.00 0.00 C +ATOM 374 CA ALA A 374 569.864 509.090 540.233 1.00 0.00 C +ATOM 375 CA ALA A 375 572.160 508.807 537.207 1.00 0.00 C +ATOM 376 CA ALA A 376 575.112 510.653 535.659 1.00 0.00 C +ATOM 377 CA ASP A 377 576.393 508.936 532.509 1.00 0.00 C +ATOM 378 CA PRO A 378 579.669 507.965 530.825 1.00 0.00 C +ATOM 379 CA ALA A 379 579.629 509.049 527.173 1.00 0.00 C +ATOM 380 CA PRO A 380 578.562 508.806 523.523 1.00 0.00 C +ATOM 381 CA GLY A 381 576.367 507.296 520.799 1.00 0.00 C +ATOM 382 CA THR A 382 574.506 509.078 517.993 1.00 0.00 C +ATOM 383 CA LYS A 383 570.928 509.558 516.776 1.00 0.00 C +ATOM 384 CA ALA A 384 570.406 509.814 513.011 1.00 0.00 C +ATOM 385 CA ASP A 385 572.198 513.022 512.001 1.00 0.00 C +ATOM 386 CA ALA A 386 569.614 515.821 512.073 1.00 0.00 C +ATOM 387 CA ALA A 387 566.578 518.123 512.014 1.00 0.00 C +ATOM 388 CA ALA A 388 564.655 519.480 509.018 1.00 0.00 C +ATOM 389 CA THR A 389 566.387 521.622 506.386 1.00 0.00 C +ATOM 390 CA ASP A 390 565.158 520.685 502.903 1.00 0.00 C +ATOM 391 CA ALA A 391 565.966 522.738 499.796 1.00 0.00 C +ATOM 392 CA ALA A 392 564.056 525.780 498.526 1.00 0.00 C +ATOM 393 CA PRO A 393 565.855 528.616 496.728 1.00 0.00 C +ATOM 394 CA GLY A 394 569.095 530.033 495.311 1.00 0.00 C +ATOM 395 CA ALA A 395 571.678 532.189 493.522 1.00 0.00 C +ATOM 396 CA GLU A 396 572.441 534.408 490.520 1.00 0.00 C +ATOM 397 CA PRO A 397 575.938 535.913 490.383 1.00 0.00 C +ATOM 398 CA ASP A 398 578.900 536.062 487.990 1.00 0.00 C +ATOM 399 CA ALA A 399 582.688 536.312 487.677 1.00 0.00 C +ATOM 400 CA ALA A 400 585.215 533.509 487.151 1.00 0.00 C +ATOM 401 CA PRO A 401 587.970 531.852 489.195 1.00 0.00 C +ATOM 402 CA LEU A 402 591.617 531.317 490.159 1.00 0.00 C +ATOM 403 CA GLU A 403 593.663 531.886 486.995 1.00 0.00 C +ATOM 404 CA ASN A 404 595.406 529.434 484.657 1.00 0.00 C +ATOM 405 CA THR A 405 597.518 526.685 486.237 1.00 0.00 C +ATOM 406 CA ALA A 406 596.003 524.060 488.546 1.00 0.00 C +ATOM 407 CA ALA A 407 596.354 521.667 491.490 1.00 0.00 C +ATOM 408 CA ASP A 408 599.098 519.054 491.885 1.00 0.00 C +ATOM 409 CA LYS A 409 602.524 518.620 493.495 1.00 0.00 C +ATOM 410 CA GLY A 410 602.883 516.337 496.524 1.00 0.00 C +ATOM 411 CA GLY A 411 601.789 513.699 499.045 1.00 0.00 C +ATOM 412 CA SER A 412 601.535 515.545 502.368 1.00 0.00 C +ATOM 413 CA GLU A 413 599.776 518.851 503.073 1.00 0.00 C +ATOM 414 CA GLU A 414 597.963 520.093 506.186 1.00 0.00 C +ATOM 415 CA SER A 415 594.403 520.698 507.400 1.00 0.00 C +ATOM 416 CA SER A 416 591.496 519.194 509.350 1.00 0.00 C +ATOM 417 CA GLN A 417 588.692 517.693 511.447 1.00 0.00 C +ATOM 418 CA PRO A 418 590.234 514.906 513.537 1.00 0.00 C +ATOM 419 CA VAL A 419 589.324 515.268 517.219 1.00 0.00 C +ATOM 420 CA ASN A 420 587.307 518.261 518.439 1.00 0.00 C +ATOM 421 CA ASN A 421 584.538 519.034 520.939 1.00 0.00 C +ATOM 422 CA VAL A 422 581.994 521.267 519.191 1.00 0.00 C +ATOM 423 CA ASN A 423 580.268 519.983 516.047 1.00 0.00 C +ATOM 424 CA ASN A 424 576.990 521.005 514.396 1.00 0.00 C +ATOM 425 CA GLY A 425 575.241 523.993 512.806 1.00 0.00 C +ATOM 426 CA HIS A 426 572.878 524.562 509.872 1.00 0.00 C +ATOM 427 CA SER A 427 569.530 526.377 509.786 1.00 0.00 C +ATOM 428 CA THR A 428 569.965 530.162 509.736 1.00 0.00 C +TER 429 THR A 428 +END diff --git a/Plants/Q94J51/Q94J51.dcd b/Plants/Q94J51/Q94J51.dcd new file mode 100644 index 0000000000000000000000000000000000000000..db279cb7595956a32a202e4dbb72d0c45580d6bc --- /dev/null +++ b/Plants/Q94J51/Q94J51.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:9026456bc745efd1bc33a3064c4a0133a6d5961d78a28ea8dd1c14163cf5e26a +size 11480276 diff --git a/Plants/Q94J51/top.pdb b/Plants/Q94J51/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..178b55fe433a0ffed97173091f8dc720eaebbb25 --- /dev/null +++ b/Plants/Q94J51/top.pdb @@ -0,0 +1,93 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 208.039 270.267 248.255 1.00 0.00 C +ATOM 2 CA ALA A 2 211.437 269.665 246.641 1.00 0.00 C +ATOM 3 CA SER A 3 212.581 269.154 243.043 1.00 0.00 C +ATOM 4 CA GLY A 4 215.834 268.310 241.247 1.00 0.00 C +ATOM 5 CA SER A 5 217.488 265.599 243.352 1.00 0.00 C +ATOM 6 CA ARG A 6 218.084 261.882 242.760 1.00 0.00 C +ATOM 7 CA GLY A 7 221.449 261.007 241.201 1.00 0.00 C +ATOM 8 CA ASP A 8 225.140 261.188 240.275 1.00 0.00 C +ATOM 9 CA PHE A 9 228.010 258.684 240.171 1.00 0.00 C +ATOM 10 CA ARG A 10 231.817 258.615 240.031 1.00 0.00 C +ATOM 11 CA ALA A 11 235.502 257.674 240.247 1.00 0.00 C +ATOM 12 CA VAL A 12 238.077 258.328 237.516 1.00 0.00 C +ATOM 13 CA GLN A 13 240.128 261.401 236.587 1.00 0.00 C +ATOM 14 CA PRO A 14 240.765 264.088 239.213 1.00 0.00 C +ATOM 15 CA GLY A 15 242.169 265.591 242.420 1.00 0.00 C +ATOM 16 CA ASP A 16 241.902 268.226 245.159 1.00 0.00 C +ATOM 17 CA LEU A 17 239.119 270.779 245.662 1.00 0.00 C +ATOM 18 CA HIS A 18 237.035 273.462 243.938 1.00 0.00 C +ATOM 19 CA ARG A 19 237.325 273.336 240.141 1.00 0.00 C +ATOM 20 CA SER A 20 240.673 273.343 238.322 1.00 0.00 C +ATOM 21 CA LYS A 21 243.955 271.416 238.153 1.00 0.00 C +ATOM 22 CA PRO A 22 246.051 273.318 235.603 1.00 0.00 C +ATOM 23 CA PHE A 23 248.195 272.822 232.492 1.00 0.00 C +ATOM 24 CA GLN A 24 250.553 270.153 231.140 1.00 0.00 C +ATOM 25 CA PRO A 25 252.866 267.161 231.608 1.00 0.00 C +ATOM 26 CA ALA A 26 256.213 266.300 233.211 1.00 0.00 C +ATOM 27 CA ARG A 27 257.965 264.461 236.051 1.00 0.00 C +ATOM 28 CA ALA A 28 261.196 262.454 235.811 1.00 0.00 C +ATOM 29 CA GLN A 29 263.824 259.934 236.931 1.00 0.00 C +ATOM 30 CA PRO A 30 266.504 257.242 237.223 1.00 0.00 C +ATOM 31 CA PRO A 31 266.546 255.321 240.514 1.00 0.00 C +ATOM 32 CA GLY A 32 264.167 253.904 243.131 1.00 0.00 C +ATOM 33 CA VAL A 33 261.445 256.548 243.476 1.00 0.00 C +ATOM 34 CA GLN A 34 259.935 260.045 243.393 1.00 0.00 C +ATOM 35 CA ARG A 35 260.958 262.742 245.881 1.00 0.00 C +ATOM 36 CA ALA A 36 258.087 264.308 247.836 1.00 0.00 C +ATOM 37 CA ALA A 37 254.932 266.216 248.794 1.00 0.00 C +ATOM 38 CA ALA A 38 253.175 264.476 251.693 1.00 0.00 C +ATOM 39 CA SER A 39 252.893 260.735 251.026 1.00 0.00 C +ATOM 40 CA SER A 40 256.230 258.926 251.355 1.00 0.00 C +ATOM 41 CA VAL A 41 258.616 259.600 254.248 1.00 0.00 C +ATOM 42 CA ASP A 42 261.358 257.123 255.176 1.00 0.00 C +ATOM 43 CA VAL A 43 263.449 256.614 258.320 1.00 0.00 C +ATOM 44 CA ARG A 44 263.710 256.051 262.079 1.00 0.00 C +ATOM 45 CA GLY A 45 266.418 254.918 264.508 1.00 0.00 C +ATOM 46 CA ARG A 46 267.786 251.376 264.824 1.00 0.00 C +ATOM 47 CA ARG A 47 271.196 249.691 265.055 1.00 0.00 C +ATOM 48 CA ARG A 48 271.395 246.553 262.904 1.00 0.00 C +ATOM 49 CA LEU A 49 269.428 243.291 263.012 1.00 0.00 C +ATOM 50 CA LEU A 50 266.299 241.316 263.920 1.00 0.00 C +ATOM 51 CA ARG A 51 264.437 240.047 260.847 1.00 0.00 C +ATOM 52 CA ARG A 52 262.753 236.650 260.468 1.00 0.00 C +ATOM 53 CA ARG A 53 260.230 236.177 257.652 1.00 0.00 C +ATOM 54 CA ALA A 54 260.874 232.639 256.393 1.00 0.00 C +ATOM 55 CA ARG A 55 262.415 230.707 253.493 1.00 0.00 C +ATOM 56 CA PRO A 56 263.612 229.392 250.124 1.00 0.00 C +ATOM 57 CA ARG A 57 263.259 225.615 249.767 1.00 0.00 C +ATOM 58 CA GLU A 58 260.755 222.909 248.803 1.00 0.00 C +ATOM 59 CA ALA A 59 256.953 223.044 248.614 1.00 0.00 C +ATOM 60 CA ARG A 60 254.474 224.936 250.805 1.00 0.00 C +ATOM 61 CA PRO A 61 250.708 224.844 250.240 1.00 0.00 C +ATOM 62 CA GLY A 62 247.874 226.124 248.038 1.00 0.00 C +ATOM 63 CA GLN A 63 247.693 229.925 248.213 1.00 0.00 C +ATOM 64 CA ARG A 64 249.991 232.963 248.106 1.00 0.00 C +ATOM 65 CA ARG A 65 249.803 234.404 251.627 1.00 0.00 C +ATOM 66 CA ARG A 66 247.015 233.888 254.173 1.00 0.00 C +ATOM 67 CA TRP A 67 247.052 231.732 257.314 1.00 0.00 C +ATOM 68 CA ALA A 68 245.291 229.576 259.916 1.00 0.00 C +ATOM 69 CA ALA A 69 246.264 229.996 263.576 1.00 0.00 C +ATOM 70 CA GLY A 70 243.185 229.362 265.728 1.00 0.00 C +ATOM 71 CA ARG A 71 242.094 230.207 269.279 1.00 0.00 C +ATOM 72 CA ALA A 72 244.271 232.477 271.430 1.00 0.00 C +ATOM 73 CA GLU A 73 247.404 234.343 272.536 1.00 0.00 C +ATOM 74 CA ALA A 74 250.517 233.875 270.389 1.00 0.00 C +ATOM 75 CA ALA A 75 251.408 231.356 267.674 1.00 0.00 C +ATOM 76 CA LYS A 76 254.454 232.337 265.605 1.00 0.00 C +ATOM 77 CA SER A 77 254.245 234.653 262.587 1.00 0.00 C +ATOM 78 CA GLU A 78 252.616 237.494 260.639 1.00 0.00 C +ATOM 79 CA ALA A 79 253.991 237.244 257.095 1.00 0.00 C +ATOM 80 CA GLY A 80 253.385 239.229 253.899 1.00 0.00 C +ATOM 81 CA GLU A 81 255.279 239.226 250.593 1.00 0.00 C +ATOM 82 CA ARG A 82 255.234 238.996 246.791 1.00 0.00 C +ATOM 83 CA GLN A 83 254.829 242.183 244.742 1.00 0.00 C +ATOM 84 CA GLY A 84 254.076 245.799 243.808 1.00 0.00 C +ATOM 85 CA PRO A 85 252.780 248.411 246.260 1.00 0.00 C +ATOM 86 CA GLY A 86 251.243 248.633 249.740 1.00 0.00 C +ATOM 87 CA VAL A 87 253.895 247.786 252.341 1.00 0.00 C +ATOM 88 CA THR A 88 253.298 246.713 255.947 1.00 0.00 C +ATOM 89 CA LEU A 89 252.420 248.496 259.198 1.00 0.00 C +TER 90 LEU A 89 +END diff --git a/Plants/Q94J77/Q94J77.dcd b/Plants/Q94J77/Q94J77.dcd new file mode 100644 index 0000000000000000000000000000000000000000..0e0498ac81a457a7d60e260965e0a918afb80448 --- /dev/null +++ b/Plants/Q94J77/Q94J77.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:10d15741e959ad46ae9a67948a83f2c89115d358b2e85a849e9c4ecbb8a8be97 +size 12800276 diff --git a/Plants/Q94J77/top.pdb b/Plants/Q94J77/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..d35d8ddd0bb66ff66d6d110915984d30b5f8f757 --- /dev/null +++ b/Plants/Q94J77/top.pdb @@ -0,0 +1,104 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 231.508 283.129 238.914 1.00 0.00 C +ATOM 2 CA ALA A 2 229.569 281.062 241.460 1.00 0.00 C +ATOM 3 CA ALA A 3 227.108 283.172 243.462 1.00 0.00 C +ATOM 4 CA GLU A 4 226.875 286.627 245.051 1.00 0.00 C +ATOM 5 CA ARG A 5 229.903 288.494 243.686 1.00 0.00 C +ATOM 6 CA SER A 6 232.571 288.245 246.395 1.00 0.00 C +ATOM 7 CA ARG A 7 235.968 289.970 246.337 1.00 0.00 C +ATOM 8 CA ARG A 8 236.519 291.746 243.012 1.00 0.00 C +ATOM 9 CA ARG A 9 237.801 289.045 240.650 1.00 0.00 C +ATOM 10 CA TRP A 10 240.499 286.737 239.270 1.00 0.00 C +ATOM 11 CA ARG A 11 243.414 286.046 236.915 1.00 0.00 C +ATOM 12 CA GLY A 12 247.207 285.997 237.271 1.00 0.00 C +ATOM 13 CA GLY A 13 248.825 284.510 240.383 1.00 0.00 C +ATOM 14 CA ARG A 14 249.049 283.302 243.989 1.00 0.00 C +ATOM 15 CA ARG A 15 246.560 283.690 246.848 1.00 0.00 C +ATOM 16 CA ARG A 16 244.743 282.609 250.017 1.00 0.00 C +ATOM 17 CA GLY A 17 243.272 279.913 252.271 1.00 0.00 C +ATOM 18 CA ARG A 18 244.507 276.359 251.669 1.00 0.00 C +ATOM 19 CA GLY A 19 245.885 274.312 248.766 1.00 0.00 C +ATOM 20 CA ASP A 20 244.038 274.417 245.435 1.00 0.00 C +ATOM 21 CA GLY A 21 245.508 273.075 242.186 1.00 0.00 C +ATOM 22 CA GLY A 22 244.558 270.908 239.200 1.00 0.00 C +ATOM 23 CA ASP A 23 245.397 267.196 239.375 1.00 0.00 C +ATOM 24 CA GLY A 24 247.979 265.802 236.945 1.00 0.00 C +ATOM 25 CA GLY A 25 251.543 265.386 238.226 1.00 0.00 C +ATOM 26 CA GLY A 26 254.952 266.967 238.854 1.00 0.00 C +ATOM 27 CA ASP A 27 257.287 267.618 235.914 1.00 0.00 C +ATOM 28 CA GLY A 28 257.484 265.190 232.985 1.00 0.00 C +ATOM 29 CA LEU A 29 256.145 263.510 229.838 1.00 0.00 C +ATOM 30 CA ARG A 30 252.885 261.683 229.097 1.00 0.00 C +ATOM 31 CA ARG A 31 250.641 261.368 226.034 1.00 0.00 C +ATOM 32 CA TRP A 32 246.883 261.993 225.967 1.00 0.00 C +ATOM 33 CA TRP A 33 243.924 262.743 228.246 1.00 0.00 C +ATOM 34 CA CYS A 34 245.035 264.564 231.403 1.00 0.00 C +ATOM 35 CA ARG A 35 244.640 268.351 231.554 1.00 0.00 C +ATOM 36 CA PRO A 36 241.100 269.576 232.249 1.00 0.00 C +ATOM 37 CA ALA A 37 239.329 272.468 233.986 1.00 0.00 C +ATOM 38 CA SER A 38 241.773 275.383 233.768 1.00 0.00 C +ATOM 39 CA GLY A 39 245.176 276.195 232.259 1.00 0.00 C +ATOM 40 CA ARG A 40 248.079 276.500 229.810 1.00 0.00 C +ATOM 41 CA SER A 41 251.581 275.767 231.118 1.00 0.00 C +ATOM 42 CA THR A 42 251.634 273.340 234.054 1.00 0.00 C +ATOM 43 CA GLU A 43 251.124 274.568 237.625 1.00 0.00 C +ATOM 44 CA ARG A 44 253.306 272.654 240.093 1.00 0.00 C +ATOM 45 CA VAL A 45 254.662 274.055 243.366 1.00 0.00 C +ATOM 46 CA SER A 46 255.213 275.201 246.958 1.00 0.00 C +ATOM 47 CA GLY A 47 253.233 275.250 250.212 1.00 0.00 C +ATOM 48 CA ARG A 48 252.519 275.806 253.913 1.00 0.00 C +ATOM 49 CA GLU A 49 251.006 272.579 255.262 1.00 0.00 C +ATOM 50 CA VAL A 50 253.057 270.446 257.662 1.00 0.00 C +ATOM 51 CA GLY A 51 254.227 266.869 257.066 1.00 0.00 C +ATOM 52 CA GLY A 52 253.381 263.956 259.371 1.00 0.00 C +ATOM 53 CA PHE A 53 252.185 260.946 261.378 1.00 0.00 C +ATOM 54 CA GLY A 54 252.327 257.540 263.079 1.00 0.00 C +ATOM 55 CA GLY A 55 254.824 254.670 263.293 1.00 0.00 C +ATOM 56 CA GLY A 56 253.817 251.197 262.095 1.00 0.00 C +ATOM 57 CA GLU A 57 250.660 249.314 261.092 1.00 0.00 C +ATOM 58 CA GLY A 58 247.237 247.914 262.008 1.00 0.00 C +ATOM 59 CA GLY A 59 244.177 248.762 259.902 1.00 0.00 C +ATOM 60 CA PHE A 60 240.806 247.970 258.313 1.00 0.00 C +ATOM 61 CA GLY A 61 239.097 246.849 255.097 1.00 0.00 C +ATOM 62 CA GLY A 62 240.289 243.478 253.781 1.00 0.00 C +ATOM 63 CA GLY A 63 241.300 242.840 250.164 1.00 0.00 C +ATOM 64 CA GLU A 64 243.263 243.414 246.949 1.00 0.00 C +ATOM 65 CA GLY A 65 245.155 243.564 243.646 1.00 0.00 C +ATOM 66 CA SER A 66 248.464 241.682 243.806 1.00 0.00 C +ATOM 67 CA GLY A 67 248.590 239.853 247.146 1.00 0.00 C +ATOM 68 CA GLU A 68 248.660 236.113 247.870 1.00 0.00 C +ATOM 69 CA VAL A 69 250.243 232.676 247.425 1.00 0.00 C +ATOM 70 CA ASP A 70 253.845 231.506 247.005 1.00 0.00 C +ATOM 71 CA ARG A 71 255.528 231.076 250.396 1.00 0.00 C +ATOM 72 CA GLY A 72 256.543 231.497 254.044 1.00 0.00 C +ATOM 73 CA GLU A 73 255.804 232.143 257.725 1.00 0.00 C +ATOM 74 CA ALA A 74 257.812 229.724 259.878 1.00 0.00 C +ATOM 75 CA ALA A 75 261.300 228.707 258.730 1.00 0.00 C +ATOM 76 CA VAL A 76 264.198 230.053 260.804 1.00 0.00 C +ATOM 77 CA ALA A 77 266.698 228.434 263.181 1.00 0.00 C +ATOM 78 CA SER A 78 268.519 225.112 262.774 1.00 0.00 C +ATOM 79 CA PRO A 79 267.730 221.795 261.074 1.00 0.00 C +ATOM 80 CA VAL A 80 265.793 218.526 261.353 1.00 0.00 C +ATOM 81 CA THR A 81 265.251 216.832 257.984 1.00 0.00 C +ATOM 82 CA GLY A 82 264.408 214.384 255.189 1.00 0.00 C +ATOM 83 CA ALA A 83 260.603 214.426 255.016 1.00 0.00 C +ATOM 84 CA ASN A 84 258.776 214.378 258.360 1.00 0.00 C +ATOM 85 CA ARG A 85 260.232 213.890 261.847 1.00 0.00 C +ATOM 86 CA GLY A 86 258.063 211.339 263.665 1.00 0.00 C +ATOM 87 CA ALA A 87 258.249 207.592 263.001 1.00 0.00 C +ATOM 88 CA VAL A 88 257.759 203.973 264.085 1.00 0.00 C +ATOM 89 CA THR A 89 258.030 201.742 261.008 1.00 0.00 C +ATOM 90 CA CYS A 90 258.297 197.996 260.362 1.00 0.00 C +ATOM 91 CA ASP A 91 259.627 195.253 262.646 1.00 0.00 C +ATOM 92 CA GLY A 92 258.547 193.689 265.948 1.00 0.00 C +ATOM 93 CA PRO A 93 255.826 191.222 266.961 1.00 0.00 C +ATOM 94 CA THR A 94 255.375 187.443 267.141 1.00 0.00 C +ATOM 95 CA ASP A 95 252.637 186.899 269.733 1.00 0.00 C +ATOM 96 CA ARG A 96 252.821 184.687 272.830 1.00 0.00 C +ATOM 97 CA ALA A 97 251.612 185.897 276.234 1.00 0.00 C +ATOM 98 CA ARG A 98 253.297 187.932 278.979 1.00 0.00 C +ATOM 99 CA HIS A 99 253.287 191.722 279.376 1.00 0.00 C +ATOM 100 CA ARG A 100 251.355 195.002 279.229 1.00 0.00 C +TER 101 ARG A 100 +END diff --git a/Plants/Q94J84/Q94J84.dcd b/Plants/Q94J84/Q94J84.dcd new file mode 100644 index 0000000000000000000000000000000000000000..34a1550a94f39b487a9fecf36f745ceeb8e72bb0 --- /dev/null +++ b/Plants/Q94J84/Q94J84.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:23067dd8efb9351571f0d1ce17e9849bf66b567c98275c1e27ec171a8a4651c5 +size 40260276 diff --git a/Plants/Q94J84/top.pdb b/Plants/Q94J84/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..5fd9706dd365325ba7dd7039ca62679e9a60e62b --- /dev/null +++ b/Plants/Q94J84/top.pdb @@ -0,0 +1,221 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 227.026 204.793 315.214 1.00 0.00 C +ATOM 2 CA GLU A 2 230.185 206.892 315.577 1.00 0.00 C +ATOM 3 CA ARG A 3 233.752 206.824 314.239 1.00 0.00 C +ATOM 4 CA GLU A 4 233.945 204.968 310.917 1.00 0.00 C +ATOM 5 CA GLY A 5 235.427 201.777 309.456 1.00 0.00 C +ATOM 6 CA ARG A 6 238.264 201.799 306.913 1.00 0.00 C +ATOM 7 CA GLY A 7 241.910 200.908 307.565 1.00 0.00 C +ATOM 8 CA ILE A 8 243.813 204.206 307.696 1.00 0.00 C +ATOM 9 CA ASN A 9 245.281 206.368 304.923 1.00 0.00 C +ATOM 10 CA SER A 10 245.630 208.114 301.555 1.00 0.00 C +ATOM 11 CA PRO A 11 243.895 211.344 300.518 1.00 0.00 C +ATOM 12 CA ASP A 12 241.832 212.713 297.622 1.00 0.00 C +ATOM 13 CA ALA A 13 239.268 213.620 294.954 1.00 0.00 C +ATOM 14 CA GLU A 14 237.548 212.243 291.846 1.00 0.00 C +ATOM 15 CA THR A 15 237.822 208.451 291.601 1.00 0.00 C +ATOM 16 CA GLY A 16 236.497 205.620 289.423 1.00 0.00 C +ATOM 17 CA ARG A 17 236.562 204.509 285.779 1.00 0.00 C +ATOM 18 CA ARG A 18 235.444 202.467 282.763 1.00 0.00 C +ATOM 19 CA THR A 19 234.522 203.437 279.196 1.00 0.00 C +ATOM 20 CA SER A 20 234.745 204.864 275.670 1.00 0.00 C +ATOM 21 CA ARG A 21 237.245 204.741 272.798 1.00 0.00 C +ATOM 22 CA THR A 22 240.193 203.033 271.093 1.00 0.00 C +ATOM 23 CA ALA A 23 240.772 204.695 267.713 1.00 0.00 C +ATOM 24 CA SER A 24 239.016 206.232 264.702 1.00 0.00 C +ATOM 25 CA VAL A 25 237.486 204.269 261.818 1.00 0.00 C +ATOM 26 CA PRO A 26 236.794 200.714 263.002 1.00 0.00 C +ATOM 27 CA PRO A 27 236.333 197.899 265.528 1.00 0.00 C +ATOM 28 CA PRO A 28 239.797 197.116 266.908 1.00 0.00 C +ATOM 29 CA PRO A 29 242.030 194.037 266.694 1.00 0.00 C +ATOM 30 CA ALA A 30 245.038 191.707 266.892 1.00 0.00 C +ATOM 31 CA ALA A 31 243.977 188.219 265.785 1.00 0.00 C +ATOM 32 CA GLU A 32 244.506 184.899 263.993 1.00 0.00 C +ATOM 33 CA SER A 33 243.914 185.287 260.249 1.00 0.00 C +ATOM 34 CA ALA A 34 243.695 188.100 257.689 1.00 0.00 C +ATOM 35 CA ARG A 35 241.748 191.197 258.754 1.00 0.00 C +ATOM 36 CA GLY A 36 239.432 192.723 256.142 1.00 0.00 C +ATOM 37 CA GLY A 37 237.365 195.492 257.747 1.00 0.00 C +ATOM 38 CA ARG A 38 238.570 198.892 256.522 1.00 0.00 C +ATOM 39 CA GLY A 39 241.519 201.282 256.850 1.00 0.00 C +ATOM 40 CA GLY A 40 240.711 204.998 256.629 1.00 0.00 C +ATOM 41 CA ALA A 41 243.037 207.867 257.567 1.00 0.00 C +ATOM 42 CA ALA A 42 242.099 210.730 255.235 1.00 0.00 C +ATOM 43 CA ARG A 43 240.083 213.375 253.376 1.00 0.00 C +ATOM 44 CA ARG A 44 238.414 213.662 249.963 1.00 0.00 C +ATOM 45 CA ARG A 45 234.607 213.693 250.106 1.00 0.00 C +ATOM 46 CA GLY A 46 233.571 217.346 249.795 1.00 0.00 C +ATOM 47 CA ARG A 47 235.902 219.784 248.023 1.00 0.00 C +ATOM 48 CA PRO A 48 237.097 223.285 248.934 1.00 0.00 C +ATOM 49 CA PRO A 49 236.658 224.223 252.600 1.00 0.00 C +ATOM 50 CA PRO A 50 239.136 222.212 254.681 1.00 0.00 C +ATOM 51 CA PRO A 51 241.454 219.370 253.647 1.00 0.00 C +ATOM 52 CA PRO A 52 244.941 218.025 252.908 1.00 0.00 C +ATOM 53 CA PHE A 53 246.942 220.138 250.448 1.00 0.00 C +ATOM 54 CA SER A 54 246.965 218.848 246.863 1.00 0.00 C +ATOM 55 CA PRO A 55 248.532 221.604 244.751 1.00 0.00 C +ATOM 56 CA PRO A 56 251.174 224.103 243.615 1.00 0.00 C +ATOM 57 CA ALA A 57 253.572 226.354 245.539 1.00 0.00 C +ATOM 58 CA ALA A 58 253.263 228.537 248.646 1.00 0.00 C +ATOM 59 CA GLU A 59 251.683 229.670 251.922 1.00 0.00 C +ATOM 60 CA GLY A 60 251.617 233.137 253.501 1.00 0.00 C +ATOM 61 CA GLU A 61 253.754 236.199 252.745 1.00 0.00 C +ATOM 62 CA ARG A 62 252.598 239.694 251.764 1.00 0.00 C +ATOM 63 CA GLY A 63 250.556 239.359 248.565 1.00 0.00 C +ATOM 64 CA ARG A 64 247.594 236.972 248.353 1.00 0.00 C +ATOM 65 CA GLY A 65 248.765 233.390 247.788 1.00 0.00 C +ATOM 66 CA ARG A 66 245.919 231.102 246.701 1.00 0.00 C +ATOM 67 CA GLU A 67 245.521 227.524 247.948 1.00 0.00 C +ATOM 68 CA GLY A 68 241.982 226.484 246.992 1.00 0.00 C +ATOM 69 CA PRO A 69 239.376 227.107 244.283 1.00 0.00 C +ATOM 70 CA LEU A 70 240.794 227.151 240.747 1.00 0.00 C +ATOM 71 CA PRO A 71 239.769 225.378 237.535 1.00 0.00 C +ATOM 72 CA PRO A 72 236.181 225.537 236.263 1.00 0.00 C +ATOM 73 CA ASP A 73 233.768 227.873 238.062 1.00 0.00 C +ATOM 74 CA SER A 74 231.874 230.463 240.117 1.00 0.00 C +ATOM 75 CA LEU A 75 232.298 234.220 240.591 1.00 0.00 C +ATOM 76 CA LEU A 76 234.438 236.852 238.856 1.00 0.00 C +ATOM 77 CA PRO A 77 236.609 238.865 241.254 1.00 0.00 C +ATOM 78 CA CYS A 78 240.026 240.467 240.727 1.00 0.00 C +ATOM 79 CA ARG A 79 240.074 244.109 241.844 1.00 0.00 C +ATOM 80 CA ARG A 80 239.414 247.299 243.820 1.00 0.00 C +ATOM 81 CA ILE A 81 240.932 250.685 242.957 1.00 0.00 C +ATOM 82 CA TYR A 82 244.258 252.272 243.920 1.00 0.00 C +ATOM 83 CA ALA A 83 247.181 250.575 242.161 1.00 0.00 C +ATOM 84 CA PRO A 84 249.512 247.747 241.117 1.00 0.00 C +ATOM 85 CA PRO A 85 250.805 246.169 237.900 1.00 0.00 C +ATOM 86 CA PRO A 86 254.149 244.377 237.548 1.00 0.00 C +ATOM 87 CA LEU A 87 256.419 242.397 235.215 1.00 0.00 C +ATOM 88 CA SER A 88 256.086 238.614 234.913 1.00 0.00 C +ATOM 89 CA LEU A 89 253.115 236.403 235.810 1.00 0.00 C +ATOM 90 CA SER A 90 250.442 234.087 237.227 1.00 0.00 C +ATOM 91 CA PRO A 91 246.688 234.416 237.786 1.00 0.00 C +ATOM 92 CA PRO A 92 244.738 234.149 241.048 1.00 0.00 C +ATOM 93 CA PHE A 93 241.061 234.466 241.995 1.00 0.00 C +ATOM 94 CA SER A 94 239.700 235.697 245.334 1.00 0.00 C +ATOM 95 CA PRO A 95 239.736 233.425 248.392 1.00 0.00 C +ATOM 96 CA PRO A 96 238.625 231.742 251.624 1.00 0.00 C +ATOM 97 CA THR A 97 241.447 230.802 254.004 1.00 0.00 C +ATOM 98 CA ALA A 98 242.189 233.026 257.007 1.00 0.00 C +ATOM 99 CA GLU A 99 242.149 236.741 257.849 1.00 0.00 C +ATOM 100 CA GLY A 100 244.006 238.127 260.874 1.00 0.00 C +ATOM 101 CA GLU A 101 242.619 241.000 262.956 1.00 0.00 C +ATOM 102 CA GLY A 102 242.741 243.267 266.016 1.00 0.00 C +ATOM 103 CA GLY A 103 239.383 244.726 267.072 1.00 0.00 C +ATOM 104 CA ARG A 104 236.954 247.113 268.779 1.00 0.00 C +ATOM 105 CA GLY A 105 233.503 246.458 267.301 1.00 0.00 C +ATOM 106 CA HIS A 106 233.606 244.646 263.951 1.00 0.00 C +ATOM 107 CA ARG A 107 233.239 241.023 262.832 1.00 0.00 C +ATOM 108 CA ARG A 108 231.149 239.933 259.839 1.00 0.00 C +ATOM 109 CA ARG A 109 231.404 239.162 256.116 1.00 0.00 C +ATOM 110 CA ILE A 110 233.914 236.929 254.320 1.00 0.00 C +ATOM 111 CA ARG A 111 234.572 238.356 250.850 1.00 0.00 C +ATOM 112 CA ARG A 112 236.773 241.090 249.368 1.00 0.00 C +ATOM 113 CA SER A 113 235.699 244.714 249.848 1.00 0.00 C +ATOM 114 CA HIS A 114 232.577 245.804 247.954 1.00 0.00 C +ATOM 115 CA ALA A 115 230.648 249.034 247.354 1.00 0.00 C +ATOM 116 CA ALA A 116 232.020 252.450 248.336 1.00 0.00 C +ATOM 117 CA CYS A 117 231.071 256.123 248.685 1.00 0.00 C +ATOM 118 CA ARG A 118 232.011 259.800 248.347 1.00 0.00 C +ATOM 119 CA TRP A 119 235.461 261.407 248.190 1.00 0.00 C +ATOM 120 CA ILE A 120 238.685 262.087 246.276 1.00 0.00 C +ATOM 121 CA CYS A 121 242.098 261.155 244.862 1.00 0.00 C +ATOM 122 CA THR A 122 244.976 263.528 244.088 1.00 0.00 C +ATOM 123 CA PRO A 123 248.378 262.363 242.831 1.00 0.00 C +ATOM 124 CA PRO A 124 251.211 261.590 245.259 1.00 0.00 C +ATOM 125 CA PRO A 125 253.646 260.832 248.089 1.00 0.00 C +ATOM 126 CA LEU A 126 253.922 257.256 249.374 1.00 0.00 C +ATOM 127 CA SER A 127 256.659 255.545 247.351 1.00 0.00 C +ATOM 128 CA PRO A 128 259.405 258.018 246.424 1.00 0.00 C +ATOM 129 CA PRO A 129 261.187 261.384 246.525 1.00 0.00 C +ATOM 130 CA PHE A 130 264.319 262.128 244.487 1.00 0.00 C +ATOM 131 CA SER A 131 266.157 265.271 245.611 1.00 0.00 C +ATOM 132 CA PRO A 132 266.066 267.797 242.761 1.00 0.00 C +ATOM 133 CA PRO A 133 269.148 267.491 240.542 1.00 0.00 C +ATOM 134 CA ALA A 134 271.518 269.080 238.018 1.00 0.00 C +ATOM 135 CA THR A 135 273.603 267.482 235.259 1.00 0.00 C +ATOM 136 CA GLU A 136 273.200 265.397 232.096 1.00 0.00 C +ATOM 137 CA GLY A 137 270.400 267.142 230.191 1.00 0.00 C +ATOM 138 CA GLU A 138 267.066 265.419 229.530 1.00 0.00 C +ATOM 139 CA GLY A 139 264.145 264.152 231.623 1.00 0.00 C +ATOM 140 CA GLY A 140 261.380 266.753 231.299 1.00 0.00 C +ATOM 141 CA ALA A 141 261.391 269.763 233.635 1.00 0.00 C +ATOM 142 CA ALA A 142 263.629 272.772 232.963 1.00 0.00 C +ATOM 143 CA ALA A 143 263.079 275.726 230.619 1.00 0.00 C +ATOM 144 CA ILE A 144 263.964 278.914 232.509 1.00 0.00 C +ATOM 145 CA GLY A 145 260.843 279.752 234.528 1.00 0.00 C +ATOM 146 CA SER A 146 260.572 278.809 238.209 1.00 0.00 C +ATOM 147 CA ALA A 147 258.380 280.338 240.924 1.00 0.00 C +ATOM 148 CA ALA A 148 257.241 281.592 244.337 1.00 0.00 C +ATOM 149 CA PRO A 149 257.829 278.785 246.846 1.00 0.00 C +ATOM 150 CA MET A 150 258.757 277.518 250.317 1.00 0.00 C +ATOM 151 CA PRO A 151 259.297 280.168 253.001 1.00 0.00 C +ATOM 152 CA ARG A 152 257.796 283.385 254.382 1.00 0.00 C +ATOM 153 CA ALA A 153 255.626 286.505 254.116 1.00 0.00 C +ATOM 154 CA SER A 154 252.948 287.077 251.466 1.00 0.00 C +ATOM 155 CA GLY A 155 250.192 284.761 250.218 1.00 0.00 C +ATOM 156 CA SER A 156 248.298 281.572 249.347 1.00 0.00 C +ATOM 157 CA ALA A 157 247.292 279.383 252.298 1.00 0.00 C +ATOM 158 CA HIS A 158 246.241 277.974 255.678 1.00 0.00 C +ATOM 159 CA ARG A 159 245.258 274.502 256.904 1.00 0.00 C +ATOM 160 CA ARG A 160 245.558 271.401 254.712 1.00 0.00 C +ATOM 161 CA GLY A 161 242.532 269.291 253.758 1.00 0.00 C +ATOM 162 CA ARG A 162 242.408 268.169 250.119 1.00 0.00 C +ATOM 163 CA PRO A 163 244.018 269.887 247.123 1.00 0.00 C +ATOM 164 CA PRO A 164 245.435 273.247 248.225 1.00 0.00 C +ATOM 165 CA PRO A 165 245.907 276.686 246.654 1.00 0.00 C +ATOM 166 CA PRO A 166 243.812 276.884 243.478 1.00 0.00 C +ATOM 167 CA LEU A 167 244.916 273.939 241.326 1.00 0.00 C +ATOM 168 CA LEU A 168 242.910 274.194 238.097 1.00 0.00 C +ATOM 169 CA PRO A 169 241.093 277.119 236.466 1.00 0.00 C +ATOM 170 CA PRO A 170 238.988 280.027 237.741 1.00 0.00 C +ATOM 171 CA PHE A 171 239.388 283.280 235.798 1.00 0.00 C +ATOM 172 CA SER A 172 241.900 286.143 235.890 1.00 0.00 C +ATOM 173 CA PRO A 173 244.017 289.183 236.782 1.00 0.00 C +ATOM 174 CA PRO A 174 247.593 289.129 238.097 1.00 0.00 C +ATOM 175 CA ALA A 175 249.231 292.568 238.004 1.00 0.00 C +ATOM 176 CA ALA A 176 252.588 293.403 236.408 1.00 0.00 C +ATOM 177 CA GLU A 177 252.106 294.087 232.691 1.00 0.00 C +ATOM 178 CA GLY A 178 254.553 296.179 230.653 1.00 0.00 C +ATOM 179 CA GLU A 179 257.991 296.371 232.284 1.00 0.00 C +ATOM 180 CA ARG A 180 261.621 295.696 233.224 1.00 0.00 C +ATOM 181 CA GLY A 181 264.770 294.342 234.887 1.00 0.00 C +ATOM 182 CA ARG A 182 265.396 291.909 237.752 1.00 0.00 C +ATOM 183 CA GLY A 183 265.300 288.108 237.987 1.00 0.00 C +ATOM 184 CA ARG A 184 268.743 286.918 239.104 1.00 0.00 C +ATOM 185 CA GLU A 185 272.325 286.873 237.807 1.00 0.00 C +ATOM 186 CA GLY A 186 272.283 285.338 234.321 1.00 0.00 C +ATOM 187 CA PRO A 187 273.640 281.869 233.520 1.00 0.00 C +ATOM 188 CA PRO A 188 274.729 281.780 229.870 1.00 0.00 C +ATOM 189 CA PRO A 189 277.190 284.029 228.026 1.00 0.00 C +ATOM 190 CA ALA A 190 277.823 282.388 224.646 1.00 0.00 C +ATOM 191 CA GLY A 191 278.045 284.003 221.202 1.00 0.00 C +ATOM 192 CA GLN A 192 277.078 283.045 217.643 1.00 0.00 C +ATOM 193 CA GLU A 193 273.703 281.699 216.496 1.00 0.00 C +ATOM 194 CA ARG A 194 272.224 278.188 216.445 1.00 0.00 C +ATOM 195 CA ARG A 195 269.921 277.525 219.407 1.00 0.00 C +ATOM 196 CA GLY A 196 269.138 280.724 221.323 1.00 0.00 C +ATOM 197 CA VAL A 197 267.290 281.666 224.518 1.00 0.00 C +ATOM 198 CA GLY A 198 265.260 284.641 225.760 1.00 0.00 C +ATOM 199 CA GLY A 199 266.560 287.376 228.072 1.00 0.00 C +ATOM 200 CA GLU A 200 268.823 290.316 227.207 1.00 0.00 C +ATOM 201 CA TRP A 201 269.509 293.379 225.046 1.00 0.00 C +ATOM 202 CA SER A 202 267.482 296.597 224.817 1.00 0.00 C +ATOM 203 CA GLY A 203 265.791 299.949 224.169 1.00 0.00 C +ATOM 204 CA ARG A 204 266.793 302.551 226.766 1.00 0.00 C +ATOM 205 CA GLU A 205 268.097 302.796 230.337 1.00 0.00 C +ATOM 206 CA PRO A 206 270.648 305.621 230.493 1.00 0.00 C +ATOM 207 CA GLU A 207 274.316 306.324 229.737 1.00 0.00 C +ATOM 208 CA ARG A 208 276.365 307.517 232.719 1.00 0.00 C +ATOM 209 CA GLU A 209 279.454 307.768 234.935 1.00 0.00 C +ATOM 210 CA ARG A 210 281.992 309.947 236.759 1.00 0.00 C +ATOM 211 CA VAL A 211 281.617 311.230 240.327 1.00 0.00 C +ATOM 212 CA ARG A 212 280.422 309.792 243.647 1.00 0.00 C +ATOM 213 CA THR A 213 281.170 308.829 247.256 1.00 0.00 C +ATOM 214 CA LYS A 214 281.878 306.355 250.066 1.00 0.00 C +ATOM 215 CA GLU A 215 280.088 307.452 253.246 1.00 0.00 C +ATOM 216 CA VAL A 216 277.667 305.659 255.579 1.00 0.00 C +ATOM 217 CA GLU A 217 273.952 305.051 254.989 1.00 0.00 C +TER 218 GLU A 217 +END diff --git a/Plants/Q94JA3/Q94JA3.dcd b/Plants/Q94JA3/Q94JA3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..4f46b0695100aa549bf96bbb8673daf1069955a4 --- /dev/null +++ b/Plants/Q94JA3/Q94JA3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:7c1d2fb80d4cf71a2691001494c42793fa36072e888b918537b6b6c5ffd2569d +size 11840276 diff --git a/Plants/Q94JA3/top.pdb b/Plants/Q94JA3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..28e98340eaf66546736e38ad2e96608e25f7aefe --- /dev/null +++ b/Plants/Q94JA3/top.pdb @@ -0,0 +1,96 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 254.208 210.153 238.855 1.00 0.00 C +ATOM 2 CA ALA A 2 254.223 211.888 242.247 1.00 0.00 C +ATOM 3 CA GLY A 3 252.879 214.396 244.780 1.00 0.00 C +ATOM 4 CA ASP A 4 254.594 217.773 245.189 1.00 0.00 C +ATOM 5 CA LYS A 5 257.118 220.458 244.222 1.00 0.00 C +ATOM 6 CA THR A 6 260.370 218.767 243.184 1.00 0.00 C +ATOM 7 CA ALA A 7 263.508 219.364 245.260 1.00 0.00 C +ATOM 8 CA ALA A 8 264.174 223.105 245.537 1.00 0.00 C +ATOM 9 CA PRO A 9 261.409 225.720 245.721 1.00 0.00 C +ATOM 10 CA PRO A 10 261.955 228.436 243.105 1.00 0.00 C +ATOM 11 CA PRO A 11 264.779 228.278 240.552 1.00 0.00 C +ATOM 12 CA PRO A 12 267.330 231.048 241.128 1.00 0.00 C +ATOM 13 CA ASP A 13 268.413 234.164 243.034 1.00 0.00 C +ATOM 14 CA ALA A 14 269.596 237.769 242.689 1.00 0.00 C +ATOM 15 CA ALA A 15 270.889 241.309 243.246 1.00 0.00 C +ATOM 16 CA ALA A 16 269.872 244.973 243.002 1.00 0.00 C +ATOM 17 CA PHE A 17 266.389 245.187 241.474 1.00 0.00 C +ATOM 18 CA SER A 18 264.040 244.449 244.382 1.00 0.00 C +ATOM 19 CA PRO A 19 265.411 241.391 246.195 1.00 0.00 C +ATOM 20 CA ASP A 20 263.033 238.503 246.912 1.00 0.00 C +ATOM 21 CA GLY A 21 261.168 237.240 243.839 1.00 0.00 C +ATOM 22 CA GLU A 22 257.758 236.183 242.507 1.00 0.00 C +ATOM 23 CA LEU A 23 255.074 235.525 239.884 1.00 0.00 C +ATOM 24 CA PHE A 24 255.404 236.288 236.166 1.00 0.00 C +ATOM 25 CA ALA A 25 253.225 239.331 235.451 1.00 0.00 C +ATOM 26 CA ALA A 26 254.413 242.859 234.639 1.00 0.00 C +ATOM 27 CA VAL A 27 254.321 245.806 237.051 1.00 0.00 C +ATOM 28 CA SER A 28 252.343 245.911 240.305 1.00 0.00 C +ATOM 29 CA ASP A 29 253.564 245.149 243.833 1.00 0.00 C +ATOM 30 CA ARG A 30 255.125 246.145 247.163 1.00 0.00 C +ATOM 31 CA ARG A 31 253.232 245.704 250.440 1.00 0.00 C +ATOM 32 CA VAL A 32 251.165 247.394 253.158 1.00 0.00 C +ATOM 33 CA GLN A 33 247.768 248.461 254.513 1.00 0.00 C +ATOM 34 CA VAL A 34 244.269 247.974 255.941 1.00 0.00 C +ATOM 35 CA SER A 35 241.479 247.573 258.505 1.00 0.00 C +ATOM 36 CA ASP A 36 238.405 249.768 259.001 1.00 0.00 C +ATOM 37 CA GLY A 37 235.228 249.758 256.898 1.00 0.00 C +ATOM 38 CA GLU A 38 235.614 247.696 253.717 1.00 0.00 C +ATOM 39 CA THR A 39 235.208 243.938 254.189 1.00 0.00 C +ATOM 40 CA ASP A 40 233.488 241.873 251.488 1.00 0.00 C +ATOM 41 CA GLU A 41 234.285 238.811 249.366 1.00 0.00 C +ATOM 42 CA GLU A 42 237.015 236.298 248.499 1.00 0.00 C +ATOM 43 CA ASP A 43 240.203 237.559 246.836 1.00 0.00 C +ATOM 44 CA ALA A 44 243.878 237.285 247.801 1.00 0.00 C +ATOM 45 CA VAL A 45 247.218 238.521 249.156 1.00 0.00 C +ATOM 46 CA PRO A 46 250.913 239.081 248.414 1.00 0.00 C +ATOM 47 CA PRO A 47 253.603 238.754 251.092 1.00 0.00 C +ATOM 48 CA ILE A 48 253.905 238.639 254.889 1.00 0.00 C +ATOM 49 CA ILE A 49 254.944 241.391 257.309 1.00 0.00 C +ATOM 50 CA TYR A 50 253.359 244.559 258.713 1.00 0.00 C +ATOM 51 CA GLU A 51 250.511 246.163 260.672 1.00 0.00 C +ATOM 52 CA ASP A 52 249.940 249.904 261.112 1.00 0.00 C +ATOM 53 CA LYS A 53 249.983 253.631 261.899 1.00 0.00 C +ATOM 54 CA ASP A 54 253.506 254.873 261.150 1.00 0.00 C +ATOM 55 CA THR A 55 254.624 257.915 263.153 1.00 0.00 C +ATOM 56 CA ASP A 56 254.578 260.501 265.951 1.00 0.00 C +ATOM 57 CA ASP A 57 252.668 263.764 266.422 1.00 0.00 C +ATOM 58 CA GLU A 58 250.757 266.986 267.113 1.00 0.00 C +ATOM 59 CA GLU A 59 248.949 270.272 266.440 1.00 0.00 C +ATOM 60 CA SER A 60 251.381 273.026 265.431 1.00 0.00 C +ATOM 61 CA GLU A 61 250.443 276.148 267.403 1.00 0.00 C +ATOM 62 CA VAL A 62 247.237 278.153 266.932 1.00 0.00 C +ATOM 63 CA ASP A 63 245.636 278.950 263.568 1.00 0.00 C +ATOM 64 CA ALA A 64 243.192 276.604 261.825 1.00 0.00 C +ATOM 65 CA MET A 65 242.479 274.341 258.844 1.00 0.00 C +ATOM 66 CA GLU A 66 243.963 274.881 255.377 1.00 0.00 C +ATOM 67 CA THR A 67 247.676 274.146 255.810 1.00 0.00 C +ATOM 68 CA ASP A 68 249.834 271.490 257.485 1.00 0.00 C +ATOM 69 CA GLU A 69 248.290 269.700 260.473 1.00 0.00 C +ATOM 70 CA GLU A 70 244.752 268.320 260.173 1.00 0.00 C +ATOM 71 CA SER A 71 241.648 266.257 259.380 1.00 0.00 C +ATOM 72 CA GLN A 72 242.794 263.841 256.666 1.00 0.00 C +ATOM 73 CA GLU A 73 241.677 260.292 255.847 1.00 0.00 C +ATOM 74 CA LEU A 74 240.311 256.818 256.608 1.00 0.00 C +ATOM 75 CA GLY A 75 242.812 253.947 256.465 1.00 0.00 C +ATOM 76 CA ASP A 76 243.309 253.141 252.775 1.00 0.00 C +ATOM 77 CA VAL A 77 243.942 252.773 249.036 1.00 0.00 C +ATOM 78 CA THR A 78 247.512 253.792 248.181 1.00 0.00 C +ATOM 79 CA ASP A 79 247.824 254.625 244.476 1.00 0.00 C +ATOM 80 CA ALA A 80 244.406 254.788 242.801 1.00 0.00 C +ATOM 81 CA SER A 81 241.725 257.309 241.816 1.00 0.00 C +ATOM 82 CA GLU A 82 240.979 260.909 240.815 1.00 0.00 C +ATOM 83 CA HIS A 83 239.363 264.342 240.467 1.00 0.00 C +ATOM 84 CA SER A 84 239.229 266.778 237.541 1.00 0.00 C +ATOM 85 CA ASP A 85 241.515 269.744 236.837 1.00 0.00 C +ATOM 86 CA GLY A 86 243.279 271.941 239.401 1.00 0.00 C +ATOM 87 CA SER A 87 246.495 273.477 240.748 1.00 0.00 C +ATOM 88 CA ASP A 88 246.124 275.823 243.727 1.00 0.00 C +ATOM 89 CA ILE A 89 242.424 276.728 243.814 1.00 0.00 C +ATOM 90 CA MET A 90 238.735 277.289 244.583 1.00 0.00 C +ATOM 91 CA THR A 91 236.920 274.221 243.236 1.00 0.00 C +ATOM 92 CA ASP A 92 234.808 272.788 246.065 1.00 0.00 C +TER 93 ASP A 92 +END diff --git a/Plants/Q94JJ6/Q94JJ6.dcd b/Plants/Q94JJ6/Q94JJ6.dcd new file mode 100644 index 0000000000000000000000000000000000000000..d0212b1441644e9cbb29fcfe403507013381db21 --- /dev/null +++ b/Plants/Q94JJ6/Q94JJ6.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:0cd18063960815bce0a29b0aa83234e9113dbba03fbcabf6be86d7a7b608af92 +size 10040276 diff --git a/Plants/Q94JJ6/top.pdb b/Plants/Q94JJ6/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..0f927c01259522dbb15e9ed0accf15258030caae --- /dev/null +++ b/Plants/Q94JJ6/top.pdb @@ -0,0 +1,81 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 225.910 275.940 227.321 1.00 0.00 C +ATOM 2 CA ALA A 2 224.046 277.545 230.231 1.00 0.00 C +ATOM 3 CA VAL A 3 223.760 275.205 233.224 1.00 0.00 C +ATOM 4 CA GLY A 4 222.251 272.845 235.807 1.00 0.00 C +ATOM 5 CA GLY A 5 222.010 269.500 233.998 1.00 0.00 C +ATOM 6 CA MET A 6 220.354 269.334 230.571 1.00 0.00 C +ATOM 7 CA SER A 7 221.370 271.529 227.627 1.00 0.00 C +ATOM 8 CA ARG A 8 223.606 269.469 225.331 1.00 0.00 C +ATOM 9 CA GLY A 9 227.261 268.815 224.478 1.00 0.00 C +ATOM 10 CA PRO A 10 230.709 268.294 222.943 1.00 0.00 C +ATOM 11 CA SER A 11 233.698 266.594 224.584 1.00 0.00 C +ATOM 12 CA THR A 12 232.491 265.108 227.878 1.00 0.00 C +ATOM 13 CA GLU A 13 233.109 265.462 231.621 1.00 0.00 C +ATOM 14 CA PRO A 14 234.711 263.198 234.232 1.00 0.00 C +ATOM 15 CA ALA A 15 233.339 259.680 234.741 1.00 0.00 C +ATOM 16 CA GLU A 16 233.670 256.802 237.216 1.00 0.00 C +ATOM 17 CA THR A 17 236.212 256.134 239.974 1.00 0.00 C +ATOM 18 CA SER A 18 238.426 253.467 241.554 1.00 0.00 C +ATOM 19 CA LEU A 19 241.117 251.506 239.701 1.00 0.00 C +ATOM 20 CA GLN A 20 242.269 248.688 237.411 1.00 0.00 C +ATOM 21 CA SER A 21 239.900 247.415 234.713 1.00 0.00 C +ATOM 22 CA LEU A 22 236.991 249.876 234.742 1.00 0.00 C +ATOM 23 CA GLY A 23 234.880 249.192 237.838 1.00 0.00 C +ATOM 24 CA ARG A 24 231.560 248.849 239.676 1.00 0.00 C +ATOM 25 CA SER A 25 228.023 249.501 240.935 1.00 0.00 C +ATOM 26 CA THR A 26 226.307 246.668 242.818 1.00 0.00 C +ATOM 27 CA THR A 27 228.900 243.890 243.085 1.00 0.00 C +ATOM 28 CA ALA A 28 232.348 244.007 244.701 1.00 0.00 C +ATOM 29 CA LYS A 29 235.500 244.012 242.560 1.00 0.00 C +ATOM 30 CA ARG A 30 239.226 244.050 241.767 1.00 0.00 C +ATOM 31 CA GLN A 31 242.088 245.969 243.393 1.00 0.00 C +ATOM 32 CA MET A 32 240.594 247.771 246.399 1.00 0.00 C +ATOM 33 CA SER A 33 239.939 248.110 250.137 1.00 0.00 C +ATOM 34 CA GLN A 34 236.739 249.970 251.041 1.00 0.00 C +ATOM 35 CA ARG A 35 236.451 253.229 249.089 1.00 0.00 C +ATOM 36 CA GLN A 36 235.607 256.630 247.593 1.00 0.00 C +ATOM 37 CA ARG A 37 234.116 259.063 250.117 1.00 0.00 C +ATOM 38 CA LEU A 38 236.510 260.333 252.795 1.00 0.00 C +ATOM 39 CA TRP A 39 237.643 261.555 256.221 1.00 0.00 C +ATOM 40 CA ALA A 40 236.339 259.939 259.416 1.00 0.00 C +ATOM 41 CA ASN A 41 236.238 257.042 261.888 1.00 0.00 C +ATOM 42 CA ARG A 42 235.445 253.332 261.542 1.00 0.00 C +ATOM 43 CA ARG A 43 234.210 251.129 264.395 1.00 0.00 C +ATOM 44 CA ALA A 44 233.467 247.476 265.183 1.00 0.00 C +ATOM 45 CA LYS A 45 235.673 244.425 264.599 1.00 0.00 C +ATOM 46 CA PRO A 46 238.719 244.458 266.887 1.00 0.00 C +ATOM 47 CA LYS A 47 241.701 246.759 266.312 1.00 0.00 C +ATOM 48 CA THR A 48 244.605 246.721 268.779 1.00 0.00 C +ATOM 49 CA PHE A 49 248.127 246.592 267.332 1.00 0.00 C +ATOM 50 CA ALA A 50 249.884 243.898 265.289 1.00 0.00 C +ATOM 51 CA PRO A 51 251.248 242.253 262.135 1.00 0.00 C +ATOM 52 CA LYS A 52 253.417 239.334 260.998 1.00 0.00 C +ATOM 53 CA PRO A 53 253.092 235.560 260.588 1.00 0.00 C +ATOM 54 CA ARG A 54 255.489 232.612 260.871 1.00 0.00 C +ATOM 55 CA ASP A 55 256.184 229.340 259.047 1.00 0.00 C +ATOM 56 CA SER A 56 259.070 228.047 256.921 1.00 0.00 C +ATOM 57 CA ARG A 57 262.848 227.621 257.158 1.00 0.00 C +ATOM 58 CA PRO A 58 266.480 226.474 257.265 1.00 0.00 C +ATOM 59 CA GLU A 59 269.495 228.796 257.074 1.00 0.00 C +ATOM 60 CA GLY A 60 272.455 230.828 258.350 1.00 0.00 C +ATOM 61 CA ALA A 61 275.988 230.030 259.530 1.00 0.00 C +ATOM 62 CA ASN A 62 278.741 230.491 262.123 1.00 0.00 C +ATOM 63 CA GLN A 63 279.295 234.219 262.681 1.00 0.00 C +ATOM 64 CA PRO A 64 281.511 237.313 262.861 1.00 0.00 C +ATOM 65 CA MET A 65 284.315 237.748 265.403 1.00 0.00 C +ATOM 66 CA GLU A 66 286.741 238.500 268.243 1.00 0.00 C +ATOM 67 CA ALA A 67 290.301 237.146 268.339 1.00 0.00 C +ATOM 68 CA HIS A 68 292.213 238.379 265.283 1.00 0.00 C +ATOM 69 CA LEU A 69 291.297 240.897 262.574 1.00 0.00 C +ATOM 70 CA ALA A 70 290.956 244.049 260.461 1.00 0.00 C +ATOM 71 CA ALA A 71 292.586 247.431 261.110 1.00 0.00 C +ATOM 72 CA GLN A 72 295.614 249.348 262.403 1.00 0.00 C +ATOM 73 CA GLU A 73 297.784 252.475 262.558 1.00 0.00 C +ATOM 74 CA GLU A 74 301.515 251.955 261.983 1.00 0.00 C +ATOM 75 CA ALA A 75 303.624 253.484 259.203 1.00 0.00 C +ATOM 76 CA GLN A 76 301.347 255.477 256.889 1.00 0.00 C +ATOM 77 CA GLY A 77 298.343 253.218 256.266 1.00 0.00 C +TER 78 GLY A 77 +END diff --git a/Plants/Q94JS2/Q94JS2.dcd b/Plants/Q94JS2/Q94JS2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..e73cc63dc4921f9a1f5ff5f1d041d219dac6fb89 --- /dev/null +++ b/Plants/Q94JS2/Q94JS2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:6172d4f16b304aa58d96a14154bc07b5b9f2cdd40c6a69f0c85a69422e410497 +size 7640276 diff --git a/Plants/Q94JS2/top.pdb b/Plants/Q94JS2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..d21a66f44bed4bbb2d5ca98a3c87ba3b73cf4fac --- /dev/null +++ b/Plants/Q94JS2/top.pdb @@ -0,0 +1,61 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 239.434 235.016 264.810 1.00 0.00 C +ATOM 2 CA ARG A 2 242.102 235.858 267.396 1.00 0.00 C +ATOM 3 CA SER A 3 243.188 237.787 270.497 1.00 0.00 C +ATOM 4 CA THR A 4 245.588 240.701 269.981 1.00 0.00 C +ATOM 5 CA ARG A 5 247.159 244.106 269.307 1.00 0.00 C +ATOM 6 CA GLN A 6 247.820 247.772 270.106 1.00 0.00 C +ATOM 7 CA PRO A 7 244.406 249.422 269.730 1.00 0.00 C +ATOM 8 CA ARG A 8 244.167 253.095 270.712 1.00 0.00 C +ATOM 9 CA THR A 9 241.249 255.034 272.208 1.00 0.00 C +ATOM 10 CA THR A 10 242.330 256.527 275.543 1.00 0.00 C +ATOM 11 CA SER A 11 245.948 257.670 275.887 1.00 0.00 C +ATOM 12 CA GLN A 12 248.347 259.553 273.603 1.00 0.00 C +ATOM 13 CA ARG A 13 246.472 262.402 271.905 1.00 0.00 C +ATOM 14 CA PRO A 14 243.420 264.525 272.737 1.00 0.00 C +ATOM 15 CA ASN A 15 241.718 263.875 276.083 1.00 0.00 C +ATOM 16 CA PRO A 16 238.192 262.552 275.505 1.00 0.00 C +ATOM 17 CA LYS A 17 235.807 263.368 272.649 1.00 0.00 C +ATOM 18 CA HIS A 18 233.851 260.155 272.039 1.00 0.00 C +ATOM 19 CA ARG A 19 233.071 256.890 270.237 1.00 0.00 C +ATOM 20 CA SER A 20 229.693 255.556 269.086 1.00 0.00 C +ATOM 21 CA ASN A 21 228.944 253.659 265.867 1.00 0.00 C +ATOM 22 CA PRO A 22 228.169 252.946 262.206 1.00 0.00 C +ATOM 23 CA ILE A 23 231.510 252.807 260.381 1.00 0.00 C +ATOM 24 CA ASN A 24 232.829 254.930 257.505 1.00 0.00 C +ATOM 25 CA PRO A 25 232.694 257.942 255.176 1.00 0.00 C +ATOM 26 CA ILE A 26 229.201 258.530 253.772 1.00 0.00 C +ATOM 27 CA SER A 27 227.644 256.854 250.726 1.00 0.00 C +ATOM 28 CA GLN A 28 227.930 259.186 247.727 1.00 0.00 C +ATOM 29 CA THR A 29 231.503 260.424 247.265 1.00 0.00 C +ATOM 30 CA SER A 30 235.175 259.485 247.656 1.00 0.00 C +ATOM 31 CA SER A 31 237.439 260.615 244.807 1.00 0.00 C +ATOM 32 CA SER A 32 241.121 259.741 245.243 1.00 0.00 C +ATOM 33 CA ASN A 33 243.438 256.763 244.710 1.00 0.00 C +ATOM 34 CA ARG A 34 245.949 253.981 245.396 1.00 0.00 C +ATOM 35 CA CYS A 35 248.384 251.080 244.985 1.00 0.00 C +ATOM 36 CA LEU A 36 251.319 251.632 242.619 1.00 0.00 C +ATOM 37 CA PRO A 37 253.310 253.687 240.103 1.00 0.00 C +ATOM 38 CA LEU A 38 255.125 251.201 237.857 1.00 0.00 C +ATOM 39 CA PRO A 39 258.004 248.842 237.044 1.00 0.00 C +ATOM 40 CA TYR A 40 257.899 245.652 239.125 1.00 0.00 C +ATOM 41 CA PRO A 41 261.010 243.535 239.717 1.00 0.00 C +ATOM 42 CA PRO A 42 264.735 244.325 239.565 1.00 0.00 C +ATOM 43 CA SER A 43 265.523 244.462 235.840 1.00 0.00 C +ATOM 44 CA SER A 44 268.917 243.694 234.287 1.00 0.00 C +ATOM 45 CA PRO A 45 272.009 242.427 232.457 1.00 0.00 C +ATOM 46 CA PRO A 46 273.328 241.362 229.045 1.00 0.00 C +ATOM 47 CA SER A 47 276.365 239.630 227.531 1.00 0.00 C +ATOM 48 CA HIS A 48 277.885 240.745 224.220 1.00 0.00 C +ATOM 49 CA LYS A 49 280.976 241.027 222.010 1.00 0.00 C +ATOM 50 CA ILE A 50 280.495 240.413 218.281 1.00 0.00 C +ATOM 51 CA ARG A 51 278.650 237.109 217.835 1.00 0.00 C +ATOM 52 CA SER A 52 275.653 235.285 219.318 1.00 0.00 C +ATOM 53 CA HIS A 53 272.513 237.434 219.127 1.00 0.00 C +ATOM 54 CA LEU A 54 269.259 239.231 218.287 1.00 0.00 C +ATOM 55 CA ARG A 55 267.515 240.976 221.190 1.00 0.00 C +ATOM 56 CA PRO A 56 267.380 239.941 224.854 1.00 0.00 C +ATOM 57 CA PRO A 57 266.237 236.584 226.246 1.00 0.00 C +TER 58 PRO A 57 +END diff --git a/Plants/Q94L34/Q94L34.dcd b/Plants/Q94L34/Q94L34.dcd new file mode 100644 index 0000000000000000000000000000000000000000..0b2f160fab05f36f36b094e740379d4b3d54223b --- /dev/null +++ b/Plants/Q94L34/Q94L34.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:1b38f68067b028a470562833049093d37550b726770fdce43e38a838e940b1d2 +size 41700276 diff --git a/Plants/Q94L34/top.pdb b/Plants/Q94L34/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..12430863282403c8ff718c35258f68661d355d08 --- /dev/null +++ b/Plants/Q94L34/top.pdb @@ -0,0 +1,229 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA ASN A 1 313.541 257.421 240.867 1.00 0.00 C +ATOM 2 CA LEU A 2 314.491 257.373 244.556 1.00 0.00 C +ATOM 3 CA GLU A 3 313.828 260.202 247.020 1.00 0.00 C +ATOM 4 CA LYS A 4 312.652 261.719 250.311 1.00 0.00 C +ATOM 5 CA MET A 5 309.371 263.656 250.357 1.00 0.00 C +ATOM 6 CA ASN A 6 308.545 266.276 247.717 1.00 0.00 C +ATOM 7 CA LEU A 7 307.945 264.825 244.245 1.00 0.00 C +ATOM 8 CA PRO A 8 305.337 262.193 243.359 1.00 0.00 C +ATOM 9 CA THR A 9 302.954 263.539 240.709 1.00 0.00 C +ATOM 10 CA LYS A 10 301.890 263.105 237.076 1.00 0.00 C +ATOM 11 CA PRO A 11 299.323 263.578 234.300 1.00 0.00 C +ATOM 12 CA SER A 12 296.504 261.022 234.484 1.00 0.00 C +ATOM 13 CA GLY A 13 293.943 260.824 231.670 1.00 0.00 C +ATOM 14 CA SER A 14 290.270 259.997 231.084 1.00 0.00 C +ATOM 15 CA THR A 15 287.816 261.607 233.513 1.00 0.00 C +ATOM 16 CA GLY A 16 284.092 260.870 233.190 1.00 0.00 C +ATOM 17 CA ASP A 17 281.767 262.340 235.825 1.00 0.00 C +ATOM 18 CA MET A 18 279.776 264.140 238.530 1.00 0.00 C +ATOM 19 CA THR A 19 281.112 266.497 241.208 1.00 0.00 C +ATOM 20 CA ARG A 20 281.155 266.818 245.005 1.00 0.00 C +ATOM 21 CA GLY A 21 278.819 268.823 247.250 1.00 0.00 C +ATOM 22 CA SER A 22 276.591 270.081 250.072 1.00 0.00 C +ATOM 23 CA GLU A 23 277.299 268.059 253.223 1.00 0.00 C +ATOM 24 CA ASP A 24 276.372 267.317 256.843 1.00 0.00 C +ATOM 25 CA THR A 25 279.140 267.857 259.404 1.00 0.00 C +ATOM 26 CA ALA A 26 282.190 269.155 261.283 1.00 0.00 C +ATOM 27 CA ARG A 27 285.924 268.461 261.583 1.00 0.00 C +ATOM 28 CA ARG A 28 287.528 271.852 262.250 1.00 0.00 C +ATOM 29 CA PRO A 29 286.169 275.406 262.058 1.00 0.00 C +ATOM 30 CA PRO A 30 282.544 276.082 261.102 1.00 0.00 C +ATOM 31 CA SER A 31 279.224 276.956 262.754 1.00 0.00 C +ATOM 32 CA VAL A 32 279.447 276.254 266.492 1.00 0.00 C +ATOM 33 CA LYS A 33 279.911 272.723 267.846 1.00 0.00 C +ATOM 34 CA ALA A 34 278.812 272.583 271.492 1.00 0.00 C +ATOM 35 CA SER A 35 277.807 274.838 274.394 1.00 0.00 C +ATOM 36 CA LEU A 36 279.482 274.894 277.816 1.00 0.00 C +ATOM 37 CA SER A 37 281.007 274.090 281.214 1.00 0.00 C +ATOM 38 CA VAL A 38 280.973 270.284 281.372 1.00 0.00 C +ATOM 39 CA SER A 39 278.853 268.061 279.117 1.00 0.00 C +ATOM 40 CA PHE A 40 278.145 266.466 275.730 1.00 0.00 C +ATOM 41 CA GLY A 41 275.591 263.964 274.415 1.00 0.00 C +ATOM 42 CA GLN A 42 272.793 261.378 274.481 1.00 0.00 C +ATOM 43 CA ARG A 43 272.442 257.647 273.793 1.00 0.00 C +ATOM 44 CA ALA A 44 272.622 255.823 270.453 1.00 0.00 C +ATOM 45 CA PRO A 45 269.285 255.871 268.617 1.00 0.00 C +ATOM 46 CA HIS A 46 267.642 255.590 265.190 1.00 0.00 C +ATOM 47 CA ARG A 47 267.864 254.725 261.487 1.00 0.00 C +ATOM 48 CA ALA A 48 267.444 250.952 261.161 1.00 0.00 C +ATOM 49 CA SER A 49 267.831 249.665 257.596 1.00 0.00 C +ATOM 50 CA THR A 50 265.601 246.936 256.147 1.00 0.00 C +ATOM 51 CA ARG A 51 263.193 243.989 255.959 1.00 0.00 C +ATOM 52 CA GLY A 52 259.575 245.144 255.651 1.00 0.00 C +ATOM 53 CA SER A 53 256.267 243.334 255.108 1.00 0.00 C +ATOM 54 CA SER A 54 254.362 243.760 258.380 1.00 0.00 C +ATOM 55 CA PRO A 55 250.769 244.990 258.067 1.00 0.00 C +ATOM 56 CA VAL A 56 248.561 242.582 260.028 1.00 0.00 C +ATOM 57 CA ARG A 57 246.339 240.234 262.044 1.00 0.00 C +ATOM 58 CA ARG A 58 242.788 241.366 262.833 1.00 0.00 C +ATOM 59 CA PRO A 59 239.519 241.625 260.894 1.00 0.00 C +ATOM 60 CA PRO A 60 238.554 245.091 259.640 1.00 0.00 C +ATOM 61 CA PRO A 61 240.680 247.756 257.939 1.00 0.00 C +ATOM 62 CA THR A 62 241.004 247.852 254.144 1.00 0.00 C +ATOM 63 CA GLY A 63 243.182 245.564 252.015 1.00 0.00 C +ATOM 64 CA TYR A 64 244.457 245.435 248.427 1.00 0.00 C +ATOM 65 CA ASP A 65 245.290 243.389 245.322 1.00 0.00 C +ATOM 66 CA ARG A 66 243.113 243.377 242.196 1.00 0.00 C +ATOM 67 CA ASN A 67 242.663 245.944 239.417 1.00 0.00 C +ATOM 68 CA GLY A 68 240.095 248.682 240.070 1.00 0.00 C +ATOM 69 CA GLY A 69 237.689 250.165 242.625 1.00 0.00 C +ATOM 70 CA ASP A 70 239.186 253.292 244.206 1.00 0.00 C +ATOM 71 CA GLU A 71 237.897 256.877 244.150 1.00 0.00 C +ATOM 72 CA VAL A 72 237.326 258.657 247.470 1.00 0.00 C +ATOM 73 CA GLN A 73 238.500 256.754 250.554 1.00 0.00 C +ATOM 74 CA GLN A 74 237.363 253.120 250.413 1.00 0.00 C +ATOM 75 CA ARG A 75 235.589 252.095 253.625 1.00 0.00 C +ATOM 76 CA SER A 76 231.975 251.699 254.763 1.00 0.00 C +ATOM 77 CA PRO A 77 229.735 250.389 251.973 1.00 0.00 C +ATOM 78 CA ARG A 78 227.147 250.898 249.223 1.00 0.00 C +ATOM 79 CA ARG A 79 225.968 248.590 246.431 1.00 0.00 C +ATOM 80 CA SER A 80 223.815 245.584 245.510 1.00 0.00 C +ATOM 81 CA GLN A 81 224.243 242.009 244.267 1.00 0.00 C +ATOM 82 CA SER A 82 225.929 238.788 245.408 1.00 0.00 C +ATOM 83 CA ARG A 83 224.901 235.406 243.987 1.00 0.00 C +ATOM 84 CA ASP A 84 221.893 233.298 244.998 1.00 0.00 C +ATOM 85 CA TYR A 85 221.773 230.341 242.597 1.00 0.00 C +ATOM 86 CA TYR A 86 223.874 228.854 239.788 1.00 0.00 C +ATOM 87 CA SER A 87 221.995 226.262 237.722 1.00 0.00 C +ATOM 88 CA ASP A 88 218.294 227.151 237.557 1.00 0.00 C +ATOM 89 CA ARG A 89 217.892 230.663 236.136 1.00 0.00 C +ATOM 90 CA ASP A 90 217.580 233.941 234.220 1.00 0.00 C +ATOM 91 CA SER A 91 217.458 236.419 231.328 1.00 0.00 C +ATOM 92 CA ASP A 92 219.479 237.851 228.433 1.00 0.00 C +ATOM 93 CA ARG A 93 221.378 240.660 226.695 1.00 0.00 C +ATOM 94 CA GLN A 94 223.822 243.576 226.501 1.00 0.00 C +ATOM 95 CA ARG A 95 226.538 246.247 226.577 1.00 0.00 C +ATOM 96 CA GLU A 96 229.797 246.609 224.636 1.00 0.00 C +ATOM 97 CA ARG A 97 232.165 249.451 225.548 1.00 0.00 C +ATOM 98 CA GLU A 98 233.424 252.769 224.161 1.00 0.00 C +ATOM 99 CA ARG A 99 231.817 255.615 226.119 1.00 0.00 C +ATOM 100 CA GLU A 100 229.510 257.437 228.543 1.00 0.00 C +ATOM 101 CA LYS A 101 231.003 258.254 231.952 1.00 0.00 C +ATOM 102 CA ASP A 102 234.528 256.941 232.557 1.00 0.00 C +ATOM 103 CA ARG A 103 235.286 253.338 233.535 1.00 0.00 C +ATOM 104 CA GLU A 104 234.213 249.838 232.479 1.00 0.00 C +ATOM 105 CA ARG A 105 235.550 246.618 230.943 1.00 0.00 C +ATOM 106 CA GLU A 106 238.424 244.665 232.507 1.00 0.00 C +ATOM 107 CA ARG A 107 241.402 246.778 233.597 1.00 0.00 C +ATOM 108 CA GLY A 108 241.927 250.331 232.325 1.00 0.00 C +ATOM 109 CA ARG A 109 243.601 253.711 231.786 1.00 0.00 C +ATOM 110 CA ASP A 110 245.642 255.873 234.168 1.00 0.00 C +ATOM 111 CA ARG A 111 248.571 254.449 236.144 1.00 0.00 C +ATOM 112 CA TYR A 112 248.978 252.154 239.158 1.00 0.00 C +ATOM 113 CA ARG A 113 247.788 252.828 242.714 1.00 0.00 C +ATOM 114 CA GLU A 114 249.251 254.292 245.913 1.00 0.00 C +ATOM 115 CA ARG A 115 249.197 255.124 249.631 1.00 0.00 C +ATOM 116 CA GLU A 116 249.533 253.106 252.845 1.00 0.00 C +ATOM 117 CA ARG A 117 248.062 254.670 255.993 1.00 0.00 C +ATOM 118 CA ASP A 118 247.222 252.484 258.998 1.00 0.00 C +ATOM 119 CA TYR A 119 244.905 252.137 262.003 1.00 0.00 C +ATOM 120 CA GLY A 120 246.597 249.776 264.469 1.00 0.00 C +ATOM 121 CA ASN A 121 244.692 247.196 266.527 1.00 0.00 C +ATOM 122 CA ASP A 122 246.154 244.373 268.626 1.00 0.00 C +ATOM 123 CA ARG A 123 246.029 240.570 268.825 1.00 0.00 C +ATOM 124 CA ARG A 124 249.510 239.498 269.941 1.00 0.00 C +ATOM 125 CA SER A 125 252.565 240.116 272.132 1.00 0.00 C +ATOM 126 CA ARG A 126 255.737 240.908 274.089 1.00 0.00 C +ATOM 127 CA ARG A 127 256.653 244.507 273.238 1.00 0.00 C +ATOM 128 CA ASP A 128 256.221 247.214 270.593 1.00 0.00 C +ATOM 129 CA TYR A 129 257.706 250.722 270.642 1.00 0.00 C +ATOM 130 CA ASP A 130 255.026 253.428 270.764 1.00 0.00 C +ATOM 131 CA SER A 131 255.496 256.958 269.411 1.00 0.00 C +ATOM 132 CA ARG A 132 257.792 259.741 268.187 1.00 0.00 C +ATOM 133 CA SER A 133 260.025 260.956 265.348 1.00 0.00 C +ATOM 134 CA ARG A 134 259.786 260.339 261.596 1.00 0.00 C +ATOM 135 CA ARG A 135 261.161 262.167 258.549 1.00 0.00 C +ATOM 136 CA ASN A 136 262.563 261.997 255.011 1.00 0.00 C +ATOM 137 CA ASP A 137 262.476 263.534 251.526 1.00 0.00 C +ATOM 138 CA TYR A 138 262.253 263.192 247.738 1.00 0.00 C +ATOM 139 CA GLU A 139 260.812 259.775 246.863 1.00 0.00 C +ATOM 140 CA ASP A 140 257.737 258.127 245.332 1.00 0.00 C +ATOM 141 CA ASP A 141 256.961 258.864 241.675 1.00 0.00 C +ATOM 142 CA ARG A 142 258.698 256.261 239.503 1.00 0.00 C +ATOM 143 CA SER A 143 258.380 254.591 236.093 1.00 0.00 C +ATOM 144 CA ARG A 144 257.640 255.049 232.384 1.00 0.00 C +ATOM 145 CA HIS A 145 257.609 258.560 230.903 1.00 0.00 C +ATOM 146 CA ASP A 146 256.090 261.554 229.103 1.00 0.00 C +ATOM 147 CA ARG A 147 252.739 261.536 227.291 1.00 0.00 C +ATOM 148 CA ARG A 148 253.124 262.326 223.584 1.00 0.00 C +ATOM 149 CA SER A 149 256.761 263.312 223.016 1.00 0.00 C +ATOM 150 CA ARG A 150 259.830 261.371 224.168 1.00 0.00 C +ATOM 151 CA SER A 151 262.982 261.914 226.239 1.00 0.00 C +ATOM 152 CA ARG A 152 263.708 258.927 228.490 1.00 0.00 C +ATOM 153 CA SER A 153 263.676 258.640 232.289 1.00 0.00 C +ATOM 154 CA ARG A 154 262.904 261.309 234.897 1.00 0.00 C +ATOM 155 CA SER A 155 260.513 264.254 234.543 1.00 0.00 C +ATOM 156 CA ARG A 156 256.956 265.619 234.595 1.00 0.00 C +ATOM 157 CA SER A 157 253.887 264.512 236.563 1.00 0.00 C +ATOM 158 CA ARG A 158 252.666 265.110 240.122 1.00 0.00 C +ATOM 159 CA SER A 159 250.837 262.127 241.629 1.00 0.00 C +ATOM 160 CA VAL A 160 248.130 263.687 243.810 1.00 0.00 C +ATOM 161 CA GLN A 161 245.056 264.455 245.925 1.00 0.00 C +ATOM 162 CA ILE A 162 242.087 262.854 247.697 1.00 0.00 C +ATOM 163 CA GLU A 163 241.530 263.964 251.299 1.00 0.00 C +ATOM 164 CA ARG A 164 238.148 265.369 252.351 1.00 0.00 C +ATOM 165 CA GLU A 165 236.546 268.631 253.496 1.00 0.00 C +ATOM 166 CA PRO A 166 233.025 269.645 252.451 1.00 0.00 C +ATOM 167 CA THR A 167 231.067 271.792 254.915 1.00 0.00 C +ATOM 168 CA PRO A 168 227.358 272.560 254.508 1.00 0.00 C +ATOM 169 CA LYS A 169 223.957 270.964 255.145 1.00 0.00 C +ATOM 170 CA ARG A 170 223.023 267.967 257.303 1.00 0.00 C +ATOM 171 CA ASP A 171 222.234 265.052 254.981 1.00 0.00 C +ATOM 172 CA SER A 172 223.279 262.076 252.843 1.00 0.00 C +ATOM 173 CA SER A 173 224.936 258.886 251.580 1.00 0.00 C +ATOM 174 CA ASN A 174 224.077 256.082 254.011 1.00 0.00 C +ATOM 175 CA LYS A 175 222.588 254.917 257.319 1.00 0.00 C +ATOM 176 CA GLU A 176 221.450 251.576 258.754 1.00 0.00 C +ATOM 177 CA LYS A 177 220.828 249.766 262.049 1.00 0.00 C +ATOM 178 CA SER A 178 219.662 247.603 264.961 1.00 0.00 C +ATOM 179 CA ALA A 179 221.368 244.196 264.963 1.00 0.00 C +ATOM 180 CA VAL A 180 222.431 240.771 266.250 1.00 0.00 C +ATOM 181 CA THR A 181 225.893 239.958 264.883 1.00 0.00 C +ATOM 182 CA VAL A 182 229.679 240.049 264.463 1.00 0.00 C +ATOM 183 CA ASN A 183 232.557 237.554 264.394 1.00 0.00 C +ATOM 184 CA SER A 184 234.513 237.382 261.129 1.00 0.00 C +ATOM 185 CA ASN A 185 234.940 237.596 257.349 1.00 0.00 C +ATOM 186 CA LEU A 186 232.759 239.414 254.810 1.00 0.00 C +ATOM 187 CA ALA A 187 232.964 238.107 251.237 1.00 0.00 C +ATOM 188 CA LYS A 188 232.127 234.397 251.461 1.00 0.00 C +ATOM 189 CA LEU A 189 230.571 232.671 254.480 1.00 0.00 C +ATOM 190 CA LYS A 190 228.570 235.203 256.506 1.00 0.00 C +ATOM 191 CA ASP A 191 228.830 234.475 260.236 1.00 0.00 C +ATOM 192 CA LEU A 192 230.653 231.245 261.106 1.00 0.00 C +ATOM 193 CA TYR A 193 230.670 228.773 264.006 1.00 0.00 C +ATOM 194 CA GLY A 194 229.628 230.058 267.437 1.00 0.00 C +ATOM 195 CA ASP A 195 230.846 233.274 269.077 1.00 0.00 C +ATOM 196 CA ALA A 196 234.430 234.307 269.854 1.00 0.00 C +ATOM 197 CA SER A 197 238.193 234.894 269.743 1.00 0.00 C +ATOM 198 CA SER A 198 241.559 233.693 268.422 1.00 0.00 C +ATOM 199 CA GLN A 199 244.189 231.049 269.200 1.00 0.00 C +ATOM 200 CA LYS A 200 246.696 230.679 266.355 1.00 0.00 C +ATOM 201 CA ARG A 201 248.634 229.143 263.456 1.00 0.00 C +ATOM 202 CA ASP A 202 248.216 226.107 261.192 1.00 0.00 C +ATOM 203 CA GLU A 203 246.747 225.441 257.740 1.00 0.00 C +ATOM 204 CA GLY A 204 244.171 227.050 255.440 1.00 0.00 C +ATOM 205 CA PHE A 205 241.257 228.087 253.216 1.00 0.00 C +ATOM 206 CA GLY A 206 238.083 228.237 255.318 1.00 0.00 C +ATOM 207 CA THR A 207 234.742 226.415 255.501 1.00 0.00 C +ATOM 208 CA ARG A 208 233.224 226.600 252.011 1.00 0.00 C +ATOM 209 CA LYS A 209 231.260 226.475 248.749 1.00 0.00 C +ATOM 210 CA ASP A 210 231.863 228.564 245.620 1.00 0.00 C +ATOM 211 CA SER A 211 229.216 228.551 242.880 1.00 0.00 C +ATOM 212 CA SER A 212 228.998 224.953 241.646 1.00 0.00 C +ATOM 213 CA SER A 213 231.624 222.448 242.805 1.00 0.00 C +ATOM 214 CA GLU A 214 234.598 221.104 244.772 1.00 0.00 C +ATOM 215 CA GLU A 215 237.698 219.034 243.980 1.00 0.00 C +ATOM 216 CA VAL A 216 237.144 215.798 242.047 1.00 0.00 C +ATOM 217 CA ILE A 217 235.057 212.884 240.756 1.00 0.00 C +ATOM 218 CA LYS A 218 232.609 213.136 237.847 1.00 0.00 C +ATOM 219 CA LEU A 219 232.991 211.489 234.433 1.00 0.00 C +ATOM 220 CA GLY A 220 231.955 213.737 231.536 1.00 0.00 C +ATOM 221 CA GLY A 221 232.733 217.238 230.250 1.00 0.00 C +ATOM 222 CA SER A 222 233.354 220.920 231.009 1.00 0.00 C +ATOM 223 CA SER A 223 233.805 223.230 234.005 1.00 0.00 C +ATOM 224 CA TRP A 224 230.842 225.586 234.440 1.00 0.00 C +ATOM 225 CA ARG A 225 230.071 229.289 234.892 1.00 0.00 C +TER 226 ARG A 225 +END diff --git a/Plants/Q94LD2/Q94LD2.dcd b/Plants/Q94LD2/Q94LD2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..e0aa5c7eaf154739fd7def441b8ba982de81394b --- /dev/null +++ b/Plants/Q94LD2/Q94LD2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:fe942e4b835fa079fdf7d1e778b879ec762e140ecbb69e2196987c3365a31290 +size 48180276 diff --git a/Plants/Q94LD2/top.pdb b/Plants/Q94LD2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..0ca76504fda18943ff956eafa2fe28d275f036b1 --- /dev/null +++ b/Plants/Q94LD2/top.pdb @@ -0,0 +1,265 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 314.575 192.884 313.282 1.00 0.00 C +ATOM 2 CA GLU A 2 314.863 193.847 316.957 1.00 0.00 C +ATOM 3 CA ALA A 3 315.648 197.158 318.670 1.00 0.00 C +ATOM 4 CA ALA A 4 315.766 200.944 318.259 1.00 0.00 C +ATOM 5 CA PRO A 5 317.454 203.524 320.498 1.00 0.00 C +ATOM 6 CA ARG A 6 321.256 203.372 320.691 1.00 0.00 C +ATOM 7 CA ASP A 7 322.457 199.863 319.819 1.00 0.00 C +ATOM 8 CA ASP A 8 325.739 199.067 318.056 1.00 0.00 C +ATOM 9 CA GLU A 9 329.168 198.791 316.418 1.00 0.00 C +ATOM 10 CA PRO A 10 329.098 197.566 312.811 1.00 0.00 C +ATOM 11 CA ALA A 11 329.681 200.348 310.275 1.00 0.00 C +ATOM 12 CA ARG A 12 326.596 201.323 308.262 1.00 0.00 C +ATOM 13 CA ARG A 13 327.820 202.590 304.884 1.00 0.00 C +ATOM 14 CA ASN A 14 328.488 201.072 301.454 1.00 0.00 C +ATOM 15 CA ASP A 15 325.642 199.919 299.198 1.00 0.00 C +ATOM 16 CA ASP A 16 326.175 199.889 295.426 1.00 0.00 C +ATOM 17 CA ASP A 17 323.621 199.968 292.600 1.00 0.00 C +ATOM 18 CA ASP A 18 320.007 198.764 292.500 1.00 0.00 C +ATOM 19 CA ASP A 19 319.379 195.173 293.607 1.00 0.00 C +ATOM 20 CA GLU A 20 319.858 191.535 292.584 1.00 0.00 C +ATOM 21 CA HIS A 21 316.959 189.106 292.126 1.00 0.00 C +ATOM 22 CA ARG A 22 314.373 186.497 291.113 1.00 0.00 C +ATOM 23 CA ARG A 23 312.144 183.846 289.527 1.00 0.00 C +ATOM 24 CA GLY A 24 312.949 181.011 287.112 1.00 0.00 C +ATOM 25 CA SER A 25 311.764 179.933 283.655 1.00 0.00 C +ATOM 26 CA VAL A 26 308.562 181.700 282.584 1.00 0.00 C +ATOM 27 CA GLU A 27 307.812 183.897 279.562 1.00 0.00 C +ATOM 28 CA GLY A 28 305.136 182.943 277.024 1.00 0.00 C +ATOM 29 CA GLU A 29 303.537 185.931 275.284 1.00 0.00 C +ATOM 30 CA ALA A 30 300.923 186.633 272.602 1.00 0.00 C +ATOM 31 CA ARG A 31 297.482 185.654 273.912 1.00 0.00 C +ATOM 32 CA PRO A 32 293.852 186.539 274.657 1.00 0.00 C +ATOM 33 CA ARG A 33 291.932 189.436 273.096 1.00 0.00 C +ATOM 34 CA ALA A 34 288.806 191.469 272.314 1.00 0.00 C +ATOM 35 CA THR A 35 286.292 194.292 271.834 1.00 0.00 C +ATOM 36 CA LEU A 36 285.178 194.699 268.213 1.00 0.00 C +ATOM 37 CA PRO A 37 287.793 193.461 265.734 1.00 0.00 C +ATOM 38 CA LEU A 38 291.301 193.035 264.310 1.00 0.00 C +ATOM 39 CA ARG A 39 294.195 194.324 266.427 1.00 0.00 C +ATOM 40 CA CYS A 40 297.690 194.864 267.843 1.00 0.00 C +ATOM 41 CA ARG A 41 300.661 193.016 266.335 1.00 0.00 C +ATOM 42 CA ARG A 42 302.466 190.806 263.810 1.00 0.00 C +ATOM 43 CA ARG A 43 305.392 192.052 261.712 1.00 0.00 C +ATOM 44 CA ARG A 44 308.106 194.706 262.046 1.00 0.00 C +ATOM 45 CA TRP A 45 308.937 197.930 263.898 1.00 0.00 C +ATOM 46 CA ARG A 46 309.166 200.123 267.005 1.00 0.00 C +ATOM 47 CA ARG A 47 308.365 203.511 268.554 1.00 0.00 C +ATOM 48 CA TRP A 48 307.347 206.283 270.962 1.00 0.00 C +ATOM 49 CA PRO A 49 303.934 207.974 270.923 1.00 0.00 C +ATOM 50 CA ALA A 50 300.824 205.885 271.616 1.00 0.00 C +ATOM 51 CA HIS A 51 297.218 204.705 271.265 1.00 0.00 C +ATOM 52 CA GLY A 52 293.970 203.547 269.645 1.00 0.00 C +ATOM 53 CA HIS A 53 291.758 205.961 267.698 1.00 0.00 C +ATOM 54 CA ASP A 54 291.154 209.548 266.562 1.00 0.00 C +ATOM 55 CA GLY A 55 289.178 211.491 263.947 1.00 0.00 C +ATOM 56 CA ARG A 56 285.601 211.562 265.257 1.00 0.00 C +ATOM 57 CA GLY A 57 284.468 215.089 266.149 1.00 0.00 C +ATOM 58 CA CYS A 58 281.972 215.158 269.027 1.00 0.00 C +ATOM 59 CA ARG A 59 278.647 216.243 270.537 1.00 0.00 C +ATOM 60 CA ARG A 60 275.129 217.482 269.761 1.00 0.00 C +ATOM 61 CA ASN A 61 271.967 216.370 271.573 1.00 0.00 C +ATOM 62 CA SER A 62 268.654 214.527 271.189 1.00 0.00 C +ATOM 63 CA GLY A 63 265.843 217.098 271.219 1.00 0.00 C +ATOM 64 CA GLU A 64 264.560 218.945 274.294 1.00 0.00 C +ATOM 65 CA ALA A 65 267.355 220.671 276.225 1.00 0.00 C +ATOM 66 CA GLU A 66 270.038 222.774 274.524 1.00 0.00 C +ATOM 67 CA GLY A 67 273.033 225.099 274.900 1.00 0.00 C +ATOM 68 CA GLU A 68 275.330 228.032 274.099 1.00 0.00 C +ATOM 69 CA THR A 69 279.129 228.147 273.827 1.00 0.00 C +ATOM 70 CA ASP A 70 280.288 225.678 271.167 1.00 0.00 C +ATOM 71 CA ALA A 71 281.312 224.400 267.727 1.00 0.00 C +ATOM 72 CA GLY A 72 284.263 222.517 266.222 1.00 0.00 C +ATOM 73 CA ASP A 73 287.789 223.313 267.426 1.00 0.00 C +ATOM 74 CA GLY A 74 290.158 220.874 265.708 1.00 0.00 C +ATOM 75 CA VAL A 75 289.028 219.669 262.275 1.00 0.00 C +ATOM 76 CA PRO A 76 290.029 219.094 258.644 1.00 0.00 C +ATOM 77 CA ALA A 77 286.802 218.831 256.636 1.00 0.00 C +ATOM 78 CA LYS A 78 283.158 219.079 257.718 1.00 0.00 C +ATOM 79 CA PRO A 79 280.372 220.425 255.494 1.00 0.00 C +ATOM 80 CA ARG A 80 281.236 222.188 252.229 1.00 0.00 C +ATOM 81 CA VAL A 81 279.648 221.702 248.800 1.00 0.00 C +ATOM 82 CA GLY A 82 281.880 219.145 247.069 1.00 0.00 C +ATOM 83 CA ARG A 83 282.478 218.791 243.323 1.00 0.00 C +ATOM 84 CA GLY A 84 285.032 221.261 241.947 1.00 0.00 C +ATOM 85 CA GLY A 85 286.829 224.160 243.644 1.00 0.00 C +ATOM 86 CA GLY A 86 286.579 227.480 245.496 1.00 0.00 C +ATOM 87 CA ARG A 87 283.240 228.249 247.161 1.00 0.00 C +ATOM 88 CA ARG A 88 282.014 231.053 249.431 1.00 0.00 C +ATOM 89 CA GLY A 89 281.532 234.789 248.861 1.00 0.00 C +ATOM 90 CA ASP A 90 280.035 235.537 245.438 1.00 0.00 C +ATOM 91 CA ALA A 91 279.328 239.247 244.936 1.00 0.00 C +ATOM 92 CA GLU A 92 279.477 242.893 243.842 1.00 0.00 C +ATOM 93 CA GLY A 93 279.630 245.444 241.016 1.00 0.00 C +ATOM 94 CA GLY A 94 277.171 247.313 238.785 1.00 0.00 C +ATOM 95 CA ASP A 95 273.828 249.066 238.270 1.00 0.00 C +ATOM 96 CA GLY A 96 272.356 252.294 239.660 1.00 0.00 C +ATOM 97 CA ALA A 97 270.545 255.129 237.871 1.00 0.00 C +ATOM 98 CA ALA A 98 267.435 257.067 236.831 1.00 0.00 C +ATOM 99 CA GLY A 99 263.864 258.151 236.061 1.00 0.00 C +ATOM 100 CA PRO A 100 260.302 256.800 236.134 1.00 0.00 C +ATOM 101 CA HIS A 101 257.169 258.330 237.670 1.00 0.00 C +ATOM 102 CA LEU A 102 256.333 261.558 239.512 1.00 0.00 C +ATOM 103 CA SER A 103 257.601 264.884 238.152 1.00 0.00 C +ATOM 104 CA GLY A 104 255.381 267.884 238.919 1.00 0.00 C +ATOM 105 CA ALA A 105 254.930 268.624 242.630 1.00 0.00 C +ATOM 106 CA ALA A 106 252.215 269.614 245.113 1.00 0.00 C +ATOM 107 CA GLY A 107 249.295 271.708 243.847 1.00 0.00 C +ATOM 108 CA ALA A 108 246.724 271.406 241.051 1.00 0.00 C +ATOM 109 CA ALA A 109 244.916 273.613 238.526 1.00 0.00 C +ATOM 110 CA GLY A 110 242.119 275.271 240.512 1.00 0.00 C +ATOM 111 CA GLY A 111 239.928 277.271 242.903 1.00 0.00 C +ATOM 112 CA SER A 112 236.317 276.055 242.939 1.00 0.00 C +ATOM 113 CA THR A 113 235.692 273.283 240.401 1.00 0.00 C +ATOM 114 CA VAL A 114 236.020 270.971 237.391 1.00 0.00 C +ATOM 115 CA ALA A 115 239.286 271.414 235.480 1.00 0.00 C +ATOM 116 CA ALA A 116 241.475 268.476 236.526 1.00 0.00 C +ATOM 117 CA THR A 117 243.027 266.387 233.744 1.00 0.00 C +ATOM 118 CA PRO A 118 243.228 262.862 232.311 1.00 0.00 C +ATOM 119 CA LEU A 119 241.202 260.570 230.041 1.00 0.00 C +ATOM 120 CA PHE A 120 242.164 261.663 226.520 1.00 0.00 C +ATOM 121 CA CYS A 121 245.079 264.035 225.896 1.00 0.00 C +ATOM 122 CA ARG A 122 245.329 267.594 224.560 1.00 0.00 C +ATOM 123 CA ARG A 123 245.591 270.124 221.723 1.00 0.00 C +ATOM 124 CA GLY A 124 247.133 271.109 218.381 1.00 0.00 C +ATOM 125 CA ARG A 125 246.773 271.733 214.639 1.00 0.00 C +ATOM 126 CA VAL A 126 250.323 271.664 213.258 1.00 0.00 C +ATOM 127 CA SER A 127 253.601 271.552 211.320 1.00 0.00 C +ATOM 128 CA GLY A 128 255.890 274.223 212.785 1.00 0.00 C +ATOM 129 CA ASP A 129 259.412 275.611 213.207 1.00 0.00 C +ATOM 130 CA PHE A 130 260.834 278.566 211.267 1.00 0.00 C +ATOM 131 CA PRO A 131 263.706 281.059 211.501 1.00 0.00 C +ATOM 132 CA ALA A 132 265.730 283.993 212.848 1.00 0.00 C +ATOM 133 CA LYS A 133 263.821 285.707 215.665 1.00 0.00 C +ATOM 134 CA ARG A 134 262.609 289.312 215.890 1.00 0.00 C +ATOM 135 CA ARG A 135 261.631 290.840 219.240 1.00 0.00 C +ATOM 136 CA SER A 136 259.623 291.626 222.381 1.00 0.00 C +ATOM 137 CA ASP A 137 259.978 291.104 226.139 1.00 0.00 C +ATOM 138 CA ARG A 138 258.657 293.732 228.561 1.00 0.00 C +ATOM 139 CA GLY A 139 256.932 295.142 231.651 1.00 0.00 C +ATOM 140 CA ARG A 140 254.498 297.122 233.812 1.00 0.00 C +ATOM 141 CA GLY A 141 251.390 299.251 234.385 1.00 0.00 C +ATOM 142 CA GLY A 142 249.881 301.396 231.621 1.00 0.00 C +ATOM 143 CA SER A 143 249.272 300.102 228.090 1.00 0.00 C +ATOM 144 CA CYS A 144 246.072 301.639 226.709 1.00 0.00 C +ATOM 145 CA GLU A 145 246.114 302.142 222.932 1.00 0.00 C +ATOM 146 CA ALA A 146 245.086 299.242 220.685 1.00 0.00 C +ATOM 147 CA GLU A 147 245.091 295.901 218.855 1.00 0.00 C +ATOM 148 CA GLY A 148 242.765 293.106 217.718 1.00 0.00 C +ATOM 149 CA GLY A 149 242.698 289.875 219.736 1.00 0.00 C +ATOM 150 CA ASP A 150 244.027 290.045 223.303 1.00 0.00 C +ATOM 151 CA GLY A 151 241.366 291.574 225.561 1.00 0.00 C +ATOM 152 CA ALA A 152 240.749 294.865 227.378 1.00 0.00 C +ATOM 153 CA THR A 153 238.169 297.518 228.286 1.00 0.00 C +ATOM 154 CA GLY A 154 238.751 300.950 226.738 1.00 0.00 C +ATOM 155 CA ARG A 155 239.705 303.684 229.214 1.00 0.00 C +ATOM 156 CA ARG A 156 242.938 304.698 230.956 1.00 0.00 C +ATOM 157 CA SER A 157 245.940 306.913 231.729 1.00 0.00 C +ATOM 158 CA GLY A 158 245.512 308.350 235.232 1.00 0.00 C +ATOM 159 CA GLU A 159 242.090 308.231 236.903 1.00 0.00 C +ATOM 160 CA GLU A 160 238.713 309.852 236.205 1.00 0.00 C +ATOM 161 CA GLY A 161 235.470 308.019 237.004 1.00 0.00 C +ATOM 162 CA GLU A 162 232.860 309.477 239.366 1.00 0.00 C +ATOM 163 CA ALA A 163 231.039 309.951 242.679 1.00 0.00 C +ATOM 164 CA ALA A 164 228.139 311.754 244.369 1.00 0.00 C +ATOM 165 CA GLY A 165 227.927 312.147 248.153 1.00 0.00 C +ATOM 166 CA GLY A 166 224.951 310.434 249.803 1.00 0.00 C +ATOM 167 CA ARG A 167 222.481 310.028 252.676 1.00 0.00 C +ATOM 168 CA PRO A 168 219.731 307.400 252.886 1.00 0.00 C +ATOM 169 CA ALA A 169 220.928 303.806 252.478 1.00 0.00 C +ATOM 170 CA PRO A 170 222.592 301.160 250.299 1.00 0.00 C +ATOM 171 CA GLU A 171 222.521 297.513 249.201 1.00 0.00 C +ATOM 172 CA ARG A 172 220.169 295.133 247.378 1.00 0.00 C +ATOM 173 CA GLU A 173 220.204 291.364 246.823 1.00 0.00 C +ATOM 174 CA LYS A 174 222.215 288.425 245.470 1.00 0.00 C +ATOM 175 CA GLU A 175 221.830 285.168 243.530 1.00 0.00 C +ATOM 176 CA LYS A 176 219.472 282.864 241.621 1.00 0.00 C +ATOM 177 CA ALA A 177 219.127 280.750 238.470 1.00 0.00 C +ATOM 178 CA GLY A 178 220.594 278.981 235.431 1.00 0.00 C +ATOM 179 CA ARG A 179 219.441 277.870 231.974 1.00 0.00 C +ATOM 180 CA GLY A 180 218.144 275.330 229.447 1.00 0.00 C +ATOM 181 CA GLY A 181 219.539 271.896 230.328 1.00 0.00 C +ATOM 182 CA ALA A 182 222.555 271.228 228.098 1.00 0.00 C +ATOM 183 CA ALA A 183 225.932 272.955 228.454 1.00 0.00 C +ATOM 184 CA THR A 184 229.095 273.876 230.368 1.00 0.00 C +ATOM 185 CA GLY A 185 232.239 274.393 232.457 1.00 0.00 C +ATOM 186 CA GLU A 186 230.940 274.656 236.029 1.00 0.00 C +ATOM 187 CA LEU A 187 227.473 274.093 237.506 1.00 0.00 C +ATOM 188 CA GLY A 188 226.141 270.915 239.131 1.00 0.00 C +ATOM 189 CA LYS A 189 224.316 267.770 237.994 1.00 0.00 C +ATOM 190 CA GLY A 190 221.528 265.363 237.018 1.00 0.00 C +ATOM 191 CA LEU A 191 218.319 263.424 237.695 1.00 0.00 C +ATOM 192 CA LYS A 192 218.542 259.685 238.391 1.00 0.00 C +ATOM 193 CA GLN A 193 216.233 258.620 241.228 1.00 0.00 C +ATOM 194 CA GLU A 194 213.136 256.403 241.353 1.00 0.00 C +ATOM 195 CA ASN A 195 209.629 254.917 241.438 1.00 0.00 C +ATOM 196 CA ALA A 196 206.901 252.329 240.826 1.00 0.00 C +ATOM 197 CA ARG A 197 206.211 248.641 241.486 1.00 0.00 C +ATOM 198 CA ARG A 198 206.951 245.362 243.281 1.00 0.00 C +ATOM 199 CA GLY A 199 210.607 244.297 243.382 1.00 0.00 C +ATOM 200 CA PHE A 200 213.218 241.649 244.212 1.00 0.00 C +ATOM 201 CA HIS A 201 213.283 238.797 241.686 1.00 0.00 C +ATOM 202 CA PHE A 202 213.132 239.921 238.049 1.00 0.00 C +ATOM 203 CA ILE A 203 209.787 240.899 236.509 1.00 0.00 C +ATOM 204 CA GLY A 204 207.122 239.724 234.053 1.00 0.00 C +ATOM 205 CA GLU A 205 205.464 241.516 231.128 1.00 0.00 C +ATOM 206 CA GLY A 206 205.196 245.209 232.026 1.00 0.00 C +ATOM 207 CA ARG A 207 206.899 246.267 235.266 1.00 0.00 C +ATOM 208 CA GLU A 208 210.532 247.147 234.526 1.00 0.00 C +ATOM 209 CA PRO A 209 214.047 246.916 235.976 1.00 0.00 C +ATOM 210 CA GLY A 210 217.314 248.333 234.620 1.00 0.00 C +ATOM 211 CA MET A 211 219.507 250.596 232.480 1.00 0.00 C +ATOM 212 CA GLY A 212 221.389 251.352 229.254 1.00 0.00 C +ATOM 213 CA GLU A 213 220.732 253.412 226.117 1.00 0.00 C +ATOM 214 CA GLY A 214 218.051 256.075 225.634 1.00 0.00 C +ATOM 215 CA GLY A 215 214.800 257.993 225.111 1.00 0.00 C +ATOM 216 CA THR A 216 214.078 259.967 228.289 1.00 0.00 C +ATOM 217 CA ALA A 217 211.742 261.707 230.744 1.00 0.00 C +ATOM 218 CA THR A 218 212.138 261.998 234.522 1.00 0.00 C +ATOM 219 CA GLY A 219 211.384 265.129 236.558 1.00 0.00 C +ATOM 220 CA ASN A 220 209.562 268.475 236.552 1.00 0.00 C +ATOM 221 CA THR A 221 208.611 269.882 233.141 1.00 0.00 C +ATOM 222 CA ALA A 222 205.276 271.206 231.860 1.00 0.00 C +ATOM 223 CA GLY A 223 202.353 273.238 233.216 1.00 0.00 C +ATOM 224 CA GLY A 224 202.136 276.615 234.967 1.00 0.00 C +ATOM 225 CA HIS A 225 204.013 278.884 237.385 1.00 0.00 C +ATOM 226 CA GLY A 226 203.877 277.462 240.917 1.00 0.00 C +ATOM 227 CA ARG A 227 203.038 279.667 243.908 1.00 0.00 C +ATOM 228 CA ARG A 228 204.632 283.081 243.344 1.00 0.00 C +ATOM 229 CA PRO A 229 205.605 286.610 242.290 1.00 0.00 C +ATOM 230 CA GLY A 230 206.998 289.876 243.673 1.00 0.00 C +ATOM 231 CA MET A 231 208.112 290.145 247.307 1.00 0.00 C +ATOM 232 CA ALA A 232 205.301 291.681 249.369 1.00 0.00 C +ATOM 233 CA ARG A 233 203.203 290.325 252.246 1.00 0.00 C +ATOM 234 CA PRO A 234 201.236 288.790 255.125 1.00 0.00 C +ATOM 235 CA PHE A 235 200.137 285.161 254.754 1.00 0.00 C +ATOM 236 CA ARG A 236 201.346 283.205 251.716 1.00 0.00 C +ATOM 237 CA ALA A 237 199.206 281.990 248.808 1.00 0.00 C +ATOM 238 CA ILE A 238 196.135 280.020 247.708 1.00 0.00 C +ATOM 239 CA GLY A 239 195.540 276.563 246.223 1.00 0.00 C +ATOM 240 CA GLY A 240 193.883 273.199 246.898 1.00 0.00 C +ATOM 241 CA ALA A 241 190.832 271.216 248.028 1.00 0.00 C +ATOM 242 CA ILE A 242 191.242 267.654 249.317 1.00 0.00 C +ATOM 243 CA GLN A 243 190.389 264.151 250.547 1.00 0.00 C +ATOM 244 CA GLY A 244 188.793 260.694 250.702 1.00 0.00 C +ATOM 245 CA GLY A 245 184.990 260.825 250.529 1.00 0.00 C +ATOM 246 CA LYS A 246 181.855 259.098 251.837 1.00 0.00 C +ATOM 247 CA ARG A 247 178.166 258.980 250.891 1.00 0.00 C +ATOM 248 CA GLY A 248 175.378 261.551 251.255 1.00 0.00 C +ATOM 249 CA LYS A 249 176.502 264.897 249.822 1.00 0.00 C +ATOM 250 CA SER A 250 173.719 266.234 247.590 1.00 0.00 C +ATOM 251 CA LYS A 251 171.197 264.002 245.807 1.00 0.00 C +ATOM 252 CA ARG A 252 169.393 262.004 243.112 1.00 0.00 C +ATOM 253 CA ASN A 253 169.811 260.383 239.689 1.00 0.00 C +ATOM 254 CA GLN A 254 171.253 256.876 240.058 1.00 0.00 C +ATOM 255 CA TRP A 255 169.581 253.493 240.586 1.00 0.00 C +ATOM 256 CA GLY A 256 167.612 250.510 241.906 1.00 0.00 C +ATOM 257 CA LEU A 257 166.809 246.797 242.197 1.00 0.00 C +ATOM 258 CA ILE A 258 166.472 244.546 239.142 1.00 0.00 C +ATOM 259 CA THR A 259 166.720 243.965 235.385 1.00 0.00 C +ATOM 260 CA PRO A 260 164.313 241.569 233.659 1.00 0.00 C +ATOM 261 CA ILE A 261 160.521 241.216 233.544 1.00 0.00 C +TER 262 ILE A 261 +END diff --git a/Plants/Q94LD7/Q94LD7.dcd b/Plants/Q94LD7/Q94LD7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..864a994383cb8288278bc6dca5ab5d74ee0f6974 --- /dev/null +++ b/Plants/Q94LD7/Q94LD7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2cd4a8417b9a6e41cc30d6904c8bbde032d4e304f5d0c2f3c1638baccbdeb280 +size 8480276 diff --git a/Plants/Q94LD7/top.pdb b/Plants/Q94LD7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a41aad7b422d120dd12c3d9f7ad4591ae2a6039f --- /dev/null +++ b/Plants/Q94LD7/top.pdb @@ -0,0 +1,68 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 226.629 227.706 215.264 1.00 0.00 C +ATOM 2 CA GLY A 2 224.817 227.428 218.605 1.00 0.00 C +ATOM 3 CA ALA A 3 221.833 227.829 220.939 1.00 0.00 C +ATOM 4 CA GLY A 4 220.183 227.405 224.347 1.00 0.00 C +ATOM 5 CA ILE A 5 221.713 228.857 227.519 1.00 0.00 C +ATOM 6 CA GLY A 6 224.078 231.840 227.353 1.00 0.00 C +ATOM 7 CA ILE A 7 223.025 234.095 224.468 1.00 0.00 C +ATOM 8 CA ASN A 8 225.440 233.473 221.588 1.00 0.00 C +ATOM 9 CA PRO A 9 228.590 231.338 221.777 1.00 0.00 C +ATOM 10 CA GLN A 10 232.394 231.388 221.978 1.00 0.00 C +ATOM 11 CA VAL A 11 234.493 228.718 220.251 1.00 0.00 C +ATOM 12 CA THR A 12 235.828 225.369 221.482 1.00 0.00 C +ATOM 13 CA ARG A 13 235.403 222.547 224.006 1.00 0.00 C +ATOM 14 CA ARG A 14 232.087 222.877 225.853 1.00 0.00 C +ATOM 15 CA GLY A 15 231.509 224.875 229.046 1.00 0.00 C +ATOM 16 CA PRO A 16 233.707 225.040 232.153 1.00 0.00 C +ATOM 17 CA GLY A 17 234.300 225.672 235.863 1.00 0.00 C +ATOM 18 CA ALA A 18 236.428 228.831 235.976 1.00 0.00 C +ATOM 19 CA ILE A 19 239.112 229.609 233.387 1.00 0.00 C +ATOM 20 CA CYS A 20 240.644 233.078 233.755 1.00 0.00 C +ATOM 21 CA ILE A 21 242.421 234.062 230.531 1.00 0.00 C +ATOM 22 CA HIS A 22 245.192 233.871 227.924 1.00 0.00 C +ATOM 23 CA GLY A 23 245.395 237.057 225.845 1.00 0.00 C +ATOM 24 CA SER A 24 247.360 240.230 226.613 1.00 0.00 C +ATOM 25 CA ASP A 25 250.683 242.036 227.070 1.00 0.00 C +ATOM 26 CA GLU A 26 252.724 245.002 228.315 1.00 0.00 C +ATOM 27 CA ARG A 27 252.158 247.229 231.354 1.00 0.00 C +ATOM 28 CA SER A 28 252.584 250.409 233.409 1.00 0.00 C +ATOM 29 CA ASP A 29 253.373 251.642 236.927 1.00 0.00 C +ATOM 30 CA THR A 30 251.627 254.771 238.220 1.00 0.00 C +ATOM 31 CA ILE A 31 249.184 257.695 238.238 1.00 0.00 C +ATOM 32 CA ASP A 32 249.686 260.947 240.157 1.00 0.00 C +ATOM 33 CA ILE A 33 252.785 262.501 241.738 1.00 0.00 C +ATOM 34 CA ASP A 34 254.669 264.862 244.060 1.00 0.00 C +ATOM 35 CA LYS A 35 258.391 264.536 244.804 1.00 0.00 C +ATOM 36 CA GLU A 36 260.759 267.507 245.087 1.00 0.00 C +ATOM 37 CA ALA A 37 264.563 267.526 245.303 1.00 0.00 C +ATOM 38 CA SER A 38 266.724 267.637 248.439 1.00 0.00 C +ATOM 39 CA SER A 39 266.989 266.872 252.162 1.00 0.00 C +ATOM 40 CA GLU A 40 265.259 268.782 254.969 1.00 0.00 C +ATOM 41 CA GLN A 41 264.226 269.824 258.484 1.00 0.00 C +ATOM 42 CA ALA A 42 263.872 270.556 262.207 1.00 0.00 C +ATOM 43 CA THR A 43 264.843 269.574 265.757 1.00 0.00 C +ATOM 44 CA THR A 44 267.937 268.607 267.760 1.00 0.00 C +ATOM 45 CA ALA A 45 268.287 268.471 271.551 1.00 0.00 C +ATOM 46 CA ASP A 46 267.236 268.120 275.197 1.00 0.00 C +ATOM 47 CA GLY A 47 265.851 269.132 278.599 1.00 0.00 C +ATOM 48 CA ASN A 48 264.312 267.827 281.831 1.00 0.00 C +ATOM 49 CA LEU A 49 261.047 266.580 283.346 1.00 0.00 C +ATOM 50 CA GLN A 50 261.879 263.905 285.928 1.00 0.00 C +ATOM 51 CA TYR A 51 259.151 263.949 288.587 1.00 0.00 C +ATOM 52 CA ALA A 52 259.123 265.195 292.187 1.00 0.00 C +ATOM 53 CA GLY A 53 260.210 262.571 294.727 1.00 0.00 C +ATOM 54 CA GLY A 54 262.179 259.416 293.901 1.00 0.00 C +ATOM 55 CA GLU A 55 264.734 257.285 292.043 1.00 0.00 C +ATOM 56 CA PRO A 56 266.663 256.056 288.996 1.00 0.00 C +ATOM 57 CA ALA A 57 265.676 254.078 285.893 1.00 0.00 C +ATOM 58 CA ILE A 58 265.739 255.812 282.501 1.00 0.00 C +ATOM 59 CA ASP A 59 265.480 258.330 279.654 1.00 0.00 C +ATOM 60 CA GLY A 60 262.934 261.085 280.322 1.00 0.00 C +ATOM 61 CA ALA A 61 259.737 262.526 278.832 1.00 0.00 C +ATOM 62 CA SER A 62 259.680 266.065 277.423 1.00 0.00 C +ATOM 63 CA GLY A 63 258.070 269.234 278.796 1.00 0.00 C +ATOM 64 CA HIS A 64 256.397 272.656 278.701 1.00 0.00 C +TER 65 HIS A 64 +END diff --git a/Plants/Q94LS0/Q94LS0.dcd b/Plants/Q94LS0/Q94LS0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..bc3445f29c65ae03ef16a294ea00adf10be4a711 --- /dev/null +++ b/Plants/Q94LS0/Q94LS0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:20d21401a67fa8fd3ed916ebdec81f5af27e06a3e0a7fbb95719920dfc134e24 +size 14720276 diff --git a/Plants/Q94LS0/top.pdb b/Plants/Q94LS0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..c2224c43404ea2fc278fb86e88fb1caec2d97012 --- /dev/null +++ b/Plants/Q94LS0/top.pdb @@ -0,0 +1,120 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 262.932 288.161 255.009 1.00 0.00 C +ATOM 2 CA THR A 2 259.444 289.266 256.072 1.00 0.00 C +ATOM 3 CA ALA A 3 256.071 290.961 255.559 1.00 0.00 C +ATOM 4 CA ALA A 4 254.080 293.466 257.627 1.00 0.00 C +ATOM 5 CA ARG A 5 251.922 291.686 260.212 1.00 0.00 C +ATOM 6 CA ARG A 6 250.742 288.307 261.519 1.00 0.00 C +ATOM 7 CA ARG A 7 253.061 285.353 260.874 1.00 0.00 C +ATOM 8 CA GLY A 8 255.959 283.231 262.145 1.00 0.00 C +ATOM 9 CA ALA A 9 256.198 280.177 259.880 1.00 0.00 C +ATOM 10 CA ARG A 10 256.099 276.658 258.425 1.00 0.00 C +ATOM 11 CA GLY A 11 253.746 273.778 259.256 1.00 0.00 C +ATOM 12 CA GLY A 12 252.731 270.116 258.984 1.00 0.00 C +ATOM 13 CA GLU A 13 253.402 266.367 259.060 1.00 0.00 C +ATOM 14 CA GLU A 14 255.615 263.271 258.873 1.00 0.00 C +ATOM 15 CA THR A 15 259.046 263.811 257.305 1.00 0.00 C +ATOM 16 CA GLY A 16 262.623 263.570 256.017 1.00 0.00 C +ATOM 17 CA ALA A 17 264.824 260.505 255.489 1.00 0.00 C +ATOM 18 CA ARG A 18 267.847 259.870 253.258 1.00 0.00 C +ATOM 19 CA ARG A 19 270.625 262.467 253.032 1.00 0.00 C +ATOM 20 CA ARG A 20 271.890 264.772 255.789 1.00 0.00 C +ATOM 21 CA ASP A 21 271.819 262.710 258.992 1.00 0.00 C +ATOM 22 CA ARG A 22 273.474 262.422 262.412 1.00 0.00 C +ATOM 23 CA ARG A 23 271.350 263.549 265.367 1.00 0.00 C +ATOM 24 CA ARG A 24 268.040 265.436 265.317 1.00 0.00 C +ATOM 25 CA ASP A 25 265.536 268.243 264.716 1.00 0.00 C +ATOM 26 CA GLY A 26 265.011 271.968 265.322 1.00 0.00 C +ATOM 27 CA THR A 27 262.893 275.101 264.856 1.00 0.00 C +ATOM 28 CA ARG A 28 261.301 278.454 265.717 1.00 0.00 C +ATOM 29 CA LEU A 29 259.563 278.463 269.107 1.00 0.00 C +ATOM 30 CA GLY A 30 255.991 277.286 269.719 1.00 0.00 C +ATOM 31 CA ALA A 31 253.714 279.328 267.447 1.00 0.00 C +ATOM 32 CA ALA A 32 251.181 282.168 267.254 1.00 0.00 C +ATOM 33 CA THR A 33 249.866 283.053 270.719 1.00 0.00 C +ATOM 34 CA ARG A 34 250.105 285.436 273.683 1.00 0.00 C +ATOM 35 CA ARG A 35 253.527 286.866 274.553 1.00 0.00 C +ATOM 36 CA ALA A 36 255.900 288.333 277.148 1.00 0.00 C +ATOM 37 CA VAL A 37 258.263 288.301 280.136 1.00 0.00 C +ATOM 38 CA THR A 38 257.131 288.974 283.711 1.00 0.00 C +ATOM 39 CA GLY A 39 253.642 287.640 284.461 1.00 0.00 C +ATOM 40 CA ARG A 40 251.104 286.875 281.725 1.00 0.00 C +ATOM 41 CA VAL A 41 248.810 284.460 279.875 1.00 0.00 C +ATOM 42 CA GLY A 42 246.175 281.840 280.717 1.00 0.00 C +ATOM 43 CA ALA A 43 243.291 280.090 278.946 1.00 0.00 C +ATOM 44 CA TRP A 44 241.601 277.106 280.607 1.00 0.00 C +ATOM 45 CA GLY A 45 239.793 273.800 280.047 1.00 0.00 C +ATOM 46 CA ASP A 46 238.152 272.027 277.101 1.00 0.00 C +ATOM 47 CA GLY A 47 234.663 272.457 275.632 1.00 0.00 C +ATOM 48 CA MET A 48 233.718 271.989 271.971 1.00 0.00 C +ATOM 49 CA ALA A 49 231.831 268.698 271.614 1.00 0.00 C +ATOM 50 CA ALA A 50 233.598 266.145 269.407 1.00 0.00 C +ATOM 51 CA ARG A 51 234.848 262.919 267.812 1.00 0.00 C +ATOM 52 CA ARG A 52 233.997 261.641 264.325 1.00 0.00 C +ATOM 53 CA GLY A 53 235.501 258.356 263.114 1.00 0.00 C +ATOM 54 CA SER A 54 235.716 256.186 259.990 1.00 0.00 C +ATOM 55 CA GLY A 55 237.775 252.989 260.228 1.00 0.00 C +ATOM 56 CA GLU A 56 235.902 249.888 259.049 1.00 0.00 C +ATOM 57 CA GLY A 57 237.972 248.262 256.295 1.00 0.00 C +ATOM 58 CA ARG A 58 237.696 244.741 254.865 1.00 0.00 C +ATOM 59 CA GLY A 59 237.380 241.108 253.763 1.00 0.00 C +ATOM 60 CA ALA A 60 237.522 237.314 253.441 1.00 0.00 C +ATOM 61 CA ARG A 61 238.876 234.139 255.054 1.00 0.00 C +ATOM 62 CA GLY A 62 239.729 230.443 254.692 1.00 0.00 C +ATOM 63 CA ASP A 63 238.833 227.250 252.816 1.00 0.00 C +ATOM 64 CA ASP A 64 239.425 225.393 249.542 1.00 0.00 C +ATOM 65 CA ALA A 65 238.897 222.421 247.218 1.00 0.00 C +ATOM 66 CA THR A 66 241.152 223.106 244.223 1.00 0.00 C +ATOM 67 CA VAL A 67 240.913 226.741 243.107 1.00 0.00 C +ATOM 68 CA THR A 68 239.671 230.299 242.547 1.00 0.00 C +ATOM 69 CA THR A 69 236.634 230.206 240.249 1.00 0.00 C +ATOM 70 CA MET A 70 233.102 231.631 240.125 1.00 0.00 C +ATOM 71 CA ALA A 71 231.563 234.476 242.138 1.00 0.00 C +ATOM 72 CA ARG A 72 230.198 238.030 242.272 1.00 0.00 C +ATOM 73 CA GLY A 73 231.334 241.452 243.502 1.00 0.00 C +ATOM 74 CA ALA A 74 229.970 244.793 242.280 1.00 0.00 C +ATOM 75 CA GLN A 75 227.304 244.638 239.562 1.00 0.00 C +ATOM 76 CA GLY A 76 227.589 244.227 235.785 1.00 0.00 C +ATOM 77 CA GLY A 77 227.237 241.467 233.182 1.00 0.00 C +ATOM 78 CA ASP A 78 230.593 240.199 231.902 1.00 0.00 C +ATOM 79 CA GLY A 79 232.514 237.645 229.827 1.00 0.00 C +ATOM 80 CA ASP A 80 235.593 235.892 231.227 1.00 0.00 C +ATOM 81 CA GLY A 81 238.580 237.112 233.253 1.00 0.00 C +ATOM 82 CA GLY A 82 240.330 236.031 236.460 1.00 0.00 C +ATOM 83 CA GLY A 83 241.676 232.539 235.746 1.00 0.00 C +ATOM 84 CA ALA A 84 245.063 232.325 234.014 1.00 0.00 C +ATOM 85 CA ARG A 85 247.566 234.099 236.272 1.00 0.00 C +ATOM 86 CA ARG A 86 249.041 231.566 238.707 1.00 0.00 C +ATOM 87 CA GLY A 87 249.900 228.391 236.785 1.00 0.00 C +ATOM 88 CA ALA A 88 251.041 226.749 233.542 1.00 0.00 C +ATOM 89 CA THR A 89 251.926 223.305 232.173 1.00 0.00 C +ATOM 90 CA ALA A 90 253.567 220.784 229.835 1.00 0.00 C +ATOM 91 CA ARG A 91 257.251 219.949 230.335 1.00 0.00 C +ATOM 92 CA GLY A 92 260.053 217.789 231.747 1.00 0.00 C +ATOM 93 CA GLY A 93 262.950 215.767 233.174 1.00 0.00 C +ATOM 94 CA ARG A 94 266.677 216.006 233.931 1.00 0.00 C +ATOM 95 CA ARG A 95 269.398 214.258 231.917 1.00 0.00 C +ATOM 96 CA ARG A 96 272.395 212.052 231.099 1.00 0.00 C +ATOM 97 CA TRP A 97 273.282 208.366 231.480 1.00 0.00 C +ATOM 98 CA CYS A 98 270.252 206.171 232.197 1.00 0.00 C +ATOM 99 CA VAL A 99 266.688 207.248 231.385 1.00 0.00 C +ATOM 100 CA GLY A 100 264.377 209.614 229.494 1.00 0.00 C +ATOM 101 CA ALA A 101 260.721 210.478 230.133 1.00 0.00 C +ATOM 102 CA GLY A 102 258.513 211.407 227.171 1.00 0.00 C +ATOM 103 CA SER A 103 258.092 212.400 223.517 1.00 0.00 C +ATOM 104 CA GLY A 104 256.988 215.773 222.131 1.00 0.00 C +ATOM 105 CA ARG A 105 255.957 219.184 223.480 1.00 0.00 C +ATOM 106 CA LEU A 106 257.364 222.723 223.357 1.00 0.00 C +ATOM 107 CA GLY A 107 258.451 226.374 223.343 1.00 0.00 C +ATOM 108 CA ALA A 108 256.710 228.560 220.754 1.00 0.00 C +ATOM 109 CA GLU A 109 254.412 231.599 220.728 1.00 0.00 C +ATOM 110 CA MET A 110 251.689 230.859 223.289 1.00 0.00 C +ATOM 111 CA GLY A 111 251.391 227.480 225.023 1.00 0.00 C +ATOM 112 CA GLU A 112 248.431 225.330 223.958 1.00 0.00 C +ATOM 113 CA GLU A 113 246.964 221.844 224.414 1.00 0.00 C +ATOM 114 CA GLY A 114 248.701 219.320 222.148 1.00 0.00 C +ATOM 115 CA GLU A 115 250.441 221.242 219.356 1.00 0.00 C +ATOM 116 CA GLY A 116 247.830 222.446 216.857 1.00 0.00 C +TER 117 GLY A 116 +END diff --git a/Plants/Q95BG2/Q95BG2.dcd b/Plants/Q95BG2/Q95BG2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..aab483cf7066517fd5b127e7975905b68e852cb3 --- /dev/null +++ b/Plants/Q95BG2/Q95BG2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:b091314f55e03503a5a9f0c94d1c29bd7fa3b485773446ec702eb058a96ce7ab +size 12800276 diff --git a/Plants/Q95BG2/top.pdb b/Plants/Q95BG2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..797451c72a7d45d5c1d8223afc425c386a5a67d7 --- /dev/null +++ b/Plants/Q95BG2/top.pdb @@ -0,0 +1,104 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA ASP A 1 311.367 229.440 257.808 1.00 0.00 C +ATOM 2 CA LYS A 2 307.586 229.168 258.182 1.00 0.00 C +ATOM 3 CA ARG A 3 305.741 228.860 254.862 1.00 0.00 C +ATOM 4 CA GLY A 4 302.549 230.467 253.542 1.00 0.00 C +ATOM 5 CA SER A 5 299.779 227.884 253.961 1.00 0.00 C +ATOM 6 CA GLY A 6 297.967 225.992 251.195 1.00 0.00 C +ATOM 7 CA ILE A 7 294.246 226.764 251.467 1.00 0.00 C +ATOM 8 CA VAL A 8 292.655 223.533 252.710 1.00 0.00 C +ATOM 9 CA LYS A 9 291.867 222.599 256.318 1.00 0.00 C +ATOM 10 CA PHE A 10 288.534 220.806 256.758 1.00 0.00 C +ATOM 11 CA ARG A 11 287.403 217.336 257.851 1.00 0.00 C +ATOM 12 CA TYR A 12 284.342 216.547 255.725 1.00 0.00 C +ATOM 13 CA ARG A 13 280.790 216.336 254.361 1.00 0.00 C +ATOM 14 CA THR A 14 278.327 218.600 256.184 1.00 0.00 C +ATOM 15 CA LEU A 15 276.530 221.467 254.433 1.00 0.00 C +ATOM 16 CA GLU A 16 273.197 222.668 255.835 1.00 0.00 C +ATOM 17 CA GLU A 17 269.505 222.893 256.749 1.00 0.00 C +ATOM 18 CA GLU A 18 266.404 224.687 258.046 1.00 0.00 C +ATOM 19 CA TYR A 19 264.591 227.692 259.527 1.00 0.00 C +ATOM 20 CA ARG A 20 263.393 226.941 263.065 1.00 0.00 C +ATOM 21 CA THR A 21 260.740 228.453 265.343 1.00 0.00 C +ATOM 22 CA ARG A 22 257.514 229.863 263.886 1.00 0.00 C +ATOM 23 CA GLU A 23 254.735 232.247 262.833 1.00 0.00 C +ATOM 24 CA GLU A 24 251.814 234.057 261.188 1.00 0.00 C +ATOM 25 CA GLU A 25 251.137 233.631 257.463 1.00 0.00 C +ATOM 26 CA TYR A 26 250.295 235.908 254.526 1.00 0.00 C +ATOM 27 CA ARG A 27 253.230 236.130 252.107 1.00 0.00 C +ATOM 28 CA THR A 28 256.243 234.302 253.553 1.00 0.00 C +ATOM 29 CA ARG A 29 259.638 234.952 251.953 1.00 0.00 C +ATOM 30 CA GLU A 30 260.244 238.702 252.252 1.00 0.00 C +ATOM 31 CA GLU A 31 260.573 242.400 253.106 1.00 0.00 C +ATOM 32 CA ASP A 32 259.073 245.602 251.687 1.00 0.00 C +ATOM 33 CA SER A 33 258.910 248.134 254.529 1.00 0.00 C +ATOM 34 CA GLU A 34 259.827 251.799 255.022 1.00 0.00 C +ATOM 35 CA ASP A 35 256.812 253.702 256.365 1.00 0.00 C +ATOM 36 CA GLU A 36 257.404 254.755 259.978 1.00 0.00 C +ATOM 37 CA TYR A 37 254.626 256.305 262.075 1.00 0.00 C +ATOM 38 CA GLU A 38 251.723 254.130 263.241 1.00 0.00 C +ATOM 39 CA SER A 39 250.490 250.864 261.715 1.00 0.00 C +ATOM 40 CA PRO A 40 248.089 250.394 258.794 1.00 0.00 C +ATOM 41 CA GLU A 41 244.648 249.063 257.842 1.00 0.00 C +ATOM 42 CA ASN A 42 244.296 247.999 254.201 1.00 0.00 C +ATOM 43 CA GLU A 43 242.794 244.499 254.287 1.00 0.00 C +ATOM 44 CA TYR A 44 239.343 243.235 253.284 1.00 0.00 C +ATOM 45 CA ARG A 45 236.777 245.822 254.398 1.00 0.00 C +ATOM 46 CA THR A 46 233.943 248.155 255.418 1.00 0.00 C +ATOM 47 CA ARG A 47 233.596 247.639 259.177 1.00 0.00 C +ATOM 48 CA GLU A 48 234.510 245.316 262.055 1.00 0.00 C +ATOM 49 CA GLY A 49 236.448 247.366 264.616 1.00 0.00 C +ATOM 50 CA GLU A 50 239.296 247.010 267.121 1.00 0.00 C +ATOM 51 CA GLY A 51 242.271 249.264 266.353 1.00 0.00 C +ATOM 52 CA LYS A 52 243.415 252.167 268.539 1.00 0.00 C +ATOM 53 CA ASN A 53 243.168 255.932 269.071 1.00 0.00 C +ATOM 54 CA GLU A 54 245.584 258.834 268.561 1.00 0.00 C +ATOM 55 CA ILE A 55 245.018 261.819 266.263 1.00 0.00 C +ATOM 56 CA LEU A 56 246.948 262.486 263.047 1.00 0.00 C +ATOM 57 CA GLU A 57 249.343 265.427 263.403 1.00 0.00 C +ATOM 58 CA ASP A 58 250.326 269.104 263.221 1.00 0.00 C +ATOM 59 CA LYS A 59 251.593 272.696 263.295 1.00 0.00 C +ATOM 60 CA TYR A 60 252.530 275.207 260.587 1.00 0.00 C +ATOM 61 CA ARG A 61 249.545 275.574 258.248 1.00 0.00 C +ATOM 62 CA THR A 62 246.505 276.702 260.247 1.00 0.00 C +ATOM 63 CA LEU A 63 243.662 274.270 260.969 1.00 0.00 C +ATOM 64 CA GLU A 64 241.594 271.174 261.774 1.00 0.00 C +ATOM 65 CA GLU A 65 242.752 267.762 263.013 1.00 0.00 C +ATOM 66 CA ASP A 66 240.742 264.527 262.892 1.00 0.00 C +ATOM 67 CA SER A 67 237.997 262.657 261.026 1.00 0.00 C +ATOM 68 CA GLU A 68 235.672 263.260 258.069 1.00 0.00 C +ATOM 69 CA GLU A 69 231.904 262.765 257.790 1.00 0.00 C +ATOM 70 CA GLU A 70 228.741 264.198 256.222 1.00 0.00 C +ATOM 71 CA TYR A 71 225.668 265.197 258.241 1.00 0.00 C +ATOM 72 CA GLY A 72 222.107 266.127 259.226 1.00 0.00 C +ATOM 73 CA SER A 73 218.802 264.465 258.313 1.00 0.00 C +ATOM 74 CA SER A 74 215.241 263.206 257.816 1.00 0.00 C +ATOM 75 CA GLU A 75 215.078 261.723 254.310 1.00 0.00 C +ATOM 76 CA ASP A 76 215.855 260.929 250.666 1.00 0.00 C +ATOM 77 CA GLY A 77 217.585 264.003 249.225 1.00 0.00 C +ATOM 78 CA SER A 78 216.936 266.284 246.244 1.00 0.00 C +ATOM 79 CA GLU A 79 218.985 267.961 243.504 1.00 0.00 C +ATOM 80 CA LYS A 80 221.833 267.581 241.001 1.00 0.00 C +ATOM 81 CA GLU A 81 222.843 265.426 238.026 1.00 0.00 C +ATOM 82 CA TYR A 82 225.874 265.306 235.720 1.00 0.00 C +ATOM 83 CA GLY A 83 229.443 264.325 234.817 1.00 0.00 C +ATOM 84 CA THR A 84 232.849 263.570 233.286 1.00 0.00 C +ATOM 85 CA LEU A 85 236.174 263.285 231.448 1.00 0.00 C +ATOM 86 CA GLU A 86 236.280 260.635 228.712 1.00 0.00 C +ATOM 87 CA GLU A 87 238.799 261.863 226.130 1.00 0.00 C +ATOM 88 CA ASP A 88 239.834 259.645 223.210 1.00 0.00 C +ATOM 89 CA SER A 89 238.462 257.355 220.492 1.00 0.00 C +ATOM 90 CA GLU A 90 236.059 254.433 220.040 1.00 0.00 C +ATOM 91 CA GLU A 91 237.524 251.975 217.523 1.00 0.00 C +ATOM 92 CA ASP A 92 238.605 253.281 214.111 1.00 0.00 C +ATOM 93 CA SER A 93 237.868 255.748 211.302 1.00 0.00 C +ATOM 94 CA GLU A 94 238.049 259.501 210.672 1.00 0.00 C +ATOM 95 CA ASP A 95 236.887 263.108 210.280 1.00 0.00 C +ATOM 96 CA GLU A 96 239.073 265.538 208.323 1.00 0.00 C +ATOM 97 CA TYR A 97 238.712 268.399 205.833 1.00 0.00 C +ATOM 98 CA GLY A 98 237.006 271.192 203.883 1.00 0.00 C +ATOM 99 CA SER A 99 234.261 273.485 202.569 1.00 0.00 C +ATOM 100 CA PRO A 100 232.455 275.508 199.893 1.00 0.00 C +TER 101 PRO A 100 +END diff --git a/Plants/Q96240/Q96240.dcd b/Plants/Q96240/Q96240.dcd new file mode 100644 index 0000000000000000000000000000000000000000..98fac7fc2383e7e9f593ea39da38e21e8c2e2f9d --- /dev/null +++ b/Plants/Q96240/Q96240.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:ce6888194f62a265f5c665fda5bc811877f7f7fb09e68d8f7cb814b16d226c5c +size 4400276 diff --git a/Plants/Q96240/top.pdb b/Plants/Q96240/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..ed293063364801490c4068315839d83b735ebdff --- /dev/null +++ b/Plants/Q96240/top.pdb @@ -0,0 +1,34 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 250.008 248.946 237.378 1.00 0.00 C +ATOM 2 CA LYS A 2 246.791 250.462 236.012 1.00 0.00 C +ATOM 3 CA SER A 3 243.230 251.372 237.015 1.00 0.00 C +ATOM 4 CA PHE A 4 242.111 250.961 240.634 1.00 0.00 C +ATOM 5 CA ASN A 5 241.610 254.371 242.259 1.00 0.00 C +ATOM 6 CA THR A 6 242.547 257.454 244.292 1.00 0.00 C +ATOM 7 CA GLU A 7 245.857 257.881 246.128 1.00 0.00 C +ATOM 8 CA GLY A 8 244.920 258.015 249.819 1.00 0.00 C +ATOM 9 CA HIS A 9 244.376 255.649 252.756 1.00 0.00 C +ATOM 10 CA ASN A 10 245.273 252.040 253.581 1.00 0.00 C +ATOM 11 CA HIS A 11 245.753 249.625 256.489 1.00 0.00 C +ATOM 12 CA SER A 12 245.877 251.870 259.565 1.00 0.00 C +ATOM 13 CA THR A 13 246.117 252.856 263.238 1.00 0.00 C +ATOM 14 CA ALA A 14 244.781 255.988 264.947 1.00 0.00 C +ATOM 15 CA GLU A 15 247.369 256.952 267.571 1.00 0.00 C +ATOM 16 CA SER A 16 249.455 259.718 265.984 1.00 0.00 C +ATOM 17 CA GLY A 17 252.608 258.236 264.443 1.00 0.00 C +ATOM 18 CA CYS A 18 253.533 257.208 260.893 1.00 0.00 C +ATOM 19 CA TYR A 19 252.906 254.067 258.829 1.00 0.00 C +ATOM 20 CA THR A 20 251.518 251.850 256.059 1.00 0.00 C +ATOM 21 CA CYS A 21 253.020 248.368 255.694 1.00 0.00 C +ATOM 22 CA ARG A 22 255.839 246.618 253.823 1.00 0.00 C +ATOM 23 CA PRO A 23 254.325 243.529 252.186 1.00 0.00 C +ATOM 24 CA ALA A 24 254.047 244.216 248.448 1.00 0.00 C +ATOM 25 CA LYS A 25 256.040 243.848 245.222 1.00 0.00 C +ATOM 26 CA GLU A 26 257.124 241.445 242.471 1.00 0.00 C +ATOM 27 CA ARG A 27 255.953 238.293 240.680 1.00 0.00 C +ATOM 28 CA ASP A 28 257.751 236.978 237.590 1.00 0.00 C +ATOM 29 CA GLU A 29 258.206 236.542 233.832 1.00 0.00 C +ATOM 30 CA GLU A 30 261.056 234.643 232.162 1.00 0.00 C +TER 31 GLU A 30 +END diff --git a/Plants/Q96261/Q96261.dcd b/Plants/Q96261/Q96261.dcd new file mode 100644 index 0000000000000000000000000000000000000000..b3946df5717b7caa83074f9443cc148bd05ea8ed --- /dev/null +++ b/Plants/Q96261/Q96261.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c4970da8653fb10918b4cd50c20e8395989b14fb20ba6a8914026abb3d1a49f4 +size 23000276 diff --git a/Plants/Q96261/top.pdb b/Plants/Q96261/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..5666f41c248331bc9fec25639edc5c60868744c1 --- /dev/null +++ b/Plants/Q96261/top.pdb @@ -0,0 +1,189 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 218.083 253.945 213.745 1.00 0.00 C +ATOM 2 CA ALA A 2 216.621 255.582 216.860 1.00 0.00 C +ATOM 3 CA ASP A 3 216.919 253.250 219.858 1.00 0.00 C +ATOM 4 CA LEU A 4 215.566 252.066 223.217 1.00 0.00 C +ATOM 5 CA ARG A 5 214.806 253.027 226.825 1.00 0.00 C +ATOM 6 CA ASP A 6 213.220 256.271 228.039 1.00 0.00 C +ATOM 7 CA GLU A 7 213.790 258.969 230.668 1.00 0.00 C +ATOM 8 CA LYS A 8 214.995 261.349 233.388 1.00 0.00 C +ATOM 9 CA GLY A 9 216.875 262.690 236.419 1.00 0.00 C +ATOM 10 CA ASN A 10 219.853 260.627 237.599 1.00 0.00 C +ATOM 11 CA PRO A 11 219.648 259.836 241.321 1.00 0.00 C +ATOM 12 CA ILE A 12 221.774 262.312 243.287 1.00 0.00 C +ATOM 13 CA HIS A 13 223.380 264.927 245.545 1.00 0.00 C +ATOM 14 CA LEU A 14 225.297 267.814 247.129 1.00 0.00 C +ATOM 15 CA THR A 15 227.577 270.858 246.905 1.00 0.00 C +ATOM 16 CA ASP A 16 229.879 273.788 246.110 1.00 0.00 C +ATOM 17 CA THR A 17 231.373 273.566 242.612 1.00 0.00 C +ATOM 18 CA GLN A 18 234.102 275.410 240.696 1.00 0.00 C +ATOM 19 CA GLY A 19 237.872 275.580 240.174 1.00 0.00 C +ATOM 20 CA ASN A 20 240.638 275.835 237.566 1.00 0.00 C +ATOM 21 CA PRO A 21 243.403 278.290 236.645 1.00 0.00 C +ATOM 22 CA ILE A 22 247.044 278.890 237.594 1.00 0.00 C +ATOM 23 CA VAL A 23 250.479 279.229 239.206 1.00 0.00 C +ATOM 24 CA ASP A 24 253.743 281.190 239.095 1.00 0.00 C +ATOM 25 CA LEU A 25 257.031 280.124 237.491 1.00 0.00 C +ATOM 26 CA THR A 26 258.915 280.620 234.217 1.00 0.00 C +ATOM 27 CA ASP A 27 261.871 281.795 232.120 1.00 0.00 C +ATOM 28 CA GLU A 28 261.852 285.402 230.893 1.00 0.00 C +ATOM 29 CA HIS A 29 264.668 287.915 231.413 1.00 0.00 C +ATOM 30 CA GLY A 30 265.891 288.169 235.013 1.00 0.00 C +ATOM 31 CA ASN A 31 266.478 288.759 238.731 1.00 0.00 C +ATOM 32 CA PRO A 32 268.290 291.969 239.695 1.00 0.00 C +ATOM 33 CA MET A 33 267.167 292.679 243.265 1.00 0.00 C +ATOM 34 CA TYR A 34 266.571 296.386 243.916 1.00 0.00 C +ATOM 35 CA LEU A 35 263.865 298.327 242.064 1.00 0.00 C +ATOM 36 CA THR A 36 261.423 301.210 242.556 1.00 0.00 C +ATOM 37 CA GLY A 37 258.226 302.142 244.406 1.00 0.00 C +ATOM 38 CA VAL A 38 257.324 299.149 246.584 1.00 0.00 C +ATOM 39 CA VAL A 39 257.282 296.000 248.728 1.00 0.00 C +ATOM 40 CA SER A 40 258.558 295.135 252.213 1.00 0.00 C +ATOM 41 CA SER A 41 258.663 292.393 254.855 1.00 0.00 C +ATOM 42 CA THR A 42 258.835 289.076 256.723 1.00 0.00 C +ATOM 43 CA PRO A 43 259.323 285.948 254.603 1.00 0.00 C +ATOM 44 CA GLN A 44 262.617 284.470 253.386 1.00 0.00 C +ATOM 45 CA HIS A 45 264.566 281.439 254.622 1.00 0.00 C +ATOM 46 CA LYS A 46 268.278 282.194 255.027 1.00 0.00 C +ATOM 47 CA GLU A 47 271.485 281.719 257.028 1.00 0.00 C +ATOM 48 CA SER A 48 274.369 283.766 258.446 1.00 0.00 C +ATOM 49 CA THR A 49 276.858 285.494 256.135 1.00 0.00 C +ATOM 50 CA THR A 50 278.711 288.502 254.708 1.00 0.00 C +ATOM 51 CA SER A 51 278.760 291.642 256.866 1.00 0.00 C +ATOM 52 CA ASP A 52 280.410 295.016 257.503 1.00 0.00 C +ATOM 53 CA ILE A 53 281.402 298.028 255.390 1.00 0.00 C +ATOM 54 CA ALA A 54 280.423 297.782 251.717 1.00 0.00 C +ATOM 55 CA GLU A 55 277.021 299.456 251.346 1.00 0.00 C +ATOM 56 CA HIS A 56 274.112 297.038 250.891 1.00 0.00 C +ATOM 57 CA PRO A 57 272.240 294.224 249.133 1.00 0.00 C +ATOM 58 CA THR A 58 270.628 291.007 247.879 1.00 0.00 C +ATOM 59 CA SER A 59 270.809 287.942 245.623 1.00 0.00 C +ATOM 60 CA THR A 60 271.989 284.937 247.647 1.00 0.00 C +ATOM 61 CA VAL A 61 272.284 281.934 249.972 1.00 0.00 C +ATOM 62 CA GLY A 62 271.398 278.229 249.893 1.00 0.00 C +ATOM 63 CA GLU A 63 269.439 274.964 250.025 1.00 0.00 C +ATOM 64 CA THR A 64 265.808 273.878 250.413 1.00 0.00 C +ATOM 65 CA HIS A 65 264.768 272.635 253.861 1.00 0.00 C +ATOM 66 CA PRO A 66 261.019 271.969 254.005 1.00 0.00 C +ATOM 67 CA ALA A 67 258.895 268.865 253.398 1.00 0.00 C +ATOM 68 CA ALA A 68 258.232 265.588 255.225 1.00 0.00 C +ATOM 69 CA ALA A 69 256.247 266.467 258.356 1.00 0.00 C +ATOM 70 CA PRO A 70 258.369 266.911 261.489 1.00 0.00 C +ATOM 71 CA ALA A 71 256.305 266.893 264.691 1.00 0.00 C +ATOM 72 CA GLY A 72 257.894 266.687 268.148 1.00 0.00 C +ATOM 73 CA ALA A 73 255.840 267.269 271.304 1.00 0.00 C +ATOM 74 CA GLY A 74 256.072 270.962 272.213 1.00 0.00 C +ATOM 75 CA ALA A 75 254.246 273.491 274.400 1.00 0.00 C +ATOM 76 CA ALA A 76 250.745 272.247 275.243 1.00 0.00 C +ATOM 77 CA THR A 77 247.495 270.283 275.553 1.00 0.00 C +ATOM 78 CA ALA A 78 244.486 272.551 274.991 1.00 0.00 C +ATOM 79 CA ALA A 79 244.021 274.942 277.921 1.00 0.00 C +ATOM 80 CA THR A 80 243.293 273.519 281.379 1.00 0.00 C +ATOM 81 CA ALA A 81 244.269 272.960 285.019 1.00 0.00 C +ATOM 82 CA THR A 82 243.957 272.376 288.771 1.00 0.00 C +ATOM 83 CA GLY A 83 242.947 273.561 292.248 1.00 0.00 C +ATOM 84 CA VAL A 84 241.977 276.459 294.524 1.00 0.00 C +ATOM 85 CA SER A 85 239.841 279.464 293.565 1.00 0.00 C +ATOM 86 CA ALA A 86 236.517 278.875 295.331 1.00 0.00 C +ATOM 87 CA GLY A 87 233.284 278.161 297.216 1.00 0.00 C +ATOM 88 CA THR A 88 233.444 274.819 299.038 1.00 0.00 C +ATOM 89 CA GLY A 89 231.871 271.376 298.601 1.00 0.00 C +ATOM 90 CA ALA A 90 230.580 268.551 296.395 1.00 0.00 C +ATOM 91 CA THR A 91 228.520 265.593 295.160 1.00 0.00 C +ATOM 92 CA THR A 92 226.451 263.234 297.321 1.00 0.00 C +ATOM 93 CA THR A 93 223.125 261.405 297.658 1.00 0.00 C +ATOM 94 CA GLY A 94 221.864 258.088 296.271 1.00 0.00 C +ATOM 95 CA GLN A 95 221.633 256.777 292.701 1.00 0.00 C +ATOM 96 CA GLN A 96 221.125 253.003 292.805 1.00 0.00 C +ATOM 97 CA HIS A 97 221.890 250.979 289.669 1.00 0.00 C +ATOM 98 CA HIS A 98 221.223 252.580 286.277 1.00 0.00 C +ATOM 99 CA GLY A 99 221.290 255.968 284.535 1.00 0.00 C +ATOM 100 CA SER A 100 222.552 258.897 282.452 1.00 0.00 C +ATOM 101 CA LEU A 101 222.049 260.430 279.001 1.00 0.00 C +ATOM 102 CA GLU A 102 222.355 257.885 276.183 1.00 0.00 C +ATOM 103 CA GLU A 103 222.844 254.144 276.716 1.00 0.00 C +ATOM 104 CA HIS A 104 221.258 251.762 274.202 1.00 0.00 C +ATOM 105 CA LEU A 105 221.113 250.043 270.804 1.00 0.00 C +ATOM 106 CA ARG A 106 220.839 247.444 268.031 1.00 0.00 C +ATOM 107 CA ARG A 107 221.554 244.401 265.854 1.00 0.00 C +ATOM 108 CA SER A 108 219.752 243.613 262.591 1.00 0.00 C +ATOM 109 CA GLY A 109 219.676 240.376 260.582 1.00 0.00 C +ATOM 110 CA SER A 110 218.547 237.031 262.015 1.00 0.00 C +ATOM 111 CA SER A 111 217.733 234.713 264.927 1.00 0.00 C +ATOM 112 CA SER A 112 218.587 235.433 268.570 1.00 0.00 C +ATOM 113 CA SER A 113 219.606 232.662 270.979 1.00 0.00 C +ATOM 114 CA SER A 114 221.858 229.600 271.240 1.00 0.00 C +ATOM 115 CA SER A 115 221.068 225.991 270.309 1.00 0.00 C +ATOM 116 CA SER A 116 224.003 224.439 268.441 1.00 0.00 C +ATOM 117 CA GLU A 117 225.864 226.218 265.631 1.00 0.00 C +ATOM 118 CA ASP A 118 227.011 229.001 263.296 1.00 0.00 C +ATOM 119 CA ASP A 119 230.363 227.837 261.906 1.00 0.00 C +ATOM 120 CA GLY A 120 230.838 229.359 258.446 1.00 0.00 C +ATOM 121 CA GLN A 121 234.125 227.978 257.104 1.00 0.00 C +ATOM 122 CA GLY A 122 236.874 227.749 254.476 1.00 0.00 C +ATOM 123 CA GLY A 123 239.446 225.140 253.430 1.00 0.00 C +ATOM 124 CA ARG A 124 242.727 226.921 252.671 1.00 0.00 C +ATOM 125 CA ARG A 125 244.446 228.763 255.529 1.00 0.00 C +ATOM 126 CA LYS A 126 247.528 228.699 257.767 1.00 0.00 C +ATOM 127 CA LYS A 127 249.900 226.138 259.295 1.00 0.00 C +ATOM 128 CA SER A 128 248.872 222.614 258.278 1.00 0.00 C +ATOM 129 CA ILE A 129 246.087 221.602 260.673 1.00 0.00 C +ATOM 130 CA LYS A 130 245.029 218.030 261.474 1.00 0.00 C +ATOM 131 CA GLU A 131 243.397 215.740 258.904 1.00 0.00 C +ATOM 132 CA LYS A 132 243.425 213.875 255.582 1.00 0.00 C +ATOM 133 CA ILE A 133 243.753 211.331 252.764 1.00 0.00 C +ATOM 134 CA LYS A 134 245.491 211.950 249.430 1.00 0.00 C +ATOM 135 CA GLU A 135 245.183 211.764 245.637 1.00 0.00 C +ATOM 136 CA LYS A 136 245.240 212.738 241.954 1.00 0.00 C +ATOM 137 CA PHE A 137 247.255 213.978 238.968 1.00 0.00 C +ATOM 138 CA GLY A 138 244.636 215.283 236.528 1.00 0.00 C +ATOM 139 CA SER A 139 244.659 217.893 233.753 1.00 0.00 C +ATOM 140 CA GLY A 140 245.884 221.390 234.639 1.00 0.00 C +ATOM 141 CA LYS A 141 249.403 222.737 234.074 1.00 0.00 C +ATOM 142 CA HIS A 142 251.137 225.244 236.360 1.00 0.00 C +ATOM 143 CA LYS A 143 250.941 228.990 235.691 1.00 0.00 C +ATOM 144 CA ASP A 144 253.835 230.464 233.699 1.00 0.00 C +ATOM 145 CA GLU A 145 257.232 229.606 235.195 1.00 0.00 C +ATOM 146 CA GLN A 146 259.555 228.541 238.021 1.00 0.00 C +ATOM 147 CA THR A 147 260.559 226.189 240.845 1.00 0.00 C +ATOM 148 CA PRO A 148 263.180 223.441 240.533 1.00 0.00 C +ATOM 149 CA ALA A 149 263.402 220.517 238.100 1.00 0.00 C +ATOM 150 CA THR A 150 260.721 218.483 236.314 1.00 0.00 C +ATOM 151 CA ALA A 151 259.506 220.023 233.048 1.00 0.00 C +ATOM 152 CA THR A 152 260.197 219.906 229.303 1.00 0.00 C +ATOM 153 CA THR A 153 262.529 220.190 226.303 1.00 0.00 C +ATOM 154 CA THR A 154 265.552 222.501 226.497 1.00 0.00 C +ATOM 155 CA GLY A 155 268.986 220.906 226.913 1.00 0.00 C +ATOM 156 CA PRO A 156 272.071 219.901 224.915 1.00 0.00 C +ATOM 157 CA ALA A 157 275.032 221.968 223.701 1.00 0.00 C +ATOM 158 CA THR A 158 278.170 222.739 221.682 1.00 0.00 C +ATOM 159 CA THR A 159 281.409 222.820 219.678 1.00 0.00 C +ATOM 160 CA ASP A 160 284.025 220.350 218.423 1.00 0.00 C +ATOM 161 CA GLN A 161 286.640 217.722 219.299 1.00 0.00 C +ATOM 162 CA PRO A 162 285.128 215.425 221.935 1.00 0.00 C +ATOM 163 CA HIS A 163 282.638 215.893 224.781 1.00 0.00 C +ATOM 164 CA GLU A 164 278.828 215.871 224.767 1.00 0.00 C +ATOM 165 CA LYS A 165 276.168 213.575 226.239 1.00 0.00 C +ATOM 166 CA LYS A 166 274.315 210.452 227.393 1.00 0.00 C +ATOM 167 CA GLY A 167 272.942 208.048 224.775 1.00 0.00 C +ATOM 168 CA ILE A 168 275.186 205.929 222.540 1.00 0.00 C +ATOM 169 CA LEU A 169 272.867 203.740 220.456 1.00 0.00 C +ATOM 170 CA GLU A 170 269.929 201.374 219.916 1.00 0.00 C +ATOM 171 CA LYS A 171 266.561 202.547 221.256 1.00 0.00 C +ATOM 172 CA ILE A 172 263.300 203.728 219.678 1.00 0.00 C +ATOM 173 CA LYS A 173 260.645 201.098 218.935 1.00 0.00 C +ATOM 174 CA ASP A 174 259.534 197.560 219.808 1.00 0.00 C +ATOM 175 CA LYS A 175 261.812 195.450 222.015 1.00 0.00 C +ATOM 176 CA LEU A 176 263.070 192.608 224.220 1.00 0.00 C +ATOM 177 CA PRO A 177 262.826 189.201 222.531 1.00 0.00 C +ATOM 178 CA GLY A 178 264.624 187.774 219.490 1.00 0.00 C +ATOM 179 CA HIS A 179 268.070 186.800 220.789 1.00 0.00 C +ATOM 180 CA HIS A 180 271.635 187.241 219.519 1.00 0.00 C +ATOM 181 CA ASN A 181 273.687 190.388 220.152 1.00 0.00 C +ATOM 182 CA HIS A 182 276.687 192.086 221.775 1.00 0.00 C +ATOM 183 CA ASN A 183 279.600 191.055 224.004 1.00 0.00 C +ATOM 184 CA HIS A 184 282.142 191.846 226.729 1.00 0.00 C +ATOM 185 CA PRO A 185 283.777 188.560 227.754 1.00 0.00 C +TER 186 PRO A 185 +END diff --git a/Plants/Q96273/Q96273.dcd b/Plants/Q96273/Q96273.dcd new file mode 100644 index 0000000000000000000000000000000000000000..82968ba7f8fa67ae4d5c125bb64b97a072b253d2 --- /dev/null +++ b/Plants/Q96273/Q96273.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:debc7fd2bdf91e980480c42a0feab289927a8493222e41b581df0a39a02712a6 +size 12440276 diff --git a/Plants/Q96273/top.pdb b/Plants/Q96273/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..15c161a61dc48df52b6d4996fb9ad252179b1800 --- /dev/null +++ b/Plants/Q96273/top.pdb @@ -0,0 +1,101 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 258.671 256.090 223.083 1.00 0.00 C +ATOM 2 CA GLN A 2 255.695 254.006 221.935 1.00 0.00 C +ATOM 3 CA SER A 3 252.989 256.543 221.064 1.00 0.00 C +ATOM 4 CA ALA A 4 253.531 258.329 217.742 1.00 0.00 C +ATOM 5 CA LYS A 5 254.323 256.221 214.669 1.00 0.00 C +ATOM 6 CA GLU A 6 257.292 255.998 212.292 1.00 0.00 C +ATOM 7 CA LYS A 7 259.433 259.116 212.749 1.00 0.00 C +ATOM 8 CA ILE A 8 263.206 258.620 212.566 1.00 0.00 C +ATOM 9 CA SER A 9 265.046 255.284 212.635 1.00 0.00 C +ATOM 10 CA ASP A 10 266.505 252.109 214.152 1.00 0.00 C +ATOM 11 CA MET A 11 264.115 250.248 216.463 1.00 0.00 C +ATOM 12 CA ALA A 12 261.396 252.175 218.310 1.00 0.00 C +ATOM 13 CA SER A 13 261.815 255.931 217.827 1.00 0.00 C +ATOM 14 CA THR A 14 264.667 257.446 219.850 1.00 0.00 C +ATOM 15 CA ALA A 15 267.617 258.602 221.966 1.00 0.00 C +ATOM 16 CA LYS A 16 267.834 260.923 224.979 1.00 0.00 C +ATOM 17 CA GLU A 17 264.646 260.384 226.996 1.00 0.00 C +ATOM 18 CA LYS A 18 262.989 257.208 228.291 1.00 0.00 C +ATOM 19 CA LEU A 19 261.783 258.122 231.788 1.00 0.00 C +ATOM 20 CA ASN A 20 260.283 257.271 235.185 1.00 0.00 C +ATOM 21 CA ILE A 21 256.962 256.067 236.615 1.00 0.00 C +ATOM 22 CA GLY A 22 257.061 252.500 237.950 1.00 0.00 C +ATOM 23 CA GLY A 23 258.752 250.136 240.413 1.00 0.00 C +ATOM 24 CA ALA A 24 261.721 251.089 242.601 1.00 0.00 C +ATOM 25 CA LYS A 25 262.037 249.133 245.856 1.00 0.00 C +ATOM 26 CA ALA A 26 263.637 245.677 245.970 1.00 0.00 C +ATOM 27 CA GLN A 27 264.436 242.208 244.613 1.00 0.00 C +ATOM 28 CA GLY A 28 264.143 239.689 247.456 1.00 0.00 C +ATOM 29 CA HIS A 29 262.864 236.873 249.680 1.00 0.00 C +ATOM 30 CA ALA A 30 262.176 234.003 247.270 1.00 0.00 C +ATOM 31 CA GLU A 31 261.084 230.665 248.747 1.00 0.00 C +ATOM 32 CA LYS A 32 263.636 229.219 251.178 1.00 0.00 C +ATOM 33 CA THR A 33 266.917 231.121 251.538 1.00 0.00 C +ATOM 34 CA MET A 34 270.629 231.897 251.907 1.00 0.00 C +ATOM 35 CA ALA A 35 273.513 230.350 253.858 1.00 0.00 C +ATOM 36 CA ARG A 36 274.093 226.588 254.014 1.00 0.00 C +ATOM 37 CA THR A 37 273.069 224.233 251.200 1.00 0.00 C +ATOM 38 CA LYS A 38 270.805 223.696 248.183 1.00 0.00 C +ATOM 39 CA LYS A 39 267.831 221.511 249.133 1.00 0.00 C +ATOM 40 CA GLU A 40 264.025 221.489 248.972 1.00 0.00 C +ATOM 41 CA LYS A 41 261.732 223.378 251.359 1.00 0.00 C +ATOM 42 CA LYS A 42 258.422 225.259 251.222 1.00 0.00 C +ATOM 43 CA LEU A 43 255.726 226.702 253.495 1.00 0.00 C +ATOM 44 CA ALA A 44 254.620 230.262 254.279 1.00 0.00 C +ATOM 45 CA GLN A 45 256.154 231.931 257.342 1.00 0.00 C +ATOM 46 CA GLU A 46 256.223 235.739 257.458 1.00 0.00 C +ATOM 47 CA ARG A 47 253.257 237.536 255.881 1.00 0.00 C +ATOM 48 CA GLU A 48 251.131 240.479 257.038 1.00 0.00 C +ATOM 49 CA LYS A 49 250.748 243.995 258.453 1.00 0.00 C +ATOM 50 CA SER A 50 252.025 246.853 260.625 1.00 0.00 C +ATOM 51 CA LYS A 51 254.243 245.522 263.422 1.00 0.00 C +ATOM 52 CA GLU A 52 256.446 248.386 264.630 1.00 0.00 C +ATOM 53 CA ALA A 53 259.789 248.148 262.818 1.00 0.00 C +ATOM 54 CA GLN A 54 263.133 246.613 263.807 1.00 0.00 C +ATOM 55 CA ALA A 55 262.909 245.802 267.522 1.00 0.00 C +ATOM 56 CA LYS A 56 260.596 245.452 270.529 1.00 0.00 C +ATOM 57 CA ALA A 57 258.149 246.671 273.183 1.00 0.00 C +ATOM 58 CA ASP A 58 255.040 247.728 275.115 1.00 0.00 C +ATOM 59 CA LEU A 59 254.485 251.445 275.743 1.00 0.00 C +ATOM 60 CA HIS A 60 251.782 253.419 273.923 1.00 0.00 C +ATOM 61 CA GLN A 61 249.590 255.959 275.728 1.00 0.00 C +ATOM 62 CA SER A 62 245.924 256.714 275.015 1.00 0.00 C +ATOM 63 CA LYS A 63 244.884 259.900 276.827 1.00 0.00 C +ATOM 64 CA ALA A 64 243.693 263.067 278.578 1.00 0.00 C +ATOM 65 CA GLU A 65 240.563 265.008 277.602 1.00 0.00 C +ATOM 66 CA HIS A 66 237.282 263.991 275.953 1.00 0.00 C +ATOM 67 CA ALA A 67 233.579 263.285 276.504 1.00 0.00 C +ATOM 68 CA ALA A 68 230.871 265.883 277.164 1.00 0.00 C +ATOM 69 CA ASP A 69 230.018 268.772 279.497 1.00 0.00 C +ATOM 70 CA ALA A 70 228.930 272.399 279.916 1.00 0.00 C +ATOM 71 CA GLN A 71 231.525 274.746 278.409 1.00 0.00 C +ATOM 72 CA VAL A 72 233.395 275.089 275.108 1.00 0.00 C +ATOM 73 CA HIS A 73 233.043 275.854 271.392 1.00 0.00 C +ATOM 74 CA GLY A 74 233.890 274.498 267.934 1.00 0.00 C +ATOM 75 CA HIS A 75 230.630 274.737 265.977 1.00 0.00 C +ATOM 76 CA HIS A 76 227.554 272.514 265.643 1.00 0.00 C +ATOM 77 CA LEU A 77 227.548 270.728 262.277 1.00 0.00 C +ATOM 78 CA PRO A 78 225.440 269.818 259.237 1.00 0.00 C +ATOM 79 CA GLY A 79 221.700 269.466 259.873 1.00 0.00 C +ATOM 80 CA HIS A 80 220.065 266.044 259.507 1.00 0.00 C +ATOM 81 CA SER A 81 222.647 263.497 258.338 1.00 0.00 C +ATOM 82 CA THR A 82 223.262 261.442 255.190 1.00 0.00 C +ATOM 83 CA TYR A 83 224.138 261.182 251.492 1.00 0.00 C +ATOM 84 CA PRO A 84 225.879 258.042 250.214 1.00 0.00 C +ATOM 85 CA THR A 85 227.692 255.507 252.405 1.00 0.00 C +ATOM 86 CA ARG A 86 228.656 252.563 250.187 1.00 0.00 C +ATOM 87 CA ALA A 87 230.189 249.102 250.619 1.00 0.00 C +ATOM 88 CA THR A 88 230.775 245.947 252.673 1.00 0.00 C +ATOM 89 CA GLY A 89 233.981 244.117 251.730 1.00 0.00 C +ATOM 90 CA ALA A 90 236.082 246.731 249.923 1.00 0.00 C +ATOM 91 CA ASN A 91 235.858 246.864 246.122 1.00 0.00 C +ATOM 92 CA TYR A 92 236.895 244.827 243.073 1.00 0.00 C +ATOM 93 CA PRO A 93 236.289 241.602 241.137 1.00 0.00 C +ATOM 94 CA PRO A 94 233.535 239.494 239.561 1.00 0.00 C +ATOM 95 CA GLY A 95 233.507 235.999 238.044 1.00 0.00 C +ATOM 96 CA GLN A 96 234.742 232.526 239.011 1.00 0.00 C +ATOM 97 CA ILE A 97 235.916 232.001 242.598 1.00 0.00 C +TER 98 ILE A 97 +END diff --git a/Plants/Q96414/Q96414.dcd b/Plants/Q96414/Q96414.dcd new file mode 100644 index 0000000000000000000000000000000000000000..af8b042f6ed8343bd5561a7db51592a3b1a20bd3 --- /dev/null +++ b/Plants/Q96414/Q96414.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:7c7815780dbeb240bc182b3cee3e8ccdcbde358b46392d2e80e54faada112214 +size 5720276 diff --git a/Plants/Q96414/top.pdb b/Plants/Q96414/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..d3e3c74536d3893eb9b1af839b9af87009a5dd97 --- /dev/null +++ b/Plants/Q96414/top.pdb @@ -0,0 +1,45 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA GLU A 1 218.359 230.620 230.714 1.00 0.00 C +ATOM 2 CA PHE A 2 220.096 227.440 231.891 1.00 0.00 C +ATOM 3 CA THR A 3 222.826 226.704 234.445 1.00 0.00 C +ATOM 4 CA GLU A 4 225.153 223.721 234.893 1.00 0.00 C +ATOM 5 CA ALA A 5 228.859 224.521 235.262 1.00 0.00 C +ATOM 6 CA GLU A 6 231.537 224.144 237.946 1.00 0.00 C +ATOM 7 CA SER A 7 234.802 224.918 239.751 1.00 0.00 C +ATOM 8 CA ASN A 8 238.422 226.100 239.632 1.00 0.00 C +ATOM 9 CA MET A 9 239.438 228.347 242.536 1.00 0.00 C +ATOM 10 CA ASN A 10 238.747 232.059 242.022 1.00 0.00 C +ATOM 11 CA ASP A 11 237.690 235.407 243.502 1.00 0.00 C +ATOM 12 CA LEU A 12 236.443 238.921 244.287 1.00 0.00 C +ATOM 13 CA VAL A 13 237.228 241.601 246.877 1.00 0.00 C +ATOM 14 CA SER A 14 239.593 244.451 247.777 1.00 0.00 C +ATOM 15 CA GLU A 15 240.404 245.837 251.232 1.00 0.00 C +ATOM 16 CA TYR A 16 241.915 249.334 251.323 1.00 0.00 C +ATOM 17 CA GLN A 17 242.987 252.791 252.512 1.00 0.00 C +ATOM 18 CA GLN A 18 246.202 254.790 252.084 1.00 0.00 C +ATOM 19 CA TYR A 19 246.272 258.202 253.779 1.00 0.00 C +ATOM 20 CA GLN A 20 245.308 260.583 256.593 1.00 0.00 C +ATOM 21 CA ASP A 21 247.611 259.862 259.541 1.00 0.00 C +ATOM 22 CA ALA A 22 248.619 262.396 262.202 1.00 0.00 C +ATOM 23 CA THR A 23 251.514 264.574 261.022 1.00 0.00 C +ATOM 24 CA ALA A 24 254.634 266.681 261.608 1.00 0.00 C +ATOM 25 CA ASP A 25 257.121 266.955 258.735 1.00 0.00 C +ATOM 26 CA GLU A 26 258.823 270.137 257.513 1.00 0.00 C +ATOM 27 CA GLU A 27 262.510 269.620 258.319 1.00 0.00 C +ATOM 28 CA GLY A 28 266.055 268.283 258.724 1.00 0.00 C +ATOM 29 CA ASP A 29 269.839 267.921 258.977 1.00 0.00 C +ATOM 30 CA TYR A 30 273.399 268.173 257.644 1.00 0.00 C +ATOM 31 CA PHE A 31 275.421 264.969 257.243 1.00 0.00 C +ATOM 32 CA GLU A 32 273.239 262.412 255.448 1.00 0.00 C +ATOM 33 CA ASP A 33 271.003 262.943 252.410 1.00 0.00 C +ATOM 34 CA GLU A 34 268.140 265.456 252.496 1.00 0.00 C +ATOM 35 CA GLU A 35 264.969 263.551 251.582 1.00 0.00 C +ATOM 36 CA GLU A 36 264.301 259.950 250.532 1.00 0.00 C +ATOM 37 CA GLU A 37 263.867 257.101 253.025 1.00 0.00 C +ATOM 38 CA ARG A 38 266.856 254.834 253.688 1.00 0.00 C +ATOM 39 CA GLN A 39 265.680 251.249 253.159 1.00 0.00 C +ATOM 40 CA GLU A 40 265.947 247.484 252.643 1.00 0.00 C +ATOM 41 CA MET A 41 268.172 244.959 254.429 1.00 0.00 C +TER 42 MET A 41 +END diff --git a/Plants/Q9AS77/Q9AS77.dcd b/Plants/Q9AS77/Q9AS77.dcd new file mode 100644 index 0000000000000000000000000000000000000000..4cf75614f7e1e82af8e06e737cf6e7428d35ebb6 --- /dev/null +++ b/Plants/Q9AS77/Q9AS77.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:84e760db1e932dabfb46c5b2a64b4581c84e8b4ad7e0d4b57c040b5002a865cd +size 6920276 diff --git a/Plants/Q9AS77/top.pdb b/Plants/Q9AS77/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..c822a3aa81f93057fe7b4fdec4641ee9deefba9e --- /dev/null +++ b/Plants/Q9AS77/top.pdb @@ -0,0 +1,55 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 241.012 252.171 276.214 1.00 0.00 C +ATOM 2 CA GLU A 2 241.527 255.211 278.453 1.00 0.00 C +ATOM 3 CA VAL A 3 239.206 256.442 281.212 1.00 0.00 C +ATOM 4 CA GLY A 4 235.971 256.266 283.217 1.00 0.00 C +ATOM 5 CA ASP A 5 236.231 256.106 287.014 1.00 0.00 C +ATOM 6 CA VAL A 6 237.896 252.987 288.434 1.00 0.00 C +ATOM 7 CA HIS A 7 240.856 253.460 290.786 1.00 0.00 C +ATOM 8 CA LYS A 8 244.055 255.272 289.787 1.00 0.00 C +ATOM 9 CA GLY A 9 246.205 254.855 286.669 1.00 0.00 C +ATOM 10 CA TRP A 10 245.663 257.139 283.668 1.00 0.00 C +ATOM 11 CA PRO A 11 246.490 259.387 280.705 1.00 0.00 C +ATOM 12 CA ARG A 12 248.087 258.677 277.320 1.00 0.00 C +ATOM 13 CA ILE A 13 247.914 255.815 274.811 1.00 0.00 C +ATOM 14 CA GLY A 14 250.878 255.017 272.553 1.00 0.00 C +ATOM 15 CA GLY A 15 251.870 257.813 270.163 1.00 0.00 C +ATOM 16 CA ALA A 16 251.388 259.470 266.766 1.00 0.00 C +ATOM 17 CA PRO A 17 251.703 258.254 263.170 1.00 0.00 C +ATOM 18 CA ALA A 18 252.585 259.770 259.787 1.00 0.00 C +ATOM 19 CA SER A 19 253.059 257.729 256.605 1.00 0.00 C +ATOM 20 CA GLY A 20 251.217 259.173 253.598 1.00 0.00 C +ATOM 21 CA GLY A 21 250.354 261.662 250.846 1.00 0.00 C +ATOM 22 CA GLY A 22 248.173 264.781 251.019 1.00 0.00 C +ATOM 23 CA GLY A 23 249.390 267.055 248.215 1.00 0.00 C +ATOM 24 CA GLU A 24 247.544 270.097 246.853 1.00 0.00 C +ATOM 25 CA ALA A 25 244.779 269.835 244.245 1.00 0.00 C +ATOM 26 CA ARG A 26 243.473 266.335 243.497 1.00 0.00 C +ATOM 27 CA THR A 27 243.612 265.534 239.774 1.00 0.00 C +ATOM 28 CA ASP A 28 242.984 263.371 236.702 1.00 0.00 C +ATOM 29 CA VAL A 29 243.234 259.914 235.119 1.00 0.00 C +ATOM 30 CA GLY A 30 246.010 258.087 233.256 1.00 0.00 C +ATOM 31 CA SER A 31 247.576 254.616 233.117 1.00 0.00 C +ATOM 32 CA ARG A 32 246.789 252.599 229.983 1.00 0.00 C +ATOM 33 CA ARG A 33 245.477 249.087 230.661 1.00 0.00 C +ATOM 34 CA ASP A 34 246.394 247.932 234.174 1.00 0.00 C +ATOM 35 CA GLY A 35 249.480 245.730 233.789 1.00 0.00 C +ATOM 36 CA GLU A 36 251.149 242.375 234.476 1.00 0.00 C +ATOM 37 CA GLY A 37 254.177 240.111 234.001 1.00 0.00 C +ATOM 38 CA GLY A 38 256.867 240.580 231.344 1.00 0.00 C +ATOM 39 CA GLY A 39 259.897 239.712 229.204 1.00 0.00 C +ATOM 40 CA THR A 40 263.672 239.657 228.694 1.00 0.00 C +ATOM 41 CA PRO A 41 265.749 236.568 227.881 1.00 0.00 C +ATOM 42 CA ALA A 42 264.785 232.901 227.508 1.00 0.00 C +ATOM 43 CA ASP A 43 261.057 232.802 226.730 1.00 0.00 C +ATOM 44 CA GLY A 44 257.288 232.785 227.289 1.00 0.00 C +ATOM 45 CA GLY A 45 255.064 231.390 224.528 1.00 0.00 C +ATOM 46 CA ALA A 46 255.403 228.344 222.263 1.00 0.00 C +ATOM 47 CA GLU A 47 258.877 228.335 220.699 1.00 0.00 C +ATOM 48 CA ALA A 48 261.657 226.688 222.717 1.00 0.00 C +ATOM 49 CA MET A 49 260.809 226.249 226.405 1.00 0.00 C +ATOM 50 CA PRO A 50 258.699 223.087 226.668 1.00 0.00 C +ATOM 51 CA LEU A 51 255.768 220.768 227.408 1.00 0.00 C +TER 52 LEU A 51 +END diff --git a/Plants/Q9AUU1/Q9AUU1.dcd b/Plants/Q9AUU1/Q9AUU1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..f94e85a2a7944a38f617e800e3a3ad87a0fced95 --- /dev/null +++ b/Plants/Q9AUU1/Q9AUU1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:67d77120c9ea8b1cecb2bfdda2db9cb33c56f322c6ea217d754701d1ba8f6461 +size 13880276 diff --git a/Plants/Q9AUU1/top.pdb b/Plants/Q9AUU1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..a44c3fce3504940f00850774fb228e1ce46808f6 --- /dev/null +++ b/Plants/Q9AUU1/top.pdb @@ -0,0 +1,113 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 285.383 224.912 208.770 1.00 0.00 C +ATOM 2 CA ALA A 2 283.641 225.735 212.058 1.00 0.00 C +ATOM 3 CA ASP A 3 283.710 225.950 215.861 1.00 0.00 C +ATOM 4 CA GLY A 4 283.994 229.648 216.731 1.00 0.00 C +ATOM 5 CA TRP A 5 283.456 231.480 220.028 1.00 0.00 C +ATOM 6 CA GLY A 6 281.610 232.758 223.106 1.00 0.00 C +ATOM 7 CA THR A 7 278.508 231.976 225.175 1.00 0.00 C +ATOM 8 CA GLY A 8 275.041 231.500 223.667 1.00 0.00 C +ATOM 9 CA LYS A 9 274.831 232.517 220.002 1.00 0.00 C +ATOM 10 CA GLY A 10 277.217 233.232 217.119 1.00 0.00 C +ATOM 11 CA ASP A 11 278.329 236.864 217.424 1.00 0.00 C +ATOM 12 CA VAL A 12 275.335 238.881 216.206 1.00 0.00 C +ATOM 13 CA GLU A 13 271.629 238.057 215.877 1.00 0.00 C +ATOM 14 CA GLU A 14 268.176 239.361 214.935 1.00 0.00 C +ATOM 15 CA GLU A 15 267.099 241.276 211.822 1.00 0.00 C +ATOM 16 CA ARG A 16 266.714 244.733 210.269 1.00 0.00 C +ATOM 17 CA ASN A 17 264.627 246.676 212.796 1.00 0.00 C +ATOM 18 CA GLN A 18 265.494 246.588 216.505 1.00 0.00 C +ATOM 19 CA ILE A 19 266.682 245.649 220.001 1.00 0.00 C +ATOM 20 CA MET A 20 266.058 243.038 222.705 1.00 0.00 C +ATOM 21 CA GLN A 21 263.290 240.620 223.710 1.00 0.00 C +ATOM 22 CA LYS A 22 260.412 239.187 225.754 1.00 0.00 C +ATOM 23 CA ILE A 23 257.477 237.661 227.644 1.00 0.00 C +ATOM 24 CA PHE A 24 253.902 238.935 227.983 1.00 0.00 C +ATOM 25 CA GLY A 25 253.205 240.707 224.683 1.00 0.00 C +ATOM 26 CA ASP A 26 251.680 244.071 223.747 1.00 0.00 C +ATOM 27 CA GLU A 27 248.279 245.572 224.576 1.00 0.00 C +ATOM 28 CA SER A 28 245.228 244.691 226.682 1.00 0.00 C +ATOM 29 CA GLY A 29 241.634 243.614 226.025 1.00 0.00 C +ATOM 30 CA GLU A 30 238.902 241.607 224.285 1.00 0.00 C +ATOM 31 CA GLU A 31 236.000 239.169 223.893 1.00 0.00 C +ATOM 32 CA VAL A 32 235.176 237.858 227.374 1.00 0.00 C +ATOM 33 CA VAL A 33 234.613 240.659 229.896 1.00 0.00 C +ATOM 34 CA VAL A 34 235.683 240.521 233.550 1.00 0.00 C +ATOM 35 CA GLU A 35 233.467 242.983 235.433 1.00 0.00 C +ATOM 36 CA GLU A 36 234.522 246.413 236.714 1.00 0.00 C +ATOM 37 CA GLU A 37 234.963 250.064 235.718 1.00 0.00 C +ATOM 38 CA GLU A 38 235.571 252.892 238.198 1.00 0.00 C +ATOM 39 CA GLU A 39 234.571 256.434 237.212 1.00 0.00 C +ATOM 40 CA GLU A 40 236.151 259.628 238.560 1.00 0.00 C +ATOM 41 CA ASP A 41 238.083 262.375 240.359 1.00 0.00 C +ATOM 42 CA PRO A 42 237.303 265.732 238.734 1.00 0.00 C +ATOM 43 CA GLU A 43 234.790 268.595 238.793 1.00 0.00 C +ATOM 44 CA GLU A 44 231.676 270.790 238.795 1.00 0.00 C +ATOM 45 CA TYR A 45 229.001 273.503 238.734 1.00 0.00 C +ATOM 46 CA LEU A 46 229.290 275.319 242.071 1.00 0.00 C +ATOM 47 CA ALA A 47 227.796 277.198 245.030 1.00 0.00 C +ATOM 48 CA HIS A 48 224.259 275.827 245.388 1.00 0.00 C +ATOM 49 CA ASP A 49 223.427 272.141 245.871 1.00 0.00 C +ATOM 50 CA GLY A 50 225.837 269.236 245.353 1.00 0.00 C +ATOM 51 CA ASP A 51 229.249 269.991 246.872 1.00 0.00 C +ATOM 52 CA ASP A 52 232.879 270.257 247.996 1.00 0.00 C +ATOM 53 CA ALA A 53 235.798 270.893 250.361 1.00 0.00 C +ATOM 54 CA THR A 54 236.319 273.379 253.201 1.00 0.00 C +ATOM 55 CA SER A 55 236.748 277.096 252.483 1.00 0.00 C +ATOM 56 CA GLY A 56 237.546 280.393 250.747 1.00 0.00 C +ATOM 57 CA GLY A 57 237.825 284.183 251.007 1.00 0.00 C +ATOM 58 CA ASP A 58 240.555 285.533 248.718 1.00 0.00 C +ATOM 59 CA ARG A 59 243.400 283.408 247.338 1.00 0.00 C +ATOM 60 CA GLY A 60 243.258 283.880 243.560 1.00 0.00 C +ATOM 61 CA SER A 61 243.748 283.703 239.786 1.00 0.00 C +ATOM 62 CA GLY A 62 243.229 281.268 236.903 1.00 0.00 C +ATOM 63 CA GLY A 63 246.098 278.778 236.612 1.00 0.00 C +ATOM 64 CA GLY A 64 245.082 275.642 238.521 1.00 0.00 C +ATOM 65 CA GLY A 65 243.980 272.319 240.024 1.00 0.00 C +ATOM 66 CA GLY A 66 243.589 268.580 239.402 1.00 0.00 C +ATOM 67 CA ASP A 67 244.864 266.806 242.523 1.00 0.00 C +ATOM 68 CA GLY A 68 245.151 266.110 246.258 1.00 0.00 C +ATOM 69 CA GLY A 69 244.822 268.697 249.035 1.00 0.00 C +ATOM 70 CA GLN A 70 242.619 267.656 251.965 1.00 0.00 C +ATOM 71 CA LEU A 71 241.826 269.669 255.101 1.00 0.00 C +ATOM 72 CA GLN A 72 242.002 268.969 258.842 1.00 0.00 C +ATOM 73 CA ASP A 73 243.380 268.533 262.367 1.00 0.00 C +ATOM 74 CA ARG A 74 244.117 264.838 262.928 1.00 0.00 C +ATOM 75 CA ARG A 75 246.875 263.701 265.298 1.00 0.00 C +ATOM 76 CA LEU A 76 246.690 265.921 268.389 1.00 0.00 C +ATOM 77 CA ALA A 77 249.259 265.612 271.186 1.00 0.00 C +ATOM 78 CA SER A 78 250.305 266.889 274.619 1.00 0.00 C +ATOM 79 CA PRO A 79 252.292 264.824 277.130 1.00 0.00 C +ATOM 80 CA ALA A 80 252.557 261.029 276.921 1.00 0.00 C +ATOM 81 CA ALA A 81 250.400 257.888 276.995 1.00 0.00 C +ATOM 82 CA GLU A 82 248.108 255.506 278.888 1.00 0.00 C +ATOM 83 CA VAL A 83 247.805 253.929 282.344 1.00 0.00 C +ATOM 84 CA VAL A 84 246.107 250.527 282.582 1.00 0.00 C +ATOM 85 CA GLU A 85 242.926 249.283 284.271 1.00 0.00 C +ATOM 86 CA GLU A 86 241.994 245.624 284.779 1.00 0.00 C +ATOM 87 CA TYR A 87 238.298 244.718 284.965 1.00 0.00 C +ATOM 88 CA GLY A 88 237.562 241.098 285.899 1.00 0.00 C +ATOM 89 CA LEU A 89 238.326 237.441 285.151 1.00 0.00 C +ATOM 90 CA GLU A 90 238.537 234.534 287.605 1.00 0.00 C +ATOM 91 CA ASP A 91 241.670 235.075 289.705 1.00 0.00 C +ATOM 92 CA ASN A 92 242.084 233.128 292.954 1.00 0.00 C +ATOM 93 CA GLY A 93 244.475 231.428 295.385 1.00 0.00 C +ATOM 94 CA HIS A 94 247.662 233.343 296.219 1.00 0.00 C +ATOM 95 CA GLY A 95 251.134 232.006 295.398 1.00 0.00 C +ATOM 96 CA GLY A 96 254.149 231.042 293.278 1.00 0.00 C +ATOM 97 CA ASP A 97 255.101 234.268 291.488 1.00 0.00 C +ATOM 98 CA GLN A 98 257.184 234.487 288.305 1.00 0.00 C +ATOM 99 CA TRP A 99 258.174 231.448 286.231 1.00 0.00 C +ATOM 100 CA TYR A 100 260.075 228.214 285.563 1.00 0.00 C +ATOM 101 CA GLU A 101 261.019 225.611 282.946 1.00 0.00 C +ATOM 102 CA THR A 102 263.208 225.902 279.841 1.00 0.00 C +ATOM 103 CA THR A 103 264.001 222.299 278.887 1.00 0.00 C +ATOM 104 CA ASN A 104 264.805 220.565 282.183 1.00 0.00 C +ATOM 105 CA GLY A 105 263.356 220.021 285.665 1.00 0.00 C +ATOM 106 CA PHE A 106 263.273 218.824 289.281 1.00 0.00 C +ATOM 107 CA TRP A 107 261.032 215.754 289.544 1.00 0.00 C +ATOM 108 CA ARG A 108 258.542 213.144 288.319 1.00 0.00 C +ATOM 109 CA LEU A 109 259.207 209.503 287.416 1.00 0.00 C +TER 110 LEU A 109 +END diff --git a/Plants/Q9AV19/Q9AV19.dcd b/Plants/Q9AV19/Q9AV19.dcd new file mode 100644 index 0000000000000000000000000000000000000000..3316b4cd8d7818e7b5d4998fd4e322b820976c1b --- /dev/null +++ b/Plants/Q9AV19/Q9AV19.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5b7fa8209a0b6ab3a7d91eaf244fdef90310443ce07bacc33ce91687761b8397 +size 7040276 diff --git a/Plants/Q9AV19/top.pdb b/Plants/Q9AV19/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..615184a32d80d8edaad771ec53a987418212daed --- /dev/null +++ b/Plants/Q9AV19/top.pdb @@ -0,0 +1,56 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 262.148 241.293 272.047 1.00 0.00 C +ATOM 2 CA PRO A 2 260.046 244.376 272.817 1.00 0.00 C +ATOM 3 CA GLU A 3 256.535 243.520 271.609 1.00 0.00 C +ATOM 4 CA LYS A 4 255.054 244.011 268.133 1.00 0.00 C +ATOM 5 CA GLN A 5 255.828 245.459 264.694 1.00 0.00 C +ATOM 6 CA ALA A 6 258.567 247.701 263.284 1.00 0.00 C +ATOM 7 CA PRO A 7 259.135 251.428 262.735 1.00 0.00 C +ATOM 8 CA LYS A 8 259.502 254.721 264.617 1.00 0.00 C +ATOM 9 CA PRO A 9 261.490 253.818 267.739 1.00 0.00 C +ATOM 10 CA ALA A 10 264.659 252.949 269.667 1.00 0.00 C +ATOM 11 CA ALA A 11 266.278 249.703 268.501 1.00 0.00 C +ATOM 12 CA VAL A 12 269.913 248.857 269.265 1.00 0.00 C +ATOM 13 CA ALA A 13 271.949 245.975 270.702 1.00 0.00 C +ATOM 14 CA ALA A 14 271.242 243.079 268.330 1.00 0.00 C +ATOM 15 CA PRO A 15 267.959 241.439 269.354 1.00 0.00 C +ATOM 16 CA GLN A 16 265.227 242.190 266.807 1.00 0.00 C +ATOM 17 CA ARG A 17 261.594 243.197 266.261 1.00 0.00 C +ATOM 18 CA GLU A 18 259.992 240.863 263.711 1.00 0.00 C +ATOM 19 CA ARG A 19 256.936 239.494 261.894 1.00 0.00 C +ATOM 20 CA GLY A 20 253.933 240.040 259.613 1.00 0.00 C +ATOM 21 CA GLY A 21 250.312 240.315 258.461 1.00 0.00 C +ATOM 22 CA ARG A 22 247.251 239.026 256.593 1.00 0.00 C +ATOM 23 CA GLY A 23 243.929 240.838 256.153 1.00 0.00 C +ATOM 24 CA ALA A 24 241.304 238.134 255.593 1.00 0.00 C +ATOM 25 CA ALA A 25 239.015 236.244 253.205 1.00 0.00 C +ATOM 26 CA ALA A 26 237.640 236.285 249.652 1.00 0.00 C +ATOM 27 CA ASP A 27 236.634 235.712 246.022 1.00 0.00 C +ATOM 28 CA GLY A 28 237.956 235.995 242.460 1.00 0.00 C +ATOM 29 CA VAL A 29 238.045 239.726 241.693 1.00 0.00 C +ATOM 30 CA HIS A 30 239.851 242.832 242.963 1.00 0.00 C +ATOM 31 CA GLU A 31 239.496 245.953 240.806 1.00 0.00 C +ATOM 32 CA ARG A 32 242.869 247.693 240.485 1.00 0.00 C +ATOM 33 CA GLU A 33 244.771 248.238 237.228 1.00 0.00 C +ATOM 34 CA ALA A 34 244.640 251.968 236.464 1.00 0.00 C +ATOM 35 CA GLY A 35 242.499 253.985 238.887 1.00 0.00 C +ATOM 36 CA ASP A 36 240.533 256.994 237.624 1.00 0.00 C +ATOM 37 CA ARG A 37 239.657 260.517 238.779 1.00 0.00 C +ATOM 38 CA PRO A 38 238.736 262.413 241.954 1.00 0.00 C +ATOM 39 CA ALA A 39 235.564 264.509 241.715 1.00 0.00 C +ATOM 40 CA LYS A 40 234.809 265.409 238.091 1.00 0.00 C +ATOM 41 CA ALA A 41 234.927 265.117 234.294 1.00 0.00 C +ATOM 42 CA GLN A 42 236.020 267.470 231.503 1.00 0.00 C +ATOM 43 CA TRP A 43 238.935 266.327 229.332 1.00 0.00 C +ATOM 44 CA MET A 44 241.583 269.047 229.663 1.00 0.00 C +ATOM 45 CA ASP A 45 244.790 267.453 230.963 1.00 0.00 C +ATOM 46 CA GLY A 46 246.822 266.764 227.815 1.00 0.00 C +ATOM 47 CA TRP A 47 247.456 263.014 227.588 1.00 0.00 C +ATOM 48 CA ARG A 48 249.215 260.037 229.188 1.00 0.00 C +ATOM 49 CA ARG A 49 252.479 258.353 228.173 1.00 0.00 C +ATOM 50 CA GLU A 50 253.112 254.908 229.671 1.00 0.00 C +ATOM 51 CA ASP A 51 250.068 253.928 231.742 1.00 0.00 C +ATOM 52 CA GLY A 52 251.094 250.684 233.457 1.00 0.00 C +TER 53 GLY A 52 +END diff --git a/Plants/Q9AVT2/Q9AVT2.dcd b/Plants/Q9AVT2/Q9AVT2.dcd new file mode 100644 index 0000000000000000000000000000000000000000..f1091b1dbaf619cfaa7eec8756bbdd70c712de40 --- /dev/null +++ b/Plants/Q9AVT2/Q9AVT2.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2316c5d797edb92d7fd3fbfaa4fdc9d2189c7c57d4b607c20526b25cc8958db3 +size 40620276 diff --git a/Plants/Q9AVT2/top.pdb b/Plants/Q9AVT2/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..4cc858c73de1f2f28b991ed63ee4b107e0773d53 --- /dev/null +++ b/Plants/Q9AVT2/top.pdb @@ -0,0 +1,223 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA ALA A 1 204.531 260.797 242.793 1.00 0.00 C +ATOM 2 CA GLY A 2 203.330 257.593 241.117 1.00 0.00 C +ATOM 3 CA GLY A 3 203.638 253.856 241.789 1.00 0.00 C +ATOM 4 CA ALA A 4 201.204 253.197 244.646 1.00 0.00 C +ATOM 5 CA HIS A 5 202.864 250.591 246.875 1.00 0.00 C +ATOM 6 CA ASP A 6 206.516 251.358 247.644 1.00 0.00 C +ATOM 7 CA ILE A 7 209.843 253.154 247.177 1.00 0.00 C +ATOM 8 CA ASP A 8 212.709 255.224 248.598 1.00 0.00 C +ATOM 9 CA GLU A 9 214.796 256.734 245.791 1.00 0.00 C +ATOM 10 CA GLN A 10 215.466 260.316 246.902 1.00 0.00 C +ATOM 11 CA ARG A 11 214.224 263.844 246.174 1.00 0.00 C +ATOM 12 CA PRO A 12 213.526 266.218 249.071 1.00 0.00 C +ATOM 13 CA THR A 13 214.926 269.188 251.003 1.00 0.00 C +ATOM 14 CA TYR A 14 216.569 272.289 249.520 1.00 0.00 C +ATOM 15 CA GLY A 15 218.079 273.438 246.216 1.00 0.00 C +ATOM 16 CA SER A 16 218.774 276.437 243.972 1.00 0.00 C +ATOM 17 CA GLY A 17 217.170 279.643 242.682 1.00 0.00 C +ATOM 18 CA SER A 18 216.542 282.010 239.763 1.00 0.00 C +ATOM 19 CA THR A 19 218.239 283.398 236.647 1.00 0.00 C +ATOM 20 CA PRO A 20 216.048 286.113 235.116 1.00 0.00 C +ATOM 21 CA SER A 21 214.215 288.278 237.659 1.00 0.00 C +ATOM 22 CA TYR A 22 214.813 291.969 238.391 1.00 0.00 C +ATOM 23 CA GLU A 23 217.895 294.102 239.072 1.00 0.00 C +ATOM 24 CA GLY A 24 220.996 294.158 241.285 1.00 0.00 C +ATOM 25 CA ASP A 25 223.770 291.948 242.678 1.00 0.00 C +ATOM 26 CA GLU A 26 224.419 289.345 239.973 1.00 0.00 C +ATOM 27 CA SER A 27 226.762 287.343 237.733 1.00 0.00 C +ATOM 28 CA THR A 28 229.416 284.629 237.403 1.00 0.00 C +ATOM 29 CA TYR A 29 229.543 282.497 234.248 1.00 0.00 C +ATOM 30 CA GLY A 30 231.492 279.223 234.241 1.00 0.00 C +ATOM 31 CA GLY A 31 234.558 277.321 233.019 1.00 0.00 C +ATOM 32 CA GLY A 32 235.411 277.420 229.307 1.00 0.00 C +ATOM 33 CA GLY A 33 239.096 278.066 228.588 1.00 0.00 C +ATOM 34 CA GLY A 34 241.497 275.114 228.393 1.00 0.00 C +ATOM 35 CA GLY A 35 244.388 272.775 227.564 1.00 0.00 C +ATOM 36 CA PHE A 36 247.491 274.570 228.855 1.00 0.00 C +ATOM 37 CA GLU A 37 251.076 275.211 229.973 1.00 0.00 C +ATOM 38 CA TYR A 38 253.576 275.558 227.119 1.00 0.00 C +ATOM 39 CA GLY A 39 256.832 277.536 227.179 1.00 0.00 C +ATOM 40 CA ARG A 40 260.288 275.946 227.382 1.00 0.00 C +ATOM 41 CA PRO A 41 261.413 274.809 230.841 1.00 0.00 C +ATOM 42 CA LYS A 42 261.764 273.167 234.261 1.00 0.00 C +ATOM 43 CA PRO A 43 258.907 271.213 235.852 1.00 0.00 C +ATOM 44 CA GLN A 44 255.476 269.617 235.408 1.00 0.00 C +ATOM 45 CA ALA A 45 251.815 269.548 236.461 1.00 0.00 C +ATOM 46 CA ALA A 46 249.963 266.776 238.304 1.00 0.00 C +ATOM 47 CA GLN A 47 249.711 268.045 241.888 1.00 0.00 C +ATOM 48 CA GLY A 48 251.773 269.962 244.455 1.00 0.00 C +ATOM 49 CA TYR A 49 251.449 271.116 248.071 1.00 0.00 C +ATOM 50 CA ARG A 50 250.729 268.098 250.283 1.00 0.00 C +ATOM 51 CA PRO A 51 248.062 267.126 252.825 1.00 0.00 C +ATOM 52 CA LYS A 52 244.465 267.494 254.025 1.00 0.00 C +ATOM 53 CA PRO A 53 241.162 269.172 254.916 1.00 0.00 C +ATOM 54 CA GLN A 54 239.921 272.438 253.396 1.00 0.00 C +ATOM 55 CA PRO A 55 239.905 276.248 253.402 1.00 0.00 C +ATOM 56 CA VAL A 56 239.605 279.324 255.629 1.00 0.00 C +ATOM 57 CA HIS A 57 237.656 282.350 256.881 1.00 0.00 C +ATOM 58 CA GLY A 58 234.175 283.420 258.000 1.00 0.00 C +ATOM 59 CA TYR A 59 232.263 286.710 258.194 1.00 0.00 C +ATOM 60 CA GLU A 60 233.987 289.038 260.667 1.00 0.00 C +ATOM 61 CA PRO A 61 235.198 291.477 263.332 1.00 0.00 C +ATOM 62 CA GLU A 62 238.131 291.021 265.720 1.00 0.00 C +ATOM 63 CA PRO A 63 237.578 287.794 267.668 1.00 0.00 C +ATOM 64 CA GLU A 64 234.942 285.262 266.594 1.00 0.00 C +ATOM 65 CA PRO A 65 236.738 282.676 264.449 1.00 0.00 C +ATOM 66 CA ALA A 66 239.982 281.153 263.155 1.00 0.00 C +ATOM 67 CA TYR A 67 243.111 280.364 265.181 1.00 0.00 C +ATOM 68 CA GLY A 68 245.620 277.690 264.147 1.00 0.00 C +ATOM 69 CA PHE A 69 246.608 274.015 263.964 1.00 0.00 C +ATOM 70 CA LYS A 70 246.624 270.783 261.947 1.00 0.00 C +ATOM 71 CA PRO A 71 249.810 270.941 259.864 1.00 0.00 C +ATOM 72 CA ASN A 72 252.536 272.960 258.128 1.00 0.00 C +ATOM 73 CA LEU A 73 252.687 272.183 254.401 1.00 0.00 C +ATOM 74 CA TYR A 74 256.061 271.138 252.974 1.00 0.00 C +ATOM 75 CA GLY A 75 258.048 270.274 249.839 1.00 0.00 C +ATOM 76 CA ASP A 76 261.672 271.430 250.060 1.00 0.00 C +ATOM 77 CA GLN A 77 265.149 272.476 251.213 1.00 0.00 C +ATOM 78 CA HIS A 78 266.125 276.068 252.028 1.00 0.00 C +ATOM 79 CA GLU A 79 269.769 277.162 251.827 1.00 0.00 C +ATOM 80 CA GLU A 80 269.816 280.921 251.208 1.00 0.00 C +ATOM 81 CA LYS A 81 271.339 282.845 248.293 1.00 0.00 C +ATOM 82 CA PRO A 82 275.022 282.165 247.595 1.00 0.00 C +ATOM 83 CA SER A 83 276.635 280.143 250.392 1.00 0.00 C +ATOM 84 CA TRP A 84 277.713 276.524 250.897 1.00 0.00 C +ATOM 85 CA ASN A 85 276.366 273.062 250.051 1.00 0.00 C +ATOM 86 CA MET A 86 274.763 271.012 252.834 1.00 0.00 C +ATOM 87 CA PRO A 87 272.337 268.737 254.692 1.00 0.00 C +ATOM 88 CA PRO A 88 269.562 266.849 256.496 1.00 0.00 C +ATOM 89 CA GLN A 89 268.605 263.180 256.870 1.00 0.00 C +ATOM 90 CA ASP A 90 269.390 260.031 254.873 1.00 0.00 C +ATOM 91 CA PHE A 91 272.263 258.100 253.282 1.00 0.00 C +ATOM 92 CA GLN A 92 274.961 258.427 250.612 1.00 0.00 C +ATOM 93 CA SER A 93 277.200 255.510 249.615 1.00 0.00 C +ATOM 94 CA GLY A 94 276.366 254.688 245.990 1.00 0.00 C +ATOM 95 CA TYR A 95 273.776 255.812 243.431 1.00 0.00 C +ATOM 96 CA SER A 96 273.995 256.832 239.767 1.00 0.00 C +ATOM 97 CA ASP A 97 275.405 259.424 237.357 1.00 0.00 C +ATOM 98 CA ASP A 98 276.120 260.295 233.718 1.00 0.00 C +ATOM 99 CA LYS A 99 279.400 258.574 232.824 1.00 0.00 C +ATOM 100 CA TYR A 100 280.661 255.423 234.556 1.00 0.00 C +ATOM 101 CA GLY A 101 283.735 253.173 234.561 1.00 0.00 C +ATOM 102 CA GLU A 102 285.195 249.994 236.069 1.00 0.00 C +ATOM 103 CA GLU A 103 285.988 248.730 239.575 1.00 0.00 C +ATOM 104 CA SER A 104 286.137 248.716 243.382 1.00 0.00 C +ATOM 105 CA LYS A 105 283.226 248.324 245.809 1.00 0.00 C +ATOM 106 CA PRO A 106 282.984 248.346 249.611 1.00 0.00 C +ATOM 107 CA SER A 107 283.317 245.535 252.161 1.00 0.00 C +ATOM 108 CA TYR A 108 281.568 243.327 254.727 1.00 0.00 C +ATOM 109 CA GLY A 109 277.885 244.300 254.803 1.00 0.00 C +ATOM 110 CA ARG A 110 274.322 243.056 255.322 1.00 0.00 C +ATOM 111 CA ARG A 111 270.682 242.118 254.700 1.00 0.00 C +ATOM 112 CA PRO A 112 267.292 242.776 253.090 1.00 0.00 C +ATOM 113 CA SER A 113 266.093 243.567 249.561 1.00 0.00 C +ATOM 114 CA TYR A 114 268.401 244.279 246.614 1.00 0.00 C +ATOM 115 CA ASP A 115 272.136 244.875 247.071 1.00 0.00 C +ATOM 116 CA GLN A 116 273.480 241.491 248.194 1.00 0.00 C +ATOM 117 CA HIS A 117 274.072 237.735 248.434 1.00 0.00 C +ATOM 118 CA GLU A 118 276.129 235.821 245.861 1.00 0.00 C +ATOM 119 CA GLU A 119 277.745 232.389 246.218 1.00 0.00 C +ATOM 120 CA VAL A 120 277.803 228.909 244.668 1.00 0.00 C +ATOM 121 CA VAL A 121 279.525 226.658 247.214 1.00 0.00 C +ATOM 122 CA GLU A 122 279.361 223.875 249.812 1.00 0.00 C +ATOM 123 CA PRO A 123 277.594 220.663 250.848 1.00 0.00 C +ATOM 124 CA PRO A 124 276.527 220.156 254.470 1.00 0.00 C +ATOM 125 CA ARG A 125 273.725 222.122 256.143 1.00 0.00 C +ATOM 126 CA PHE A 126 272.009 220.116 258.889 1.00 0.00 C +ATOM 127 CA GLY A 127 269.366 217.500 259.720 1.00 0.00 C +ATOM 128 CA ARG A 128 267.432 215.406 262.248 1.00 0.00 C +ATOM 129 CA PRO A 129 268.116 216.944 265.666 1.00 0.00 C +ATOM 130 CA PRO A 130 266.102 219.900 266.978 1.00 0.00 C +ATOM 131 CA SER A 131 263.297 222.337 267.819 1.00 0.00 C +ATOM 132 CA ASN A 132 262.973 225.950 266.654 1.00 0.00 C +ATOM 133 CA TYR A 133 265.504 226.707 263.909 1.00 0.00 C +ATOM 134 CA GLU A 134 266.668 230.306 263.453 1.00 0.00 C +ATOM 135 CA GLN A 135 270.475 230.383 263.588 1.00 0.00 C +ATOM 136 CA GLN A 136 271.515 233.498 261.656 1.00 0.00 C +ATOM 137 CA GLU A 137 269.730 236.863 261.762 1.00 0.00 C +ATOM 138 CA GLU A 138 272.234 239.453 263.003 1.00 0.00 C +ATOM 139 CA GLU A 139 275.836 240.583 263.513 1.00 0.00 C +ATOM 140 CA PRO A 140 279.062 238.979 262.272 1.00 0.00 C +ATOM 141 CA PRO A 141 282.648 237.902 262.976 1.00 0.00 C +ATOM 142 CA ARG A 142 284.314 237.450 259.579 1.00 0.00 C +ATOM 143 CA ILE A 143 283.892 233.881 258.315 1.00 0.00 C +ATOM 144 CA HIS A 144 281.357 231.630 260.054 1.00 0.00 C +ATOM 145 CA ARG A 145 278.009 233.443 259.907 1.00 0.00 C +ATOM 146 CA PRO A 146 275.831 235.277 257.375 1.00 0.00 C +ATOM 147 CA PRO A 147 274.906 234.369 253.792 1.00 0.00 C +ATOM 148 CA SER A 148 274.638 230.747 252.639 1.00 0.00 C +ATOM 149 CA TYR A 149 271.143 229.382 253.301 1.00 0.00 C +ATOM 150 CA TYR A 150 267.989 227.413 254.134 1.00 0.00 C +ATOM 151 CA GLN A 151 265.816 226.799 251.065 1.00 0.00 C +ATOM 152 CA GLN A 152 267.066 224.160 248.618 1.00 0.00 C +ATOM 153 CA GLU A 153 265.749 221.363 246.391 1.00 0.00 C +ATOM 154 CA GLU A 154 262.053 220.454 246.236 1.00 0.00 C +ATOM 155 CA GLU A 155 259.923 223.240 244.746 1.00 0.00 C +ATOM 156 CA PRO A 156 259.320 222.503 241.057 1.00 0.00 C +ATOM 157 CA PRO A 157 256.386 221.177 239.020 1.00 0.00 C +ATOM 158 CA ARG A 158 253.707 219.745 241.320 1.00 0.00 C +ATOM 159 CA PHE A 159 251.345 222.462 242.566 1.00 0.00 C +ATOM 160 CA GLU A 160 247.648 222.928 241.774 1.00 0.00 C +ATOM 161 CA ARG A 161 245.456 225.245 243.858 1.00 0.00 C +ATOM 162 CA PRO A 162 241.837 224.124 243.455 1.00 0.00 C +ATOM 163 CA PRO A 163 239.153 223.574 246.102 1.00 0.00 C +ATOM 164 CA SER A 164 235.775 221.818 246.243 1.00 0.00 C +ATOM 165 CA TYR A 165 232.738 223.687 244.902 1.00 0.00 C +ATOM 166 CA TYR A 166 232.511 226.964 246.832 1.00 0.00 C +ATOM 167 CA GLN A 167 230.026 228.293 249.396 1.00 0.00 C +ATOM 168 CA GLN A 168 226.596 227.586 250.894 1.00 0.00 C +ATOM 169 CA GLU A 169 226.673 226.648 254.586 1.00 0.00 C +ATOM 170 CA GLU A 170 228.658 227.218 257.788 1.00 0.00 C +ATOM 171 CA GLU A 171 228.580 230.519 259.688 1.00 0.00 C +ATOM 172 CA THR A 172 230.249 233.214 261.803 1.00 0.00 C +ATOM 173 CA PRO A 173 232.907 235.198 259.929 1.00 0.00 C +ATOM 174 CA LYS A 174 233.182 238.993 260.109 1.00 0.00 C +ATOM 175 CA PHE A 175 236.167 240.633 261.818 1.00 0.00 C +ATOM 176 CA GLU A 176 237.056 241.682 265.371 1.00 0.00 C +ATOM 177 CA ARG A 177 237.137 241.453 269.173 1.00 0.00 C +ATOM 178 CA PRO A 178 237.172 242.148 272.919 1.00 0.00 C +ATOM 179 CA SER A 179 238.534 245.238 274.684 1.00 0.00 C +ATOM 180 CA TYR A 180 240.341 248.590 274.798 1.00 0.00 C +ATOM 181 CA TYR A 181 240.493 250.521 271.517 1.00 0.00 C +ATOM 182 CA GLN A 182 241.412 250.997 267.851 1.00 0.00 C +ATOM 183 CA PRO A 183 239.176 251.296 264.780 1.00 0.00 C +ATOM 184 CA ASP A 184 240.494 253.587 262.037 1.00 0.00 C +ATOM 185 CA GLN A 185 243.240 252.547 259.609 1.00 0.00 C +ATOM 186 CA GLU A 186 246.470 251.238 261.149 1.00 0.00 C +ATOM 187 CA GLU A 187 249.355 250.673 258.725 1.00 0.00 C +ATOM 188 CA GLY A 188 249.972 251.290 255.016 1.00 0.00 C +ATOM 189 CA ARG A 189 249.066 249.135 252.007 1.00 0.00 C +ATOM 190 CA TYR A 190 248.406 246.717 249.138 1.00 0.00 C +ATOM 191 CA GLN A 191 245.893 245.143 246.745 1.00 0.00 C +ATOM 192 CA ARG A 192 243.403 244.143 244.041 1.00 0.00 C +ATOM 193 CA PRO A 193 241.132 241.106 244.402 1.00 0.00 C +ATOM 194 CA GLN A 194 238.963 238.075 245.194 1.00 0.00 C +ATOM 195 CA TYR A 195 236.831 234.930 245.477 1.00 0.00 C +ATOM 196 CA GLY A 196 233.851 233.092 243.974 1.00 0.00 C +ATOM 197 CA ASN A 197 230.058 233.436 243.874 1.00 0.00 C +ATOM 198 CA ASP A 198 228.686 232.848 240.369 1.00 0.00 C +ATOM 199 CA TYR A 199 230.551 233.122 237.058 1.00 0.00 C +ATOM 200 CA GLU A 200 231.996 230.031 235.363 1.00 0.00 C +ATOM 201 CA GLU A 201 233.445 226.759 234.054 1.00 0.00 C +ATOM 202 CA PRO A 202 233.464 223.005 233.402 1.00 0.00 C +ATOM 203 CA LYS A 203 230.718 221.561 235.613 1.00 0.00 C +ATOM 204 CA HIS A 204 230.513 218.173 237.344 1.00 0.00 C +ATOM 205 CA GLY A 205 232.804 217.906 240.377 1.00 0.00 C +ATOM 206 CA HIS A 206 232.256 214.891 242.640 1.00 0.00 C +ATOM 207 CA HIS A 207 231.415 214.557 246.341 1.00 0.00 C +ATOM 208 CA HIS A 208 232.728 211.480 248.164 1.00 0.00 C +ATOM 209 CA LYS A 209 233.312 210.564 251.816 1.00 0.00 C +ATOM 210 CA GLN A 210 233.612 208.337 254.893 1.00 0.00 C +ATOM 211 CA GLN A 211 235.901 208.144 257.933 1.00 0.00 C +ATOM 212 CA HIS A 212 239.483 207.387 258.984 1.00 0.00 C +ATOM 213 CA HIS A 213 242.658 205.448 258.158 1.00 0.00 C +ATOM 214 CA ARG A 214 246.194 206.433 257.137 1.00 0.00 C +ATOM 215 CA LYS A 215 248.838 203.731 256.667 1.00 0.00 C +ATOM 216 CA TYR A 216 249.022 201.099 259.416 1.00 0.00 C +ATOM 217 CA SER A 217 249.732 199.698 262.887 1.00 0.00 C +ATOM 218 CA ASP A 218 251.581 196.401 262.411 1.00 0.00 C +ATOM 219 CA GLU A 219 254.329 195.995 265.020 1.00 0.00 C +TER 220 GLU A 219 +END diff --git a/Plants/Q9AWS3/Q9AWS3.dcd b/Plants/Q9AWS3/Q9AWS3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..439e36b0ae645df103f53a6fdc769b1292ccc3b7 --- /dev/null +++ b/Plants/Q9AWS3/Q9AWS3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5b49271b468d2e8be2d0b0d1a89683c13dbf153087b8a02803d7da9e63d559c8 +size 8840276 diff --git a/Plants/Q9AWS3/top.pdb b/Plants/Q9AWS3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..d1f684638834ff47b0335843e4542c68686a45b2 --- /dev/null +++ b/Plants/Q9AWS3/top.pdb @@ -0,0 +1,71 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 255.507 287.413 238.900 1.00 0.00 C +ATOM 2 CA LYS A 2 255.324 287.690 235.105 1.00 0.00 C +ATOM 3 CA MET A 3 257.861 289.447 232.870 1.00 0.00 C +ATOM 4 CA LYS A 4 260.386 292.135 233.823 1.00 0.00 C +ATOM 5 CA LYS A 5 263.179 292.509 236.389 1.00 0.00 C +ATOM 6 CA ILE A 6 262.974 290.069 239.308 1.00 0.00 C +ATOM 7 CA LEU A 7 261.780 286.460 239.571 1.00 0.00 C +ATOM 8 CA ASP A 8 260.873 283.287 241.475 1.00 0.00 C +ATOM 9 CA ASP A 9 263.305 280.460 242.252 1.00 0.00 C +ATOM 10 CA ASP A 10 265.543 277.459 241.546 1.00 0.00 C +ATOM 11 CA LYS A 11 263.645 275.201 239.133 1.00 0.00 C +ATOM 12 CA ARG A 12 263.220 275.507 235.359 1.00 0.00 C +ATOM 13 CA ASN A 13 265.679 275.016 232.490 1.00 0.00 C +ATOM 14 CA ARG A 14 266.201 271.492 231.138 1.00 0.00 C +ATOM 15 CA HIS A 15 264.798 268.025 231.865 1.00 0.00 C +ATOM 16 CA ASP A 16 266.752 265.281 230.086 1.00 0.00 C +ATOM 17 CA GLU A 17 267.300 261.526 229.741 1.00 0.00 C +ATOM 18 CA ASP A 18 270.180 259.901 227.848 1.00 0.00 C +ATOM 19 CA ASP A 19 271.719 257.329 230.199 1.00 0.00 C +ATOM 20 CA ASP A 20 274.270 254.899 231.651 1.00 0.00 C +ATOM 21 CA VAL A 21 277.583 253.019 231.648 1.00 0.00 C +ATOM 22 CA GLY A 22 279.011 251.019 234.560 1.00 0.00 C +ATOM 23 CA ASP A 23 279.119 247.442 235.869 1.00 0.00 C +ATOM 24 CA PRO A 24 276.422 245.085 237.167 1.00 0.00 C +ATOM 25 CA ALA A 25 273.325 242.934 237.713 1.00 0.00 C +ATOM 26 CA ASN A 26 271.836 241.494 240.910 1.00 0.00 C +ATOM 27 CA SER A 27 268.132 240.779 240.370 1.00 0.00 C +ATOM 28 CA SER A 28 264.573 239.867 241.378 1.00 0.00 C +ATOM 29 CA VAL A 29 261.246 238.594 242.731 1.00 0.00 C +ATOM 30 CA ALA A 30 260.666 237.933 246.438 1.00 0.00 C +ATOM 31 CA THR A 31 258.644 234.954 247.686 1.00 0.00 C +ATOM 32 CA ASN A 32 255.518 233.318 249.124 1.00 0.00 C +ATOM 33 CA ASP A 33 251.934 233.938 247.990 1.00 0.00 C +ATOM 34 CA ASN A 34 248.160 233.595 247.603 1.00 0.00 C +ATOM 35 CA ASP A 35 246.663 232.353 250.879 1.00 0.00 C +ATOM 36 CA LYS A 36 245.130 233.965 253.973 1.00 0.00 C +ATOM 37 CA ASP A 37 241.562 235.259 254.300 1.00 0.00 C +ATOM 38 CA ALA A 38 241.188 238.819 255.605 1.00 0.00 C +ATOM 39 CA HIS A 39 240.568 241.881 253.423 1.00 0.00 C +ATOM 40 CA GLN A 40 239.973 245.345 251.952 1.00 0.00 C +ATOM 41 CA HIS A 41 236.273 245.578 251.071 1.00 0.00 C +ATOM 42 CA LEU A 42 232.866 243.872 251.060 1.00 0.00 C +ATOM 43 CA HIS A 43 231.969 242.167 247.773 1.00 0.00 C +ATOM 44 CA ASN A 44 228.976 240.576 246.034 1.00 0.00 C +ATOM 45 CA ALA A 45 227.191 237.623 247.649 1.00 0.00 C +ATOM 46 CA SER A 46 227.386 237.071 251.414 1.00 0.00 C +ATOM 47 CA LEU A 47 224.815 234.432 252.384 1.00 0.00 C +ATOM 48 CA GLY A 48 223.957 231.489 254.646 1.00 0.00 C +ATOM 49 CA GLY A 49 226.436 229.117 256.303 1.00 0.00 C +ATOM 50 CA GLU A 50 229.974 230.483 256.671 1.00 0.00 C +ATOM 51 CA LEU A 51 233.592 231.634 256.351 1.00 0.00 C +ATOM 52 CA MET A 52 236.208 233.366 258.513 1.00 0.00 C +ATOM 53 CA LEU A 53 236.684 233.954 262.247 1.00 0.00 C +ATOM 54 CA LEU A 54 236.482 234.331 266.033 1.00 0.00 C +ATOM 55 CA PRO A 55 237.293 235.773 269.465 1.00 0.00 C +ATOM 56 CA ASN A 56 238.089 235.115 273.133 1.00 0.00 C +ATOM 57 CA SER A 57 236.800 232.443 275.523 1.00 0.00 C +ATOM 58 CA SER A 58 234.678 231.389 278.506 1.00 0.00 C +ATOM 59 CA LYS A 59 235.012 234.092 281.170 1.00 0.00 C +ATOM 60 CA PRO A 60 235.083 237.090 283.521 1.00 0.00 C +ATOM 61 CA LYS A 61 235.169 240.848 284.137 1.00 0.00 C +ATOM 62 CA TYR A 62 234.104 243.588 281.713 1.00 0.00 C +ATOM 63 CA LEU A 63 231.874 243.904 278.641 1.00 0.00 C +ATOM 64 CA LYS A 64 234.159 245.131 275.850 1.00 0.00 C +ATOM 65 CA LEU A 65 234.209 242.834 272.810 1.00 0.00 C +ATOM 66 CA LEU A 66 234.544 244.789 269.557 1.00 0.00 C +ATOM 67 CA LYS A 67 234.427 244.611 265.753 1.00 0.00 C +TER 68 LYS A 67 +END diff --git a/Plants/Q9AXJ5/Q9AXJ5.dcd b/Plants/Q9AXJ5/Q9AXJ5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..9a5f6f25afca03f925db938c7254b3998220cb7a --- /dev/null +++ b/Plants/Q9AXJ5/Q9AXJ5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:3ce46f51812910ef15fe7d5179859070a5bfb00ac24e025a7d80a93ae3eb04ff +size 5600276 diff --git a/Plants/Q9AXJ5/top.pdb b/Plants/Q9AXJ5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..310229b86a71429ce83e6764e7d697c065c6f2a0 --- /dev/null +++ b/Plants/Q9AXJ5/top.pdb @@ -0,0 +1,44 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 268.364 217.225 265.433 1.00 0.00 C +ATOM 2 CA ALA A 2 269.808 218.187 262.041 1.00 0.00 C +ATOM 3 CA SER A 3 268.443 221.501 260.747 1.00 0.00 C +ATOM 4 CA PRO A 4 267.109 224.836 262.017 1.00 0.00 C +ATOM 5 CA ASN A 5 265.042 227.124 259.778 1.00 0.00 C +ATOM 6 CA ARG A 6 263.999 230.788 259.792 1.00 0.00 C +ATOM 7 CA THR A 7 265.251 233.552 262.097 1.00 0.00 C +ATOM 8 CA ARG A 8 264.571 237.287 262.415 1.00 0.00 C +ATOM 9 CA GLY A 9 264.531 241.089 262.664 1.00 0.00 C +ATOM 10 CA GLU A 10 263.828 244.807 263.103 1.00 0.00 C +ATOM 11 CA ALA A 11 262.309 246.311 259.950 1.00 0.00 C +ATOM 12 CA ASN A 12 264.135 248.597 257.509 1.00 0.00 C +ATOM 13 CA ALA A 13 264.212 248.659 253.700 1.00 0.00 C +ATOM 14 CA SER A 14 262.626 251.738 252.113 1.00 0.00 C +ATOM 15 CA SER A 15 259.574 252.783 250.087 1.00 0.00 C +ATOM 16 CA SER A 16 257.309 254.129 247.334 1.00 0.00 C +ATOM 17 CA ILE A 17 257.254 255.049 243.638 1.00 0.00 C +ATOM 18 CA SER A 18 254.680 255.804 240.932 1.00 0.00 C +ATOM 19 CA HIS A 19 252.113 258.544 240.288 1.00 0.00 C +ATOM 20 CA HIS A 20 251.263 261.767 242.133 1.00 0.00 C +ATOM 21 CA GLN A 21 248.927 261.970 245.136 1.00 0.00 C +ATOM 22 CA LEU A 22 248.463 264.404 248.030 1.00 0.00 C +ATOM 23 CA HIS A 23 246.147 263.584 250.942 1.00 0.00 C +ATOM 24 CA GLN A 24 242.782 265.258 251.566 1.00 0.00 C +ATOM 25 CA GLN A 25 240.230 267.999 250.864 1.00 0.00 C +ATOM 26 CA ASP A 26 240.272 269.174 247.240 1.00 0.00 C +ATOM 27 CA ASN A 27 236.964 269.440 245.369 1.00 0.00 C +ATOM 28 CA ASN A 28 237.051 266.828 242.597 1.00 0.00 C +ATOM 29 CA ARG A 29 236.905 265.884 238.908 1.00 0.00 C +ATOM 30 CA ASN A 30 237.158 262.186 238.025 1.00 0.00 C +ATOM 31 CA ASN A 31 235.536 258.917 239.120 1.00 0.00 C +ATOM 32 CA SER A 32 238.400 256.671 240.244 1.00 0.00 C +ATOM 33 CA ASN A 33 238.574 254.740 243.524 1.00 0.00 C +ATOM 34 CA ASN A 34 239.624 251.081 243.684 1.00 0.00 C +ATOM 35 CA ASN A 35 237.547 249.644 246.536 1.00 0.00 C +ATOM 36 CA ASN A 36 234.056 249.384 248.041 1.00 0.00 C +ATOM 37 CA ASN A 37 232.117 246.642 246.242 1.00 0.00 C +ATOM 38 CA ARG A 38 229.396 246.240 243.605 1.00 0.00 C +ATOM 39 CA ASN A 39 228.232 248.941 241.182 1.00 0.00 C +ATOM 40 CA ILE A 40 225.198 251.237 241.374 1.00 0.00 C +TER 41 ILE A 40 +END diff --git a/Plants/Q9AYB9/Q9AYB9.dcd b/Plants/Q9AYB9/Q9AYB9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..6b7c63f3e2415852ddc2547176478d9a6b6c93e4 --- /dev/null +++ b/Plants/Q9AYB9/Q9AYB9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:36ee7804ffc178d977a412bc715653f62ad1effeedf9fc17c4f845c86828812b +size 16280276 diff --git a/Plants/Q9AYB9/top.pdb b/Plants/Q9AYB9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..cb553b844881fc378cf69e96d725a51c40fd5aa0 --- /dev/null +++ b/Plants/Q9AYB9/top.pdb @@ -0,0 +1,133 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 222.132 223.556 255.842 1.00 0.00 C +ATOM 2 CA ALA A 2 221.041 224.347 259.406 1.00 0.00 C +ATOM 3 CA ALA A 3 220.270 228.015 260.090 1.00 0.00 C +ATOM 4 CA ALA A 4 220.136 231.556 261.489 1.00 0.00 C +ATOM 5 CA GLY A 5 222.368 234.312 260.095 1.00 0.00 C +ATOM 6 CA ARG A 6 221.868 234.964 256.375 1.00 0.00 C +ATOM 7 CA ALA A 7 220.086 234.920 253.007 1.00 0.00 C +ATOM 8 CA ARG A 8 218.552 238.268 252.031 1.00 0.00 C +ATOM 9 CA ARG A 9 220.299 241.605 252.606 1.00 0.00 C +ATOM 10 CA ARG A 10 223.989 242.500 252.294 1.00 0.00 C +ATOM 11 CA PRO A 11 226.241 245.188 253.784 1.00 0.00 C +ATOM 12 CA ARG A 12 227.987 245.195 257.170 1.00 0.00 C +ATOM 13 CA ARG A 13 230.284 243.548 259.725 1.00 0.00 C +ATOM 14 CA HIS A 14 230.912 242.447 263.318 1.00 0.00 C +ATOM 15 CA GLY A 15 232.282 238.926 263.811 1.00 0.00 C +ATOM 16 CA ARG A 16 229.522 236.305 263.633 1.00 0.00 C +ATOM 17 CA ARG A 17 226.310 238.239 262.959 1.00 0.00 C +ATOM 18 CA GLU A 18 223.891 240.442 261.006 1.00 0.00 C +ATOM 19 CA ALA A 19 221.733 243.563 260.665 1.00 0.00 C +ATOM 20 CA ALA A 20 218.058 242.717 260.123 1.00 0.00 C +ATOM 21 CA ARG A 21 214.274 242.558 259.708 1.00 0.00 C +ATOM 22 CA PRO A 22 211.942 245.558 259.428 1.00 0.00 C +ATOM 23 CA ARG A 23 208.412 244.176 259.803 1.00 0.00 C +ATOM 24 CA PRO A 24 206.058 241.636 261.392 1.00 0.00 C +ATOM 25 CA ASP A 25 204.129 240.655 264.527 1.00 0.00 C +ATOM 26 CA GLY A 26 202.871 241.536 268.014 1.00 0.00 C +ATOM 27 CA ARG A 27 199.728 243.180 269.404 1.00 0.00 C +ATOM 28 CA ARG A 28 197.466 245.867 267.927 1.00 0.00 C +ATOM 29 CA ARG A 29 195.780 246.559 264.581 1.00 0.00 C +ATOM 30 CA SER A 30 198.371 248.425 262.503 1.00 0.00 C +ATOM 31 CA THR A 31 200.803 250.522 264.553 1.00 0.00 C +ATOM 32 CA ALA A 32 203.006 251.067 267.614 1.00 0.00 C +ATOM 33 CA THR A 33 206.616 250.825 266.421 1.00 0.00 C +ATOM 34 CA THR A 34 208.995 251.977 269.165 1.00 0.00 C +ATOM 35 CA GLY A 35 210.154 255.505 270.014 1.00 0.00 C +ATOM 36 CA THR A 36 209.351 258.881 268.442 1.00 0.00 C +ATOM 37 CA ALA A 37 210.337 261.682 266.054 1.00 0.00 C +ATOM 38 CA THR A 38 211.345 265.199 264.993 1.00 0.00 C +ATOM 39 CA GLU A 39 211.383 268.003 262.413 1.00 0.00 C +ATOM 40 CA ALA A 40 212.337 267.293 258.794 1.00 0.00 C +ATOM 41 CA GLU A 41 211.810 265.435 255.509 1.00 0.00 C +ATOM 42 CA ARG A 42 211.187 262.727 252.902 1.00 0.00 C +ATOM 43 CA GLY A 43 210.432 264.002 249.392 1.00 0.00 C +ATOM 44 CA SER A 44 212.848 264.457 246.481 1.00 0.00 C +ATOM 45 CA GLY A 45 214.553 261.446 244.886 1.00 0.00 C +ATOM 46 CA ALA A 46 217.559 259.219 244.163 1.00 0.00 C +ATOM 47 CA ALA A 47 216.340 255.646 244.676 1.00 0.00 C +ATOM 48 CA ARG A 48 216.404 251.839 244.814 1.00 0.00 C +ATOM 49 CA VAL A 49 219.724 250.077 245.436 1.00 0.00 C +ATOM 50 CA ASP A 50 223.223 249.002 246.493 1.00 0.00 C +ATOM 51 CA GLU A 51 226.549 248.024 244.913 1.00 0.00 C +ATOM 52 CA ASP A 52 229.851 249.353 243.555 1.00 0.00 C +ATOM 53 CA GLY A 53 232.997 248.004 241.881 1.00 0.00 C +ATOM 54 CA GLY A 54 236.103 249.062 239.945 1.00 0.00 C +ATOM 55 CA VAL A 55 239.388 248.387 238.137 1.00 0.00 C +ATOM 56 CA PRO A 56 240.170 246.206 235.112 1.00 0.00 C +ATOM 57 CA ALA A 57 243.614 246.590 233.528 1.00 0.00 C +ATOM 58 CA VAL A 58 245.662 247.547 230.461 1.00 0.00 C +ATOM 59 CA GLY A 59 246.769 251.124 229.755 1.00 0.00 C +ATOM 60 CA GLY A 60 250.422 250.841 228.708 1.00 0.00 C +ATOM 61 CA ARG A 61 252.558 250.330 231.821 1.00 0.00 C +ATOM 62 CA ASN A 62 255.641 248.172 232.416 1.00 0.00 C +ATOM 63 CA GLU A 63 256.837 246.065 235.356 1.00 0.00 C +ATOM 64 CA GLY A 64 256.573 248.145 238.537 1.00 0.00 C +ATOM 65 CA VAL A 65 256.493 249.800 241.968 1.00 0.00 C +ATOM 66 CA ASP A 66 256.316 249.900 245.772 1.00 0.00 C +ATOM 67 CA GLU A 67 256.915 246.962 248.123 1.00 0.00 C +ATOM 68 CA VAL A 68 256.664 246.856 251.923 1.00 0.00 C +ATOM 69 CA ASP A 69 254.626 249.359 253.947 1.00 0.00 C +ATOM 70 CA GLU A 70 251.681 251.309 255.375 1.00 0.00 C +ATOM 71 CA ASP A 71 250.086 253.979 253.175 1.00 0.00 C +ATOM 72 CA ALA A 72 248.360 254.893 249.903 1.00 0.00 C +ATOM 73 CA VAL A 73 246.637 252.997 247.083 1.00 0.00 C +ATOM 74 CA LYS A 74 246.887 249.212 246.723 1.00 0.00 C +ATOM 75 CA PRO A 75 249.060 248.208 243.758 1.00 0.00 C +ATOM 76 CA LYS A 76 248.766 251.060 241.249 1.00 0.00 C +ATOM 77 CA GLU A 77 251.143 251.765 238.356 1.00 0.00 C +ATOM 78 CA ALA A 78 254.319 253.736 237.623 1.00 0.00 C +ATOM 79 CA MET A 79 254.285 257.535 237.917 1.00 0.00 C +ATOM 80 CA PRO A 80 255.358 260.817 236.308 1.00 0.00 C +ATOM 81 CA LYS A 81 259.163 260.696 236.157 1.00 0.00 C +ATOM 82 CA ARG A 82 260.300 262.572 239.272 1.00 0.00 C +ATOM 83 CA GLU A 83 260.209 264.090 242.765 1.00 0.00 C +ATOM 84 CA GLU A 84 259.535 265.824 246.090 1.00 0.00 C +ATOM 85 CA VAL A 85 261.207 268.520 248.200 1.00 0.00 C +ATOM 86 CA ARG A 86 263.357 269.091 251.293 1.00 0.00 C +ATOM 87 CA GLY A 87 264.603 267.661 254.598 1.00 0.00 C +ATOM 88 CA ASP A 88 263.994 269.094 258.075 1.00 0.00 C +ATOM 89 CA ASP A 89 262.109 267.745 261.098 1.00 0.00 C +ATOM 90 CA GLY A 90 263.676 265.844 264.004 1.00 0.00 C +ATOM 91 CA GLY A 91 265.398 266.099 267.393 1.00 0.00 C +ATOM 92 CA GLU A 92 268.627 268.005 266.718 1.00 0.00 C +ATOM 93 CA PRO A 93 270.368 271.371 266.322 1.00 0.00 C +ATOM 94 CA LYS A 94 272.588 271.923 263.275 1.00 0.00 C +ATOM 95 CA LEU A 95 272.811 269.119 260.706 1.00 0.00 C +ATOM 96 CA GLY A 96 274.731 268.489 257.476 1.00 0.00 C +ATOM 97 CA GLY A 97 276.056 265.046 256.522 1.00 0.00 C +ATOM 98 CA ASP A 98 277.768 262.439 254.334 1.00 0.00 C +ATOM 99 CA GLY A 99 281.278 262.796 252.895 1.00 0.00 C +ATOM 100 CA GLY A 100 283.961 260.642 254.531 1.00 0.00 C +ATOM 101 CA GLU A 101 283.737 257.017 253.378 1.00 0.00 C +ATOM 102 CA ARG A 102 283.457 255.535 249.879 1.00 0.00 C +ATOM 103 CA GLY A 103 280.569 256.535 247.604 1.00 0.00 C +ATOM 104 CA ARG A 104 278.778 254.594 244.858 1.00 0.00 C +ATOM 105 CA ARG A 105 276.505 251.980 246.444 1.00 0.00 C +ATOM 106 CA ARG A 106 278.247 249.076 248.189 1.00 0.00 C +ATOM 107 CA GLU A 107 281.845 248.604 247.026 1.00 0.00 C +ATOM 108 CA LEU A 108 284.967 247.588 248.959 1.00 0.00 C +ATOM 109 CA ASP A 109 288.434 249.019 249.629 1.00 0.00 C +ATOM 110 CA SER A 110 290.456 249.466 252.827 1.00 0.00 C +ATOM 111 CA ASP A 111 293.629 247.588 253.788 1.00 0.00 C +ATOM 112 CA GLY A 112 296.120 246.271 251.224 1.00 0.00 C +ATOM 113 CA GLU A 113 297.446 244.181 248.327 1.00 0.00 C +ATOM 114 CA ARG A 114 299.484 244.331 245.111 1.00 0.00 C +ATOM 115 CA LYS A 115 300.251 241.117 243.214 1.00 0.00 C +ATOM 116 CA ARG A 116 298.136 240.642 240.080 1.00 0.00 C +ATOM 117 CA GLN A 117 299.989 238.100 237.931 1.00 0.00 C +ATOM 118 CA GLY A 118 303.758 237.825 237.444 1.00 0.00 C +ATOM 119 CA SER A 119 307.117 236.027 237.377 1.00 0.00 C +ATOM 120 CA GLU A 120 310.221 236.409 235.201 1.00 0.00 C +ATOM 121 CA THR A 121 313.660 237.591 236.337 1.00 0.00 C +ATOM 122 CA GLU A 122 316.664 239.544 235.041 1.00 0.00 C +ATOM 123 CA GLU A 123 318.482 242.089 232.865 1.00 0.00 C +ATOM 124 CA GLY A 124 317.183 242.234 229.286 1.00 0.00 C +ATOM 125 CA GLY A 125 318.744 239.653 226.960 1.00 0.00 C +ATOM 126 CA THR A 126 316.824 237.153 224.819 1.00 0.00 C +ATOM 127 CA GLY A 127 315.750 233.952 223.054 1.00 0.00 C +ATOM 128 CA SER A 128 316.177 230.169 223.216 1.00 0.00 C +ATOM 129 CA ALA A 129 315.507 226.840 224.944 1.00 0.00 C +TER 130 ALA A 129 +END diff --git a/Plants/Q9AYG8/Q9AYG8.dcd b/Plants/Q9AYG8/Q9AYG8.dcd new file mode 100644 index 0000000000000000000000000000000000000000..b301cf2f43d9c8f56efe1383101d9edd70ff34a0 --- /dev/null +++ b/Plants/Q9AYG8/Q9AYG8.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:34d2abad57683828456e6cc69d4ce39a1f81a3c58b7586d122e1a8ac50b5b7e4 +size 43140276 diff --git a/Plants/Q9AYG8/top.pdb b/Plants/Q9AYG8/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..8f6e728746d3107a5e22a88cca05093250ca53d5 --- /dev/null +++ b/Plants/Q9AYG8/top.pdb @@ -0,0 +1,237 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 274.543 209.335 244.357 1.00 0.00 C +ATOM 2 CA LYS A 2 271.747 207.022 245.518 1.00 0.00 C +ATOM 3 CA SER A 3 270.662 205.388 248.784 1.00 0.00 C +ATOM 4 CA CYS A 4 271.472 204.015 252.245 1.00 0.00 C +ATOM 5 CA CYS A 5 275.003 204.743 253.477 1.00 0.00 C +ATOM 6 CA ARG A 6 276.663 206.547 256.394 1.00 0.00 C +ATOM 7 CA ARG A 7 276.892 210.331 256.016 1.00 0.00 C +ATOM 8 CA SER A 8 276.292 213.903 257.199 1.00 0.00 C +ATOM 9 CA ASN A 9 273.689 215.964 255.329 1.00 0.00 C +ATOM 10 CA ARG A 10 273.300 219.750 255.512 1.00 0.00 C +ATOM 11 CA LEU A 11 275.259 222.912 256.337 1.00 0.00 C +ATOM 12 CA PRO A 12 273.913 225.860 258.340 1.00 0.00 C +ATOM 13 CA ALA A 13 273.726 229.638 258.795 1.00 0.00 C +ATOM 14 CA ALA A 14 272.805 230.836 262.292 1.00 0.00 C +ATOM 15 CA GLY A 15 272.369 233.202 265.247 1.00 0.00 C +ATOM 16 CA GLN A 16 272.325 236.936 264.491 1.00 0.00 C +ATOM 17 CA THR A 17 270.637 239.471 266.781 1.00 0.00 C +ATOM 18 CA ALA A 18 269.708 240.629 270.290 1.00 0.00 C +ATOM 19 CA ASN A 19 267.745 237.887 272.062 1.00 0.00 C +ATOM 20 CA ALA A 20 268.727 234.671 270.271 1.00 0.00 C +ATOM 21 CA SER A 21 268.574 230.923 269.605 1.00 0.00 C +ATOM 22 CA PRO A 22 265.182 229.631 268.445 1.00 0.00 C +ATOM 23 CA ALA A 23 264.588 227.642 265.250 1.00 0.00 C +ATOM 24 CA ILE A 24 261.159 227.853 263.603 1.00 0.00 C +ATOM 25 CA LEU A 25 259.034 231.015 263.639 1.00 0.00 C +ATOM 26 CA ASP A 26 258.905 234.272 261.668 1.00 0.00 C +ATOM 27 CA GLY A 27 255.957 234.078 259.261 1.00 0.00 C +ATOM 28 CA SER A 28 252.768 233.717 257.209 1.00 0.00 C +ATOM 29 CA ASP A 29 249.508 234.208 259.119 1.00 0.00 C +ATOM 30 CA LYS A 30 245.835 235.215 259.218 1.00 0.00 C +ATOM 31 CA THR A 31 244.554 236.969 262.349 1.00 0.00 C +ATOM 32 CA ASN A 32 244.212 240.364 264.043 1.00 0.00 C +ATOM 33 CA LEU A 33 245.472 243.755 265.238 1.00 0.00 C +ATOM 34 CA SER A 34 246.555 245.536 262.048 1.00 0.00 C +ATOM 35 CA GLU A 35 245.687 245.463 258.339 1.00 0.00 C +ATOM 36 CA THR A 36 247.624 247.888 256.129 1.00 0.00 C +ATOM 37 CA ALA A 37 246.270 251.176 254.760 1.00 0.00 C +ATOM 38 CA PRO A 38 242.470 251.032 254.525 1.00 0.00 C +ATOM 39 CA THR A 39 241.408 248.237 252.164 1.00 0.00 C +ATOM 40 CA GLU A 40 241.739 244.642 250.946 1.00 0.00 C +ATOM 41 CA LYS A 41 243.215 242.040 248.587 1.00 0.00 C +ATOM 42 CA ASN A 42 242.117 238.433 249.133 1.00 0.00 C +ATOM 43 CA PHE A 43 240.264 236.553 246.386 1.00 0.00 C +ATOM 44 CA ASN A 44 239.910 237.037 242.624 1.00 0.00 C +ATOM 45 CA SER A 45 241.675 236.967 239.248 1.00 0.00 C +ATOM 46 CA ALA A 46 245.166 238.482 239.060 1.00 0.00 C +ATOM 47 CA GLY A 47 247.825 237.060 236.731 1.00 0.00 C +ATOM 48 CA GLN A 48 251.025 239.121 236.902 1.00 0.00 C +ATOM 49 CA PRO A 49 254.103 238.567 239.079 1.00 0.00 C +ATOM 50 CA ASP A 50 257.606 237.208 239.707 1.00 0.00 C +ATOM 51 CA THR A 51 257.642 236.349 243.418 1.00 0.00 C +ATOM 52 CA PRO A 52 254.203 235.380 244.742 1.00 0.00 C +ATOM 53 CA ALA A 53 252.211 237.993 246.670 1.00 0.00 C +ATOM 54 CA ASP A 54 251.281 236.474 250.038 1.00 0.00 C +ATOM 55 CA PRO A 55 247.744 235.402 250.962 1.00 0.00 C +ATOM 56 CA THR A 56 245.927 232.107 251.565 1.00 0.00 C +ATOM 57 CA PRO A 57 245.427 228.574 252.900 1.00 0.00 C +ATOM 58 CA SER A 58 247.217 225.284 252.201 1.00 0.00 C +ATOM 59 CA ARG A 59 247.548 222.261 249.905 1.00 0.00 C +ATOM 60 CA PRO A 60 250.150 220.095 248.158 1.00 0.00 C +ATOM 61 CA PRO A 61 253.159 219.511 245.895 1.00 0.00 C +ATOM 62 CA SER A 62 254.071 218.051 242.496 1.00 0.00 C +ATOM 63 CA PRO A 63 253.975 216.027 239.269 1.00 0.00 C +ATOM 64 CA PRO A 64 255.590 212.671 238.463 1.00 0.00 C +ATOM 65 CA VAL A 65 259.295 212.745 237.579 1.00 0.00 C +ATOM 66 CA PRO A 66 260.854 210.165 235.250 1.00 0.00 C +ATOM 67 CA ARG A 67 261.330 208.215 232.011 1.00 0.00 C +ATOM 68 CA LYS A 68 264.352 206.166 230.923 1.00 0.00 C +ATOM 69 CA GLY A 69 267.682 206.046 229.075 1.00 0.00 C +ATOM 70 CA SER A 70 268.758 209.603 228.233 1.00 0.00 C +ATOM 71 CA SER A 71 268.184 211.707 231.358 1.00 0.00 C +ATOM 72 CA TYR A 72 270.977 213.425 233.296 1.00 0.00 C +ATOM 73 CA THR A 73 271.168 212.607 237.012 1.00 0.00 C +ATOM 74 CA SER A 74 268.282 210.910 238.830 1.00 0.00 C +ATOM 75 CA ASP A 75 268.419 212.275 242.385 1.00 0.00 C +ATOM 76 CA GLN A 76 269.843 215.798 242.662 1.00 0.00 C +ATOM 77 CA ALA A 77 271.513 217.994 240.034 1.00 0.00 C +ATOM 78 CA VAL A 78 269.112 220.281 238.157 1.00 0.00 C +ATOM 79 CA THR A 79 265.508 219.627 239.206 1.00 0.00 C +ATOM 80 CA HIS A 80 262.993 222.489 239.225 1.00 0.00 C +ATOM 81 CA SER A 81 262.256 225.827 237.543 1.00 0.00 C +ATOM 82 CA ARG A 82 261.408 229.539 237.386 1.00 0.00 C +ATOM 83 CA LEU A 83 264.294 231.736 238.552 1.00 0.00 C +ATOM 84 CA TRP A 84 266.971 233.230 240.814 1.00 0.00 C +ATOM 85 CA GLY A 85 269.071 231.535 243.504 1.00 0.00 C +ATOM 86 CA ALA A 86 268.869 230.178 247.059 1.00 0.00 C +ATOM 87 CA VAL A 87 270.779 228.120 249.634 1.00 0.00 C +ATOM 88 CA PRO A 88 271.477 224.375 249.580 1.00 0.00 C +ATOM 89 CA THR A 89 274.321 222.099 248.464 1.00 0.00 C +ATOM 90 CA GLY A 90 275.611 222.211 244.881 1.00 0.00 C +ATOM 91 CA GLY A 91 278.365 220.591 242.805 1.00 0.00 C +ATOM 92 CA ALA A 92 281.200 219.973 245.275 1.00 0.00 C +ATOM 93 CA HIS A 93 283.801 218.591 247.692 1.00 0.00 C +ATOM 94 CA GLY A 94 287.541 217.959 247.339 1.00 0.00 C +ATOM 95 CA SER A 95 289.435 220.607 249.317 1.00 0.00 C +ATOM 96 CA ALA A 96 292.738 222.075 250.520 1.00 0.00 C +ATOM 97 CA ALA A 97 295.369 223.625 252.799 1.00 0.00 C +ATOM 98 CA GLN A 98 298.290 226.036 253.210 1.00 0.00 C +ATOM 99 CA GLY A 99 299.736 227.695 250.100 1.00 0.00 C +ATOM 100 CA GLY A 100 299.744 226.736 246.413 1.00 0.00 C +ATOM 101 CA ARG A 101 299.918 228.891 243.275 1.00 0.00 C +ATOM 102 CA SER A 102 300.744 231.288 240.432 1.00 0.00 C +ATOM 103 CA THR A 103 303.675 233.664 240.964 1.00 0.00 C +ATOM 104 CA VAL A 104 302.712 236.271 243.570 1.00 0.00 C +ATOM 105 CA ASP A 105 299.663 238.427 244.327 1.00 0.00 C +ATOM 106 CA ARG A 106 298.245 241.855 243.456 1.00 0.00 C +ATOM 107 CA ASP A 107 299.745 244.992 241.899 1.00 0.00 C +ATOM 108 CA HIS A 108 302.339 247.504 243.113 1.00 0.00 C +ATOM 109 CA ALA A 109 304.834 249.132 240.738 1.00 0.00 C +ATOM 110 CA GLY A 110 304.857 246.826 237.705 1.00 0.00 C +ATOM 111 CA GLY A 111 305.041 246.920 233.900 1.00 0.00 C +ATOM 112 CA PRO A 112 307.557 244.810 231.969 1.00 0.00 C +ATOM 113 CA PRO A 113 310.847 246.409 230.903 1.00 0.00 C +ATOM 114 CA PRO A 114 310.463 249.362 228.527 1.00 0.00 C +ATOM 115 CA VAL A 115 308.252 252.437 228.108 1.00 0.00 C +ATOM 116 CA HIS A 116 305.910 253.517 230.912 1.00 0.00 C +ATOM 117 CA GLY A 117 304.118 255.385 233.708 1.00 0.00 C +ATOM 118 CA THR A 118 304.138 257.663 236.761 1.00 0.00 C +ATOM 119 CA ASP A 119 303.230 261.331 236.269 1.00 0.00 C +ATOM 120 CA GLY A 120 300.499 262.781 238.495 1.00 0.00 C +ATOM 121 CA PRO A 121 298.288 264.861 236.193 1.00 0.00 C +ATOM 122 CA ASP A 122 298.466 268.559 237.092 1.00 0.00 C +ATOM 123 CA ARG A 123 297.524 270.944 234.274 1.00 0.00 C +ATOM 124 CA PRO A 124 296.751 269.139 231.009 1.00 0.00 C +ATOM 125 CA GLY A 125 293.088 268.720 230.046 1.00 0.00 C +ATOM 126 CA GLY A 126 290.278 271.154 230.879 1.00 0.00 C +ATOM 127 CA ARG A 127 287.024 269.757 232.285 1.00 0.00 C +ATOM 128 CA SER A 128 283.744 268.848 230.573 1.00 0.00 C +ATOM 129 CA ASP A 129 282.104 270.870 227.792 1.00 0.00 C +ATOM 130 CA GLY A 130 284.648 273.173 226.136 1.00 0.00 C +ATOM 131 CA THR A 131 283.832 276.888 225.909 1.00 0.00 C +ATOM 132 CA ALA A 132 283.953 279.686 228.492 1.00 0.00 C +ATOM 133 CA VAL A 133 282.308 282.757 226.950 1.00 0.00 C +ATOM 134 CA ALA A 134 280.563 286.016 226.028 1.00 0.00 C +ATOM 135 CA ARG A 135 278.507 287.312 228.963 1.00 0.00 C +ATOM 136 CA HIS A 136 277.618 289.030 232.245 1.00 0.00 C +ATOM 137 CA GLY A 137 276.251 292.530 231.616 1.00 0.00 C +ATOM 138 CA SER A 138 273.851 293.975 234.199 1.00 0.00 C +ATOM 139 CA ALA A 139 270.266 293.460 233.015 1.00 0.00 C +ATOM 140 CA ARG A 140 267.244 291.416 231.918 1.00 0.00 C +ATOM 141 CA LEU A 141 263.954 289.845 230.812 1.00 0.00 C +ATOM 142 CA GLN A 142 260.686 290.964 232.420 1.00 0.00 C +ATOM 143 CA ASN A 143 257.656 293.203 232.985 1.00 0.00 C +ATOM 144 CA ARG A 144 254.003 294.221 232.618 1.00 0.00 C +ATOM 145 CA ARG A 145 251.121 291.974 233.696 1.00 0.00 C +ATOM 146 CA ARG A 146 248.288 292.691 236.141 1.00 0.00 C +ATOM 147 CA ARG A 147 245.893 290.307 237.900 1.00 0.00 C +ATOM 148 CA ALA A 148 244.552 286.767 237.463 1.00 0.00 C +ATOM 149 CA ARG A 149 242.232 285.189 240.041 1.00 0.00 C +ATOM 150 CA SER A 150 241.603 287.273 243.168 1.00 0.00 C +ATOM 151 CA PRO A 151 243.565 290.107 244.792 1.00 0.00 C +ATOM 152 CA ALA A 152 241.879 291.819 247.749 1.00 0.00 C +ATOM 153 CA THR A 153 238.321 293.174 247.608 1.00 0.00 C +ATOM 154 CA THR A 154 234.526 293.378 247.884 1.00 0.00 C +ATOM 155 CA ILE A 155 233.658 294.318 251.473 1.00 0.00 C +ATOM 156 CA GLY A 156 232.274 292.444 254.488 1.00 0.00 C +ATOM 157 CA GLY A 157 229.121 293.173 256.498 1.00 0.00 C +ATOM 158 CA ALA A 158 226.833 296.102 257.335 1.00 0.00 C +ATOM 159 CA GLY A 159 224.388 296.135 260.257 1.00 0.00 C +ATOM 160 CA SER A 160 220.871 297.038 259.103 1.00 0.00 C +ATOM 161 CA ASP A 161 218.958 293.760 258.774 1.00 0.00 C +ATOM 162 CA GLY A 162 216.711 291.432 256.763 1.00 0.00 C +ATOM 163 CA GLY A 163 218.198 290.789 253.315 1.00 0.00 C +ATOM 164 CA ARG A 164 219.631 293.461 251.007 1.00 0.00 C +ATOM 165 CA GLY A 165 218.203 292.937 247.514 1.00 0.00 C +ATOM 166 CA LYS A 166 219.546 295.431 244.965 1.00 0.00 C +ATOM 167 CA GLY A 167 220.405 296.450 241.396 1.00 0.00 C +ATOM 168 CA ARG A 168 220.719 294.086 238.425 1.00 0.00 C +ATOM 169 CA ARG A 169 222.095 290.760 237.177 1.00 0.00 C +ATOM 170 CA ARG A 170 225.537 289.133 237.032 1.00 0.00 C +ATOM 171 CA ARG A 171 226.084 285.441 237.796 1.00 0.00 C +ATOM 172 CA PRO A 172 228.188 282.279 237.493 1.00 0.00 C +ATOM 173 CA LYS A 173 229.564 278.880 236.458 1.00 0.00 C +ATOM 174 CA ALA A 174 228.487 276.464 239.200 1.00 0.00 C +ATOM 175 CA THR A 175 227.224 272.889 239.579 1.00 0.00 C +ATOM 176 CA ALA A 176 225.645 271.110 242.555 1.00 0.00 C +ATOM 177 CA SER A 177 228.177 268.534 243.767 1.00 0.00 C +ATOM 178 CA ALA A 178 231.263 266.690 245.030 1.00 0.00 C +ATOM 179 CA TRP A 179 230.460 263.972 247.576 1.00 0.00 C +ATOM 180 CA ARG A 180 229.000 263.894 251.094 1.00 0.00 C +ATOM 181 CA GLU A 181 227.188 265.193 254.183 1.00 0.00 C +ATOM 182 CA ALA A 182 225.966 264.809 257.772 1.00 0.00 C +ATOM 183 CA ALA A 183 224.128 261.488 258.100 1.00 0.00 C +ATOM 184 CA GLN A 184 221.464 259.338 259.773 1.00 0.00 C +ATOM 185 CA THR A 185 221.440 256.236 261.985 1.00 0.00 C +ATOM 186 CA ARG A 186 221.201 254.791 265.503 1.00 0.00 C +ATOM 187 CA GLU A 187 219.971 253.942 269.007 1.00 0.00 C +ATOM 188 CA ARG A 188 221.074 254.493 272.612 1.00 0.00 C +ATOM 189 CA GLY A 189 219.711 253.868 276.115 1.00 0.00 C +ATOM 190 CA ARG A 190 219.899 250.640 278.129 1.00 0.00 C +ATOM 191 CA GLY A 191 220.407 247.755 275.693 1.00 0.00 C +ATOM 192 CA ARG A 192 217.709 246.515 273.306 1.00 0.00 C +ATOM 193 CA ARG A 193 216.013 244.123 270.874 1.00 0.00 C +ATOM 194 CA GLY A 194 213.571 241.418 271.988 1.00 0.00 C +ATOM 195 CA GLY A 195 209.992 241.061 270.732 1.00 0.00 C +ATOM 196 CA SER A 196 208.252 244.439 270.462 1.00 0.00 C +ATOM 197 CA SER A 197 210.521 246.992 272.151 1.00 0.00 C +ATOM 198 CA PRO A 198 211.959 249.804 274.281 1.00 0.00 C +ATOM 199 CA ALA A 199 210.342 253.153 275.113 1.00 0.00 C +ATOM 200 CA SER A 200 208.505 255.690 272.944 1.00 0.00 C +ATOM 201 CA MET A 201 204.699 255.828 272.838 1.00 0.00 C +ATOM 202 CA ALA A 202 202.344 258.348 274.456 1.00 0.00 C +ATOM 203 CA ALA A 203 203.702 259.884 277.667 1.00 0.00 C +ATOM 204 CA GLY A 204 205.303 262.839 279.462 1.00 0.00 C +ATOM 205 CA ALA A 205 202.822 265.709 279.103 1.00 0.00 C +ATOM 206 CA GLU A 206 199.455 266.639 280.624 1.00 0.00 C +ATOM 207 CA ASP A 207 195.757 266.003 279.968 1.00 0.00 C +ATOM 208 CA GLU A 208 194.307 262.537 280.600 1.00 0.00 C +ATOM 209 CA GLY A 209 196.356 259.395 281.271 1.00 0.00 C +ATOM 210 CA GLY A 210 197.935 255.938 281.009 1.00 0.00 C +ATOM 211 CA GLY A 211 196.449 252.856 282.685 1.00 0.00 C +ATOM 212 CA ASP A 212 198.332 249.620 281.979 1.00 0.00 C +ATOM 213 CA ASP A 213 202.035 250.508 282.104 1.00 0.00 C +ATOM 214 CA LEU A 214 203.137 250.564 278.457 1.00 0.00 C +ATOM 215 CA ALA A 215 205.179 249.334 275.486 1.00 0.00 C +ATOM 216 CA MET A 216 202.666 249.033 272.638 1.00 0.00 C +ATOM 217 CA ARG A 217 199.736 251.320 271.801 1.00 0.00 C +ATOM 218 CA ARG A 218 199.960 253.198 268.493 1.00 0.00 C +ATOM 219 CA GLY A 219 197.292 252.864 265.793 1.00 0.00 C +ATOM 220 CA GLY A 220 196.445 252.196 262.139 1.00 0.00 C +ATOM 221 CA ARG A 221 194.768 254.173 259.347 1.00 0.00 C +ATOM 222 CA ALA A 222 193.781 257.303 257.411 1.00 0.00 C +ATOM 223 CA ALA A 223 194.306 260.767 255.914 1.00 0.00 C +ATOM 224 CA ALA A 224 196.151 262.143 252.878 1.00 0.00 C +ATOM 225 CA ALA A 225 198.181 260.587 250.054 1.00 0.00 C +ATOM 226 CA PRO A 226 197.920 261.563 246.381 1.00 0.00 C +ATOM 227 CA THR A 227 194.592 260.119 245.217 1.00 0.00 C +ATOM 228 CA GLU A 228 191.025 261.326 244.637 1.00 0.00 C +ATOM 229 CA GLY A 229 189.366 264.754 244.515 1.00 0.00 C +ATOM 230 CA VAL A 230 188.312 267.708 246.677 1.00 0.00 C +ATOM 231 CA GLU A 231 185.549 268.939 248.993 1.00 0.00 C +ATOM 232 CA LYS A 232 184.857 266.159 251.505 1.00 0.00 C +ATOM 233 CA ASP A 233 181.775 263.922 251.627 1.00 0.00 C +TER 234 ASP A 233 +END diff --git a/Plants/Q9C672/Q9C672.dcd b/Plants/Q9C672/Q9C672.dcd new file mode 100644 index 0000000000000000000000000000000000000000..f04654fc899968ac39b3ae22944d0503df4e322b --- /dev/null +++ b/Plants/Q9C672/Q9C672.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:7e9457333eb374fb213641fdc4e7f324365101810b91ab6c87690e152c40103a +size 12560276 diff --git a/Plants/Q9C672/top.pdb b/Plants/Q9C672/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..5a33db43bea64dead5f62830b4b64870fe8bde1b --- /dev/null +++ b/Plants/Q9C672/top.pdb @@ -0,0 +1,102 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 241.366 247.582 298.721 1.00 0.00 C +ATOM 2 CA GLU A 2 243.588 250.123 300.487 1.00 0.00 C +ATOM 3 CA GLU A 3 244.491 252.783 297.914 1.00 0.00 C +ATOM 4 CA LEU A 4 246.994 255.195 296.354 1.00 0.00 C +ATOM 5 CA LYS A 5 245.616 258.334 294.691 1.00 0.00 C +ATOM 6 CA THR A 6 242.436 260.238 295.571 1.00 0.00 C +ATOM 7 CA LYS A 7 239.978 261.041 292.773 1.00 0.00 C +ATOM 8 CA GLY A 8 240.836 264.467 291.345 1.00 0.00 C +ATOM 9 CA GLU A 9 242.270 264.487 287.815 1.00 0.00 C +ATOM 10 CA HIS A 10 240.638 262.657 284.898 1.00 0.00 C +ATOM 11 CA GLY A 11 240.150 261.851 281.207 1.00 0.00 C +ATOM 12 CA ASN A 12 241.946 258.612 280.313 1.00 0.00 C +ATOM 13 CA GLU A 13 245.238 258.750 278.399 1.00 0.00 C +ATOM 14 CA GLU A 14 246.929 262.032 279.340 1.00 0.00 C +ATOM 15 CA ALA A 15 247.348 264.804 281.920 1.00 0.00 C +ATOM 16 CA LYS A 16 248.772 268.313 282.334 1.00 0.00 C +ATOM 17 CA LYS A 17 248.195 271.972 281.442 1.00 0.00 C +ATOM 18 CA ALA A 18 248.369 274.599 278.688 1.00 0.00 C +ATOM 19 CA PRO A 19 245.353 275.240 276.451 1.00 0.00 C +ATOM 20 CA ALA A 20 245.230 273.591 273.019 1.00 0.00 C +ATOM 21 CA THR A 21 241.617 273.068 271.930 1.00 0.00 C +ATOM 22 CA GLY A 22 239.761 274.387 268.875 1.00 0.00 C +ATOM 23 CA GLU A 23 240.862 275.935 265.572 1.00 0.00 C +ATOM 24 CA THR A 24 242.110 279.278 264.236 1.00 0.00 C +ATOM 25 CA GLU A 25 245.163 281.281 263.148 1.00 0.00 C +ATOM 26 CA THR A 26 246.075 280.741 259.488 1.00 0.00 C +ATOM 27 CA VAL A 27 243.259 280.818 256.923 1.00 0.00 C +ATOM 28 CA GLU A 28 240.224 279.792 254.862 1.00 0.00 C +ATOM 29 CA LYS A 29 239.092 276.471 253.375 1.00 0.00 C +ATOM 30 CA ASN A 30 238.840 273.865 250.608 1.00 0.00 C +ATOM 31 CA VAL A 31 235.638 272.553 249.013 1.00 0.00 C +ATOM 32 CA ALA A 32 235.848 270.809 245.632 1.00 0.00 C +ATOM 33 CA ILE A 33 238.014 271.462 242.567 1.00 0.00 C +ATOM 34 CA ARG A 34 238.446 268.649 240.033 1.00 0.00 C +ATOM 35 CA ARG A 35 237.412 267.435 236.573 1.00 0.00 C +ATOM 36 CA THR A 36 237.697 263.937 235.092 1.00 0.00 C +ATOM 37 CA SER A 37 239.809 262.498 232.266 1.00 0.00 C +ATOM 38 CA THR A 38 242.301 259.620 232.434 1.00 0.00 C +ATOM 39 CA ALA A 39 245.730 259.341 234.070 1.00 0.00 C +ATOM 40 CA SER A 40 248.898 259.141 231.963 1.00 0.00 C +ATOM 41 CA SER A 41 252.438 260.509 231.626 1.00 0.00 C +ATOM 42 CA GLU A 42 254.181 262.707 234.205 1.00 0.00 C +ATOM 43 CA GLN A 43 257.711 264.089 234.590 1.00 0.00 C +ATOM 44 CA ASP A 44 260.065 261.095 234.713 1.00 0.00 C +ATOM 45 CA LEU A 45 261.388 257.634 235.599 1.00 0.00 C +ATOM 46 CA ASP A 46 260.146 255.169 232.973 1.00 0.00 C +ATOM 47 CA THR A 47 256.941 253.194 233.556 1.00 0.00 C +ATOM 48 CA PHE A 48 253.137 252.980 233.557 1.00 0.00 C +ATOM 49 CA LEU A 49 250.143 253.466 235.864 1.00 0.00 C +ATOM 50 CA LEU A 50 249.884 250.373 238.073 1.00 0.00 C +ATOM 51 CA GLY A 51 250.870 247.789 240.694 1.00 0.00 C +ATOM 52 CA ASP A 52 251.052 246.352 244.218 1.00 0.00 C +ATOM 53 CA LEU A 53 252.150 247.871 247.534 1.00 0.00 C +ATOM 54 CA GLU A 54 251.384 249.241 251.006 1.00 0.00 C +ATOM 55 CA ASP A 55 251.044 246.806 253.917 1.00 0.00 C +ATOM 56 CA SER A 56 247.943 244.599 253.747 1.00 0.00 C +ATOM 57 CA ASP A 57 245.500 243.493 256.453 1.00 0.00 C +ATOM 58 CA GLU A 58 245.512 242.688 260.177 1.00 0.00 C +ATOM 59 CA ALA A 59 245.351 241.676 263.847 1.00 0.00 C +ATOM 60 CA PRO A 60 244.230 238.191 264.900 1.00 0.00 C +ATOM 61 CA ASP A 61 245.191 234.794 263.467 1.00 0.00 C +ATOM 62 CA ASP A 62 243.786 234.132 259.988 1.00 0.00 C +ATOM 63 CA GLY A 63 242.146 236.354 257.363 1.00 0.00 C +ATOM 64 CA ASP A 64 240.756 234.582 254.290 1.00 0.00 C +ATOM 65 CA GLY A 65 241.239 237.014 251.398 1.00 0.00 C +ATOM 66 CA SER A 66 240.988 235.449 247.933 1.00 0.00 C +ATOM 67 CA LEU A 67 244.502 234.621 246.714 1.00 0.00 C +ATOM 68 CA GLU A 68 245.731 232.113 244.123 1.00 0.00 C +ATOM 69 CA ASP A 69 248.308 233.903 241.962 1.00 0.00 C +ATOM 70 CA ASP A 70 248.294 234.417 238.187 1.00 0.00 C +ATOM 71 CA PHE A 71 247.818 234.292 234.409 1.00 0.00 C +ATOM 72 CA ASP A 72 250.071 236.793 232.624 1.00 0.00 C +ATOM 73 CA LYS A 73 253.465 238.423 232.042 1.00 0.00 C +ATOM 74 CA ILE A 74 256.836 236.962 233.051 1.00 0.00 C +ATOM 75 CA GLY A 75 256.488 236.255 236.779 1.00 0.00 C +ATOM 76 CA ASN A 76 255.099 232.909 237.957 1.00 0.00 C +ATOM 77 CA SER A 77 255.135 231.929 241.639 1.00 0.00 C +ATOM 78 CA ASP A 78 254.289 234.923 243.838 1.00 0.00 C +ATOM 79 CA VAL A 79 256.920 236.916 245.742 1.00 0.00 C +ATOM 80 CA GLU A 80 260.275 237.711 244.121 1.00 0.00 C +ATOM 81 CA ASP A 81 261.684 240.036 241.453 1.00 0.00 C +ATOM 82 CA GLU A 82 262.758 239.797 237.805 1.00 0.00 C +ATOM 83 CA LYS A 83 265.006 237.000 236.522 1.00 0.00 C +ATOM 84 CA GLN A 84 265.438 233.440 235.237 1.00 0.00 C +ATOM 85 CA SER A 85 263.798 231.290 232.553 1.00 0.00 C +ATOM 86 CA SER A 86 260.533 231.766 230.648 1.00 0.00 C +ATOM 87 CA LYS A 87 260.340 229.039 227.995 1.00 0.00 C +ATOM 88 CA ALA A 88 259.444 228.641 224.313 1.00 0.00 C +ATOM 89 CA THR A 89 260.716 228.308 220.737 1.00 0.00 C +ATOM 90 CA THR A 90 264.450 227.616 220.418 1.00 0.00 C +ATOM 91 CA ASN A 91 264.997 226.321 216.877 1.00 0.00 C +ATOM 92 CA ALA A 92 266.050 225.438 213.323 1.00 0.00 C +ATOM 93 CA GLY A 93 269.081 226.347 211.200 1.00 0.00 C +ATOM 94 CA ASN A 94 272.018 224.417 209.730 1.00 0.00 C +ATOM 95 CA GLU A 95 271.532 220.795 210.809 1.00 0.00 C +ATOM 96 CA VAL A 96 269.315 218.654 213.049 1.00 0.00 C +ATOM 97 CA SER A 97 266.448 216.211 212.479 1.00 0.00 C +ATOM 98 CA CYS A 98 265.448 212.721 213.633 1.00 0.00 C +TER 99 CYS A 98 +END diff --git a/Plants/Q9C6E9/Q9C6E9.dcd b/Plants/Q9C6E9/Q9C6E9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..bad3fef8f1790204f1b01d7d66590aea77f7cdd2 --- /dev/null +++ b/Plants/Q9C6E9/Q9C6E9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:51124861c894735c67835aedfd2117869c3db379a550d788b3e1a27aa60dddcf +size 6800276 diff --git a/Plants/Q9C6E9/top.pdb b/Plants/Q9C6E9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..98d903098f6745d4767c501528b47cf2d1eb8911 --- /dev/null +++ b/Plants/Q9C6E9/top.pdb @@ -0,0 +1,54 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 250.514 241.941 281.600 1.00 0.00 C +ATOM 2 CA GLU A 2 250.340 239.442 278.728 1.00 0.00 C +ATOM 3 CA SER A 3 252.022 239.029 275.335 1.00 0.00 C +ATOM 4 CA ASN A 4 250.475 235.937 273.733 1.00 0.00 C +ATOM 5 CA ASN A 5 249.301 234.064 270.630 1.00 0.00 C +ATOM 6 CA PHE A 6 250.233 231.276 268.207 1.00 0.00 C +ATOM 7 CA ILE A 7 251.148 232.822 264.847 1.00 0.00 C +ATOM 8 CA ARG A 8 253.698 233.597 262.124 1.00 0.00 C +ATOM 9 CA GLU A 9 253.402 235.206 258.683 1.00 0.00 C +ATOM 10 CA HIS A 10 255.131 235.857 255.351 1.00 0.00 C +ATOM 11 CA ASP A 11 256.269 232.543 253.854 1.00 0.00 C +ATOM 12 CA VAL A 12 254.499 229.240 254.541 1.00 0.00 C +ATOM 13 CA GLU A 13 257.059 226.526 255.312 1.00 0.00 C +ATOM 14 CA ASP A 14 259.652 226.343 252.526 1.00 0.00 C +ATOM 15 CA THR A 15 260.826 226.456 248.904 1.00 0.00 C +ATOM 16 CA GLY A 16 258.266 226.465 246.081 1.00 0.00 C +ATOM 17 CA SER A 17 256.113 227.785 243.229 1.00 0.00 C +ATOM 18 CA TYR A 18 253.614 230.213 244.772 1.00 0.00 C +ATOM 19 CA GLN A 19 250.565 231.268 246.798 1.00 0.00 C +ATOM 20 CA GLU A 20 247.139 232.458 245.630 1.00 0.00 C +ATOM 21 CA GLU A 21 244.860 235.251 246.863 1.00 0.00 C +ATOM 22 CA SER A 22 244.113 237.725 244.063 1.00 0.00 C +ATOM 23 CA GLU A 23 247.310 238.060 242.018 1.00 0.00 C +ATOM 24 CA THR A 24 248.069 239.790 238.709 1.00 0.00 C +ATOM 25 CA GLU A 25 245.298 240.648 236.240 1.00 0.00 C +ATOM 26 CA SER A 26 243.757 244.044 235.460 1.00 0.00 C +ATOM 27 CA GLU A 27 241.865 245.371 238.489 1.00 0.00 C +ATOM 28 CA SER A 28 240.487 248.231 240.595 1.00 0.00 C +ATOM 29 CA SER A 29 241.382 251.816 241.522 1.00 0.00 C +ATOM 30 CA GLU A 30 244.019 253.776 243.451 1.00 0.00 C +ATOM 31 CA ASP A 31 247.111 255.696 242.324 1.00 0.00 C +ATOM 32 CA GLU A 32 250.603 255.965 240.823 1.00 0.00 C +ATOM 33 CA GLU A 33 253.247 256.764 238.199 1.00 0.00 C +ATOM 34 CA THR A 34 255.121 260.066 237.882 1.00 0.00 C +ATOM 35 CA GLU A 35 254.525 262.207 234.788 1.00 0.00 C +ATOM 36 CA SER A 36 255.915 265.753 234.674 1.00 0.00 C +ATOM 37 CA ASP A 37 258.723 265.922 237.243 1.00 0.00 C +ATOM 38 CA ASP A 38 257.426 266.082 240.822 1.00 0.00 C +ATOM 39 CA MET A 39 253.845 265.453 241.959 1.00 0.00 C +ATOM 40 CA GLU A 40 250.380 266.990 242.344 1.00 0.00 C +ATOM 41 CA THR A 41 247.318 269.251 242.507 1.00 0.00 C +ATOM 42 CA GLY A 42 247.087 272.061 245.070 1.00 0.00 C +ATOM 43 CA SER A 43 248.075 273.790 248.318 1.00 0.00 C +ATOM 44 CA GLU A 44 247.188 277.461 247.810 1.00 0.00 C +ATOM 45 CA CYS A 45 245.859 280.874 248.859 1.00 0.00 C +ATOM 46 CA ASP A 46 243.655 282.139 251.697 1.00 0.00 C +ATOM 47 CA GLU A 47 242.476 284.686 254.275 1.00 0.00 C +ATOM 48 CA PRO A 48 241.964 286.150 257.755 1.00 0.00 C +ATOM 49 CA ARG A 49 242.632 285.855 261.494 1.00 0.00 C +ATOM 50 CA PRO A 50 245.426 283.656 262.862 1.00 0.00 C +TER 51 PRO A 50 +END diff --git a/Plants/Q9C7R7/Q9C7R7.dcd b/Plants/Q9C7R7/Q9C7R7.dcd new file mode 100644 index 0000000000000000000000000000000000000000..4f390cb4ceb40c19ccec3a39ac4230c42793fd7a --- /dev/null +++ b/Plants/Q9C7R7/Q9C7R7.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:ead55967c1a60b503c0a5c6eb1cba3e784f88be93ab06afe14bc54dfff54c681 +size 12080276 diff --git a/Plants/Q9C7R7/top.pdb b/Plants/Q9C7R7/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..10b438699c020ad2b48952271abe571a691c3827 --- /dev/null +++ b/Plants/Q9C7R7/top.pdb @@ -0,0 +1,98 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 258.924 183.987 258.141 1.00 0.00 C +ATOM 2 CA THR A 2 257.404 187.480 258.119 1.00 0.00 C +ATOM 3 CA ILE A 3 255.798 190.934 258.202 1.00 0.00 C +ATOM 4 CA MET A 4 255.784 194.666 258.972 1.00 0.00 C +ATOM 5 CA ASP A 5 255.328 196.652 255.753 1.00 0.00 C +ATOM 6 CA GLN A 6 252.453 195.397 253.591 1.00 0.00 C +ATOM 7 CA GLU A 7 252.916 194.834 249.852 1.00 0.00 C +ATOM 8 CA ASP A 8 252.949 193.874 246.165 1.00 0.00 C +ATOM 9 CA ASP A 9 253.161 191.751 243.008 1.00 0.00 C +ATOM 10 CA GLU A 10 251.397 193.282 239.999 1.00 0.00 C +ATOM 11 CA THR A 11 253.000 195.162 237.098 1.00 0.00 C +ATOM 12 CA GLU A 12 254.004 197.068 233.955 1.00 0.00 C +ATOM 13 CA LYS A 13 251.140 198.824 232.158 1.00 0.00 C +ATOM 14 CA ALA A 14 248.846 201.794 232.818 1.00 0.00 C +ATOM 15 CA PRO A 15 246.453 203.892 230.722 1.00 0.00 C +ATOM 16 CA VAL A 16 245.473 207.168 229.044 1.00 0.00 C +ATOM 17 CA LYS A 17 245.751 210.143 231.408 1.00 0.00 C +ATOM 18 CA ARG A 18 247.101 213.700 231.202 1.00 0.00 C +ATOM 19 CA LYS A 19 248.299 217.317 231.195 1.00 0.00 C +ATOM 20 CA LYS A 20 249.043 220.048 233.745 1.00 0.00 C +ATOM 21 CA SER A 21 251.116 222.926 235.136 1.00 0.00 C +ATOM 22 CA LYS A 22 251.240 224.216 238.719 1.00 0.00 C +ATOM 23 CA LYS A 23 254.641 225.559 239.787 1.00 0.00 C +ATOM 24 CA GLU A 24 258.098 226.037 241.316 1.00 0.00 C +ATOM 25 CA LYS A 25 260.847 228.650 241.685 1.00 0.00 C +ATOM 26 CA ARG A 26 259.902 232.325 242.019 1.00 0.00 C +ATOM 27 CA SER A 27 259.873 234.428 245.197 1.00 0.00 C +ATOM 28 CA ARG A 28 261.038 233.522 248.709 1.00 0.00 C +ATOM 29 CA GLU A 29 262.288 235.933 251.382 1.00 0.00 C +ATOM 30 CA ILE A 30 262.070 237.176 254.977 1.00 0.00 C +ATOM 31 CA VAL A 31 264.167 240.316 255.481 1.00 0.00 C +ATOM 32 CA PHE A 32 265.650 242.351 258.340 1.00 0.00 C +ATOM 33 CA GLU A 33 265.839 243.419 261.993 1.00 0.00 C +ATOM 34 CA GLY A 34 266.201 246.101 264.674 1.00 0.00 C +ATOM 35 CA GLU A 35 267.908 248.993 262.875 1.00 0.00 C +ATOM 36 CA ASP A 36 266.025 252.264 263.399 1.00 0.00 C +ATOM 37 CA ASP A 37 262.376 251.325 263.962 1.00 0.00 C +ATOM 38 CA GLU A 38 259.700 250.510 266.548 1.00 0.00 C +ATOM 39 CA GLU A 39 257.394 253.542 266.480 1.00 0.00 C +ATOM 40 CA ASN A 40 254.636 255.572 264.811 1.00 0.00 C +ATOM 41 CA GLU A 41 253.562 255.848 261.166 1.00 0.00 C +ATOM 42 CA ASP A 42 250.106 254.418 260.440 1.00 0.00 C +ATOM 43 CA GLU A 43 246.875 254.641 258.433 1.00 0.00 C +ATOM 44 CA ILE A 44 243.518 252.924 257.886 1.00 0.00 C +ATOM 45 CA GLU A 45 240.473 255.192 257.571 1.00 0.00 C +ATOM 46 CA LYS A 46 237.488 253.226 258.889 1.00 0.00 C +ATOM 47 CA ALA A 47 233.982 254.628 259.395 1.00 0.00 C +ATOM 48 CA PRO A 48 231.323 254.437 262.117 1.00 0.00 C +ATOM 49 CA VAL A 49 227.918 255.888 261.215 1.00 0.00 C +ATOM 50 CA LYS A 50 225.565 254.829 258.412 1.00 0.00 C +ATOM 51 CA THR A 51 224.913 256.835 255.239 1.00 0.00 C +ATOM 52 CA LYS A 52 226.100 259.394 252.678 1.00 0.00 C +ATOM 53 CA LYS A 53 225.712 260.455 249.039 1.00 0.00 C +ATOM 54 CA SER A 54 228.447 259.007 246.817 1.00 0.00 C +ATOM 55 CA LYS A 55 231.453 257.359 245.156 1.00 0.00 C +ATOM 56 CA LYS A 56 232.955 254.476 243.168 1.00 0.00 C +ATOM 57 CA GLU A 57 235.339 251.951 244.736 1.00 0.00 C +ATOM 58 CA LYS A 58 238.035 249.267 244.544 1.00 0.00 C +ATOM 59 CA ARG A 59 241.778 249.773 244.042 1.00 0.00 C +ATOM 60 CA SER A 60 245.363 250.729 244.908 1.00 0.00 C +ATOM 61 CA ARG A 61 245.939 253.139 247.802 1.00 0.00 C +ATOM 62 CA GLU A 62 248.128 256.239 248.140 1.00 0.00 C +ATOM 63 CA LYS A 63 250.979 257.319 245.855 1.00 0.00 C +ATOM 64 CA VAL A 64 251.576 260.033 243.249 1.00 0.00 C +ATOM 65 CA SER A 65 250.015 263.493 243.581 1.00 0.00 C +ATOM 66 CA GLU A 66 246.501 263.944 244.980 1.00 0.00 C +ATOM 67 CA GLY A 67 245.366 266.987 246.973 1.00 0.00 C +ATOM 68 CA GLU A 68 243.969 270.473 247.611 1.00 0.00 C +ATOM 69 CA GLU A 69 242.443 272.475 250.472 1.00 0.00 C +ATOM 70 CA LYS A 70 241.592 275.460 252.681 1.00 0.00 C +ATOM 71 CA ASP A 71 239.410 277.866 250.690 1.00 0.00 C +ATOM 72 CA GLU A 72 240.065 277.817 246.937 1.00 0.00 C +ATOM 73 CA LEU A 73 243.015 277.998 244.532 1.00 0.00 C +ATOM 74 CA ARG A 74 246.152 278.752 246.559 1.00 0.00 C +ATOM 75 CA SER A 75 248.496 281.640 247.384 1.00 0.00 C +ATOM 76 CA LYS A 76 252.213 282.285 247.913 1.00 0.00 C +ATOM 77 CA LYS A 77 253.446 280.796 251.197 1.00 0.00 C +ATOM 78 CA THR A 78 255.413 279.961 254.351 1.00 0.00 C +ATOM 79 CA ARG A 79 253.833 280.926 257.681 1.00 0.00 C +ATOM 80 CA GLU A 80 251.813 282.773 260.330 1.00 0.00 C +ATOM 81 CA HIS A 81 253.435 286.176 260.881 1.00 0.00 C +ATOM 82 CA LYS A 82 251.342 288.603 258.820 1.00 0.00 C +ATOM 83 CA LYS A 83 251.943 290.626 255.648 1.00 0.00 C +ATOM 84 CA LYS A 84 254.414 290.678 252.748 1.00 0.00 C +ATOM 85 CA THR A 85 257.068 293.322 252.053 1.00 0.00 C +ATOM 86 CA LYS A 86 259.791 295.372 253.756 1.00 0.00 C +ATOM 87 CA ILE A 87 260.823 298.841 252.567 1.00 0.00 C +ATOM 88 CA VAL A 88 261.813 302.489 252.084 1.00 0.00 C +ATOM 89 CA LYS A 89 259.035 304.953 251.233 1.00 0.00 C +ATOM 90 CA HIS A 90 255.784 304.213 249.387 1.00 0.00 C +ATOM 91 CA ASN A 91 254.023 306.567 246.964 1.00 0.00 C +ATOM 92 CA GLN A 92 253.985 310.095 248.400 1.00 0.00 C +ATOM 93 CA GLU A 93 254.596 309.586 252.127 1.00 0.00 C +ATOM 94 CA ASP A 94 254.447 309.691 255.932 1.00 0.00 C +TER 95 ASP A 94 +END diff --git a/Plants/Q9C7W1/Q9C7W1.dcd b/Plants/Q9C7W1/Q9C7W1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..0fd58a45274103ce5353a4e0cfe31392803a55f0 --- /dev/null +++ b/Plants/Q9C7W1/Q9C7W1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:b7e003fc31030264ecfee7976c7c8d4eba53982b94c406303252f4405b0de07e +size 22160276 diff --git a/Plants/Q9C7W1/top.pdb b/Plants/Q9C7W1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..7f761f0863cee4f82cc23e27603ae3621c66cdba --- /dev/null +++ b/Plants/Q9C7W1/top.pdb @@ -0,0 +1,182 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 185.050 221.868 255.995 1.00 0.00 C +ATOM 2 CA GLN A 2 184.531 225.124 254.087 1.00 0.00 C +ATOM 3 CA TYR A 3 185.713 227.911 251.774 1.00 0.00 C +ATOM 4 CA TYR A 4 188.831 227.042 249.764 1.00 0.00 C +ATOM 5 CA GLU A 5 188.989 225.658 246.218 1.00 0.00 C +ATOM 6 CA ASN A 6 189.876 226.675 242.654 1.00 0.00 C +ATOM 7 CA ARG A 7 191.464 229.299 240.396 1.00 0.00 C +ATOM 8 CA GLU A 8 193.832 231.479 242.435 1.00 0.00 C +ATOM 9 CA LYS A 9 192.968 233.101 245.772 1.00 0.00 C +ATOM 10 CA ASP A 10 192.811 232.460 249.525 1.00 0.00 C +ATOM 11 CA TYR A 11 195.655 232.250 252.051 1.00 0.00 C +ATOM 12 CA TYR A 12 197.283 233.018 255.409 1.00 0.00 C +ATOM 13 CA GLU A 13 197.523 233.227 259.205 1.00 0.00 C +ATOM 14 CA VAL A 14 198.024 233.390 262.979 1.00 0.00 C +ATOM 15 CA ALA A 15 195.548 235.541 264.919 1.00 0.00 C +ATOM 16 CA GLN A 16 195.845 235.998 268.689 1.00 0.00 C +ATOM 17 CA GLY A 17 198.833 233.956 269.882 1.00 0.00 C +ATOM 18 CA GLN A 18 200.736 235.920 272.534 1.00 0.00 C +ATOM 19 CA ARG A 19 203.216 233.862 274.567 1.00 0.00 C +ATOM 20 CA ASN A 20 205.171 231.096 276.311 1.00 0.00 C +ATOM 21 CA GLY A 21 204.271 227.685 274.875 1.00 0.00 C +ATOM 22 CA TYR A 22 207.161 226.269 272.835 1.00 0.00 C +ATOM 23 CA GLY A 23 210.854 226.911 273.516 1.00 0.00 C +ATOM 24 CA GLN A 24 213.340 225.195 275.839 1.00 0.00 C +ATOM 25 CA SER A 25 216.843 225.978 277.115 1.00 0.00 C +ATOM 26 CA GLN A 26 220.603 225.436 277.412 1.00 0.00 C +ATOM 27 CA SER A 27 222.298 227.366 280.227 1.00 0.00 C +ATOM 28 CA HIS A 28 225.575 229.146 281.006 1.00 0.00 C +ATOM 29 CA ASN A 29 229.178 230.023 281.879 1.00 0.00 C +ATOM 30 CA HIS A 30 230.500 233.392 283.069 1.00 0.00 C +ATOM 31 CA GLU A 31 231.087 236.208 285.568 1.00 0.00 C +ATOM 32 CA GLY A 32 229.781 239.334 283.825 1.00 0.00 C +ATOM 33 CA TYR A 33 229.364 243.097 283.391 1.00 0.00 C +ATOM 34 CA GLY A 34 232.250 245.521 282.834 1.00 0.00 C +ATOM 35 CA GLN A 35 233.041 248.941 284.314 1.00 0.00 C +ATOM 36 CA SER A 36 233.544 251.170 281.265 1.00 0.00 C +ATOM 37 CA GLN A 37 232.263 254.722 281.772 1.00 0.00 C +ATOM 38 CA SER A 38 232.419 257.706 279.408 1.00 0.00 C +ATOM 39 CA ARG A 39 229.534 260.162 279.005 1.00 0.00 C +ATOM 40 CA GLY A 40 225.973 259.340 277.931 1.00 0.00 C +ATOM 41 CA GLY A 41 223.594 258.054 275.247 1.00 0.00 C +ATOM 42 CA TYR A 42 223.227 255.603 272.352 1.00 0.00 C +ATOM 43 CA GLY A 43 225.606 256.590 269.545 1.00 0.00 C +ATOM 44 CA GLN A 44 223.418 258.191 266.867 1.00 0.00 C +ATOM 45 CA ILE A 45 223.037 259.059 263.177 1.00 0.00 C +ATOM 46 CA HIS A 46 220.854 262.049 262.277 1.00 0.00 C +ATOM 47 CA ASN A 47 217.614 262.356 264.258 1.00 0.00 C +ATOM 48 CA ARG A 48 216.903 259.457 266.626 1.00 0.00 C +ATOM 49 CA GLU A 49 217.171 256.029 264.985 1.00 0.00 C +ATOM 50 CA GLY A 50 217.390 253.357 262.277 1.00 0.00 C +ATOM 51 CA TYR A 51 215.518 251.258 259.708 1.00 0.00 C +ATOM 52 CA ASN A 52 216.366 248.537 257.179 1.00 0.00 C +ATOM 53 CA GLN A 53 218.951 245.787 256.658 1.00 0.00 C +ATOM 54 CA ASN A 54 222.685 245.375 256.023 1.00 0.00 C +ATOM 55 CA ARG A 55 225.536 244.715 253.583 1.00 0.00 C +ATOM 56 CA GLU A 56 228.669 243.964 251.549 1.00 0.00 C +ATOM 57 CA GLY A 57 230.315 242.911 248.278 1.00 0.00 C +ATOM 58 CA TYR A 58 231.161 241.721 244.759 1.00 0.00 C +ATOM 59 CA SER A 59 232.991 241.371 241.435 1.00 0.00 C +ATOM 60 CA GLN A 60 235.374 242.760 238.807 1.00 0.00 C +ATOM 61 CA SER A 61 236.612 241.555 235.412 1.00 0.00 C +ATOM 62 CA GLN A 62 237.584 239.735 232.209 1.00 0.00 C +ATOM 63 CA SER A 63 239.715 237.684 229.806 1.00 0.00 C +ATOM 64 CA ARG A 64 243.215 237.616 228.303 1.00 0.00 C +ATOM 65 CA PRO A 65 244.609 234.482 226.644 1.00 0.00 C +ATOM 66 CA VAL A 66 244.780 231.269 228.685 1.00 0.00 C +ATOM 67 CA TYR A 67 245.046 229.142 231.835 1.00 0.00 C +ATOM 68 CA GLY A 68 247.449 230.743 234.321 1.00 0.00 C +ATOM 69 CA LEU A 69 246.750 232.335 237.711 1.00 0.00 C +ATOM 70 CA SER A 70 249.986 233.038 239.595 1.00 0.00 C +ATOM 71 CA PRO A 71 249.006 234.602 242.929 1.00 0.00 C +ATOM 72 CA THR A 72 249.343 237.978 244.662 1.00 0.00 C +ATOM 73 CA LEU A 73 249.735 239.922 247.916 1.00 0.00 C +ATOM 74 CA ASN A 74 247.121 240.917 250.502 1.00 0.00 C +ATOM 75 CA HIS A 75 245.995 238.935 253.555 1.00 0.00 C +ATOM 76 CA ARG A 76 244.186 236.836 256.170 1.00 0.00 C +ATOM 77 CA SER A 77 243.314 235.496 259.628 1.00 0.00 C +ATOM 78 CA HIS A 78 243.008 235.931 263.401 1.00 0.00 C +ATOM 79 CA GLY A 79 246.064 234.565 265.220 1.00 0.00 C +ATOM 80 CA GLY A 80 249.051 232.430 264.203 1.00 0.00 C +ATOM 81 CA PHE A 81 249.442 230.293 261.072 1.00 0.00 C +ATOM 82 CA LEU A 82 249.442 226.672 259.889 1.00 0.00 C +ATOM 83 CA ASP A 83 251.512 223.566 260.655 1.00 0.00 C +ATOM 84 CA GLY A 84 255.307 223.598 261.001 1.00 0.00 C +ATOM 85 CA LEU A 85 257.230 226.838 260.440 1.00 0.00 C +ATOM 86 CA PHE A 86 260.284 226.845 262.718 1.00 0.00 C +ATOM 87 CA LYS A 87 260.753 228.070 266.296 1.00 0.00 C +ATOM 88 CA GLY A 88 258.712 231.001 267.623 1.00 0.00 C +ATOM 89 CA GLN A 89 255.793 230.981 270.071 1.00 0.00 C +ATOM 90 CA ASN A 90 255.480 229.039 273.334 1.00 0.00 C +ATOM 91 CA GLY A 91 257.316 226.189 275.073 1.00 0.00 C +ATOM 92 CA GLN A 92 259.896 223.939 276.745 1.00 0.00 C +ATOM 93 CA LYS A 93 263.170 225.882 276.588 1.00 0.00 C +ATOM 94 CA GLY A 94 265.374 228.452 278.335 1.00 0.00 C +ATOM 95 CA GLN A 95 268.936 227.639 277.256 1.00 0.00 C +ATOM 96 CA SER A 96 272.534 226.396 277.410 1.00 0.00 C +ATOM 97 CA GLY A 97 276.255 226.054 276.663 1.00 0.00 C +ATOM 98 CA LEU A 98 279.315 227.475 274.893 1.00 0.00 C +ATOM 99 CA GLY A 99 281.841 229.322 272.720 1.00 0.00 C +ATOM 100 CA THR A 100 282.337 229.988 269.002 1.00 0.00 C +ATOM 101 CA PHE A 101 282.764 233.531 267.668 1.00 0.00 C +ATOM 102 CA LEU A 102 283.161 236.751 265.670 1.00 0.00 C +ATOM 103 CA GLY A 103 283.584 239.827 263.461 1.00 0.00 C +ATOM 104 CA GLN A 104 282.776 239.206 259.790 1.00 0.00 C +ATOM 105 CA HIS A 105 280.633 239.209 256.640 1.00 0.00 C +ATOM 106 CA LYS A 106 281.113 241.003 253.313 1.00 0.00 C +ATOM 107 CA SER A 107 284.095 241.984 251.154 1.00 0.00 C +ATOM 108 CA GLN A 108 287.874 242.467 251.211 1.00 0.00 C +ATOM 109 CA GLU A 109 289.826 245.704 250.732 1.00 0.00 C +ATOM 110 CA ALA A 110 292.032 248.081 252.731 1.00 0.00 C +ATOM 111 CA LYS A 111 292.445 251.860 252.468 1.00 0.00 C +ATOM 112 CA LYS A 112 294.242 255.111 253.311 1.00 0.00 C +ATOM 113 CA SER A 113 295.303 258.618 254.356 1.00 0.00 C +ATOM 114 CA GLN A 114 296.429 260.484 257.481 1.00 0.00 C +ATOM 115 CA GLY A 115 295.428 263.927 258.771 1.00 0.00 C +ATOM 116 CA HIS A 116 293.446 267.030 257.791 1.00 0.00 C +ATOM 117 CA GLY A 117 295.292 270.357 257.996 1.00 0.00 C +ATOM 118 CA LYS A 118 293.343 273.228 259.568 1.00 0.00 C +ATOM 119 CA LEU A 119 289.774 274.562 259.535 1.00 0.00 C +ATOM 120 CA LEU A 120 287.502 273.509 262.406 1.00 0.00 C +ATOM 121 CA GLY A 121 283.735 273.598 262.973 1.00 0.00 C +ATOM 122 CA GLN A 122 281.860 271.151 260.734 1.00 0.00 C +ATOM 123 CA HIS A 123 280.689 272.101 257.235 1.00 0.00 C +ATOM 124 CA ASP A 124 282.348 274.463 254.749 1.00 0.00 C +ATOM 125 CA GLN A 125 283.706 277.229 252.509 1.00 0.00 C +ATOM 126 CA LYS A 126 286.634 276.930 250.089 1.00 0.00 C +ATOM 127 CA LYS A 127 285.864 277.191 246.366 1.00 0.00 C +ATOM 128 CA THR A 128 286.527 275.748 242.903 1.00 0.00 C +ATOM 129 CA HIS A 129 287.378 272.244 241.674 1.00 0.00 C +ATOM 130 CA GLU A 130 288.720 271.136 238.284 1.00 0.00 C +ATOM 131 CA THR A 131 291.929 272.633 236.876 1.00 0.00 C +ATOM 132 CA ASN A 132 292.594 270.626 233.707 1.00 0.00 C +ATOM 133 CA SER A 133 293.910 272.590 230.719 1.00 0.00 C +ATOM 134 CA GLY A 134 292.090 271.921 227.439 1.00 0.00 C +ATOM 135 CA LEU A 135 291.260 268.217 227.111 1.00 0.00 C +ATOM 136 CA ASN A 136 287.968 267.828 228.988 1.00 0.00 C +ATOM 137 CA GLY A 137 285.254 265.506 227.661 1.00 0.00 C +ATOM 138 CA LEU A 138 282.033 267.360 226.821 1.00 0.00 C +ATOM 139 CA GLY A 139 278.490 266.819 225.527 1.00 0.00 C +ATOM 140 CA MET A 140 276.355 264.046 224.021 1.00 0.00 C +ATOM 141 CA PHE A 141 274.079 263.459 221.023 1.00 0.00 C +ATOM 142 CA ILE A 142 270.577 263.903 219.589 1.00 0.00 C +ATOM 143 CA ASN A 143 268.075 266.744 220.017 1.00 0.00 C +ATOM 144 CA ASN A 144 269.856 269.292 222.220 1.00 0.00 C +ATOM 145 CA GLY A 145 268.632 272.900 222.274 1.00 0.00 C +ATOM 146 CA GLU A 146 267.097 275.906 220.506 1.00 0.00 C +ATOM 147 CA LYS A 147 263.770 275.037 218.867 1.00 0.00 C +ATOM 148 CA LYS A 148 262.159 272.313 220.988 1.00 0.00 C +ATOM 149 CA HIS A 149 260.822 269.012 222.342 1.00 0.00 C +ATOM 150 CA ARG A 150 262.005 265.810 220.649 1.00 0.00 C +ATOM 151 CA ARG A 151 262.982 265.672 216.969 1.00 0.00 C +ATOM 152 CA LYS A 152 260.877 265.418 213.804 1.00 0.00 C +ATOM 153 CA SER A 153 257.137 265.599 213.102 1.00 0.00 C +ATOM 154 CA GLU A 154 255.892 269.186 213.420 1.00 0.00 C +ATOM 155 CA HIS A 155 252.735 271.319 213.409 1.00 0.00 C +ATOM 156 CA LYS A 156 251.454 273.224 210.368 1.00 0.00 C +ATOM 157 CA LYS A 157 248.171 275.002 211.125 1.00 0.00 C +ATOM 158 CA LYS A 158 246.613 276.785 214.110 1.00 0.00 C +ATOM 159 CA ASN A 159 248.204 276.722 217.571 1.00 0.00 C +ATOM 160 CA LYS A 160 247.218 276.496 221.244 1.00 0.00 C +ATOM 161 CA ASP A 161 246.614 279.432 223.596 1.00 0.00 C +ATOM 162 CA GLY A 162 249.463 279.577 226.123 1.00 0.00 C +ATOM 163 CA HIS A 163 251.935 276.806 226.972 1.00 0.00 C +ATOM 164 CA GLY A 164 254.912 275.470 225.005 1.00 0.00 C +ATOM 165 CA SER A 165 258.292 274.557 226.507 1.00 0.00 C +ATOM 166 CA GLY A 166 261.017 274.902 229.147 1.00 0.00 C +ATOM 167 CA ASN A 167 263.761 272.404 228.282 1.00 0.00 C +ATOM 168 CA GLU A 168 265.947 272.144 231.391 1.00 0.00 C +ATOM 169 CA SER A 169 269.681 272.497 232.059 1.00 0.00 C +ATOM 170 CA GLY A 170 273.392 273.100 232.676 1.00 0.00 C +ATOM 171 CA SER A 171 275.611 274.097 229.744 1.00 0.00 C +ATOM 172 CA SER A 172 274.993 272.209 226.492 1.00 0.00 C +ATOM 173 CA SER A 173 275.971 272.692 222.842 1.00 0.00 C +ATOM 174 CA GLY A 174 274.439 272.761 219.354 1.00 0.00 C +ATOM 175 CA SER A 175 273.934 270.694 216.194 1.00 0.00 C +ATOM 176 CA ASP A 176 274.452 268.959 212.841 1.00 0.00 C +ATOM 177 CA SER A 177 276.974 268.639 210.003 1.00 0.00 C +ATOM 178 CA ASP A 178 278.200 268.402 206.404 1.00 0.00 C +TER 179 ASP A 178 +END diff --git a/Plants/Q9C7Y9/Q9C7Y9.dcd b/Plants/Q9C7Y9/Q9C7Y9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..0d6efe25ed6e19ffc2fdbd8a28b31b65ffb6c28d --- /dev/null +++ b/Plants/Q9C7Y9/Q9C7Y9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5ed2c81dc9125a138ac08643757e32730f7fba0aec61bcb66377e15cc430cc8c +size 36840276 diff --git a/Plants/Q9C7Y9/top.pdb b/Plants/Q9C7Y9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..abf84f540fe9f776856eb26dc6581365b304aa83 --- /dev/null +++ b/Plants/Q9C7Y9/top.pdb @@ -0,0 +1,202 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 257.391 251.292 253.033 1.00 0.00 C +ATOM 2 CA THR A 2 257.445 252.830 249.547 1.00 0.00 C +ATOM 3 CA GLY A 3 254.388 253.031 247.283 1.00 0.00 C +ATOM 4 CA VAL A 4 255.183 254.877 244.047 1.00 0.00 C +ATOM 5 CA ASN A 5 256.465 255.997 240.638 1.00 0.00 C +ATOM 6 CA ASP A 6 259.776 257.876 240.789 1.00 0.00 C +ATOM 7 CA ASP A 7 262.631 255.432 241.411 1.00 0.00 C +ATOM 8 CA ASP A 8 262.287 252.341 243.613 1.00 0.00 C +ATOM 9 CA ASP A 9 262.653 248.923 245.255 1.00 0.00 C +ATOM 10 CA LYS A 10 262.390 245.948 242.890 1.00 0.00 C +ATOM 11 CA ASN A 11 261.991 245.393 239.141 1.00 0.00 C +ATOM 12 CA PHE A 12 262.151 245.473 235.336 1.00 0.00 C +ATOM 13 CA LYS A 13 265.177 243.842 233.693 1.00 0.00 C +ATOM 14 CA GLU A 14 268.267 242.529 235.494 1.00 0.00 C +ATOM 15 CA GLU A 15 271.430 244.524 236.223 1.00 0.00 C +ATOM 16 CA PRO A 16 270.521 248.193 236.703 1.00 0.00 C +ATOM 17 CA GLU A 17 267.219 249.725 237.826 1.00 0.00 C +ATOM 18 CA ILE A 18 266.497 252.473 235.287 1.00 0.00 C +ATOM 19 CA GLN A 19 265.889 255.224 232.723 1.00 0.00 C +ATOM 20 CA VAL A 20 266.099 259.028 232.734 1.00 0.00 C +ATOM 21 CA LEU A 21 266.712 262.700 231.922 1.00 0.00 C +ATOM 22 CA SER A 22 264.837 265.748 233.230 1.00 0.00 C +ATOM 23 CA ASP A 23 262.636 267.070 230.416 1.00 0.00 C +ATOM 24 CA ASP A 24 263.699 270.502 229.148 1.00 0.00 C +ATOM 25 CA ASP A 25 265.737 273.645 229.849 1.00 0.00 C +ATOM 26 CA SER A 26 266.149 276.881 231.817 1.00 0.00 C +ATOM 27 CA ASP A 27 264.307 278.988 234.402 1.00 0.00 C +ATOM 28 CA GLU A 28 262.470 277.672 237.469 1.00 0.00 C +ATOM 29 CA GLU A 29 258.746 278.400 237.808 1.00 0.00 C +ATOM 30 CA GLN A 30 258.001 279.051 241.487 1.00 0.00 C +ATOM 31 CA VAL A 31 254.221 279.498 241.649 1.00 0.00 C +ATOM 32 CA LYS A 32 252.510 280.982 244.713 1.00 0.00 C +ATOM 33 CA ASP A 33 251.923 279.814 248.292 1.00 0.00 C +ATOM 34 CA VAL A 34 253.541 279.008 251.645 1.00 0.00 C +ATOM 35 CA GLY A 35 255.326 280.936 254.404 1.00 0.00 C +ATOM 36 CA GLU A 36 253.791 284.228 255.552 1.00 0.00 C +ATOM 37 CA GLU A 37 250.950 284.386 258.086 1.00 0.00 C +ATOM 38 CA VAL A 38 250.427 286.422 261.264 1.00 0.00 C +ATOM 39 CA SER A 39 251.794 288.723 263.976 1.00 0.00 C +ATOM 40 CA ASP A 40 252.726 290.807 267.026 1.00 0.00 C +ATOM 41 CA GLU A 41 254.446 290.069 270.345 1.00 0.00 C +ATOM 42 CA ASP A 42 255.718 287.717 273.059 1.00 0.00 C +ATOM 43 CA ASP A 43 258.061 284.811 272.295 1.00 0.00 C +ATOM 44 CA ASP A 44 261.724 283.886 272.787 1.00 0.00 C +ATOM 45 CA ASP A 45 263.181 281.720 275.562 1.00 0.00 C +ATOM 46 CA GLY A 46 261.566 281.687 279.012 1.00 0.00 C +ATOM 47 CA SER A 47 259.976 279.691 281.842 1.00 0.00 C +ATOM 48 CA GLU A 48 257.689 276.723 282.528 1.00 0.00 C +ATOM 49 CA GLY A 49 258.101 273.044 281.626 1.00 0.00 C +ATOM 50 CA ASP A 50 259.025 269.368 282.013 1.00 0.00 C +ATOM 51 CA ASP A 51 260.850 268.007 285.068 1.00 0.00 C +ATOM 52 CA ASP A 52 263.999 266.372 286.457 1.00 0.00 C +ATOM 53 CA ASP A 53 265.055 262.764 287.072 1.00 0.00 C +ATOM 54 CA ASP A 54 265.702 260.042 289.659 1.00 0.00 C +ATOM 55 CA GLU A 55 265.831 256.237 289.810 1.00 0.00 C +ATOM 56 CA GLU A 56 266.061 254.921 286.242 1.00 0.00 C +ATOM 57 CA GLU A 57 265.856 254.608 282.450 1.00 0.00 C +ATOM 58 CA GLU A 58 263.763 253.029 279.685 1.00 0.00 C +ATOM 59 CA GLU A 59 261.479 250.212 278.518 1.00 0.00 C +ATOM 60 CA ASP A 60 257.984 251.014 279.808 1.00 0.00 C +ATOM 61 CA ASP A 61 257.440 253.564 282.587 1.00 0.00 C +ATOM 62 CA ASP A 62 253.700 253.729 283.296 1.00 0.00 C +ATOM 63 CA ASP A 63 252.241 257.109 282.313 1.00 0.00 C +ATOM 64 CA ASP A 64 249.752 256.978 279.431 1.00 0.00 C +ATOM 65 CA ASP A 65 250.079 258.374 275.901 1.00 0.00 C +ATOM 66 CA ASP A 66 246.639 258.070 274.292 1.00 0.00 C +ATOM 67 CA VAL A 67 245.686 261.220 272.372 1.00 0.00 C +ATOM 68 CA GLN A 68 245.720 261.870 268.618 1.00 0.00 C +ATOM 69 CA VAL A 69 244.086 264.934 267.051 1.00 0.00 C +ATOM 70 CA LEU A 70 246.556 266.432 264.568 1.00 0.00 C +ATOM 71 CA GLN A 71 246.862 265.414 260.909 1.00 0.00 C +ATOM 72 CA SER A 72 243.934 263.072 260.236 1.00 0.00 C +ATOM 73 CA LEU A 73 240.371 262.672 258.946 1.00 0.00 C +ATOM 74 CA GLY A 74 239.053 261.970 255.441 1.00 0.00 C +ATOM 75 CA GLY A 75 237.395 259.709 252.862 1.00 0.00 C +ATOM 76 CA PRO A 76 237.810 256.125 251.636 1.00 0.00 C +ATOM 77 CA PRO A 77 237.499 253.515 254.394 1.00 0.00 C +ATOM 78 CA VAL A 78 234.855 250.816 254.885 1.00 0.00 C +ATOM 79 CA GLN A 79 231.467 249.610 256.143 1.00 0.00 C +ATOM 80 CA SER A 80 227.995 250.790 257.177 1.00 0.00 C +ATOM 81 CA ALA A 81 225.112 253.240 257.626 1.00 0.00 C +ATOM 82 CA GLU A 82 222.479 253.391 254.877 1.00 0.00 C +ATOM 83 CA ASP A 83 223.423 250.630 252.427 1.00 0.00 C +ATOM 84 CA GLU A 84 223.619 250.990 248.639 1.00 0.00 C +ATOM 85 CA ASP A 85 225.445 253.116 246.057 1.00 0.00 C +ATOM 86 CA GLU A 86 228.710 251.297 245.317 1.00 0.00 C +ATOM 87 CA GLU A 87 230.447 248.136 244.090 1.00 0.00 C +ATOM 88 CA GLY A 88 228.719 244.968 245.313 1.00 0.00 C +ATOM 89 CA ASP A 89 226.312 243.028 243.087 1.00 0.00 C +ATOM 90 CA GLU A 90 226.011 239.317 243.897 1.00 0.00 C +ATOM 91 CA ASP A 91 224.709 238.687 247.422 1.00 0.00 C +ATOM 92 CA GLY A 92 226.709 237.125 250.264 1.00 0.00 C +ATOM 93 CA ASN A 93 226.462 233.599 251.686 1.00 0.00 C +ATOM 94 CA GLY A 94 225.291 233.324 255.301 1.00 0.00 C +ATOM 95 CA ASP A 95 226.277 236.037 257.787 1.00 0.00 C +ATOM 96 CA ASP A 96 229.726 236.402 259.363 1.00 0.00 C +ATOM 97 CA ASP A 97 232.479 236.593 261.991 1.00 0.00 C +ATOM 98 CA ASP A 98 235.297 239.026 261.183 1.00 0.00 C +ATOM 99 CA ASP A 99 237.772 240.800 263.473 1.00 0.00 C +ATOM 100 CA ASP A 100 240.094 239.143 265.999 1.00 0.00 C +ATOM 101 CA GLY A 101 243.209 241.244 266.635 1.00 0.00 C +ATOM 102 CA ASP A 102 244.829 241.876 270.025 1.00 0.00 C +ATOM 103 CA ASP A 103 247.411 244.621 269.462 1.00 0.00 C +ATOM 104 CA ASP A 104 249.954 244.574 266.625 1.00 0.00 C +ATOM 105 CA ASP A 105 252.877 242.393 267.727 1.00 0.00 C +ATOM 106 CA ASP A 106 255.863 240.519 266.283 1.00 0.00 C +ATOM 107 CA ASP A 107 256.305 238.681 262.975 1.00 0.00 C +ATOM 108 CA ASP A 108 259.547 238.419 260.991 1.00 0.00 C +ATOM 109 CA ASP A 109 262.723 238.976 263.021 1.00 0.00 C +ATOM 110 CA ASP A 110 264.046 241.468 265.582 1.00 0.00 C +ATOM 111 CA GLU A 111 264.380 245.200 264.892 1.00 0.00 C +ATOM 112 CA ASP A 112 264.617 248.966 264.365 1.00 0.00 C +ATOM 113 CA GLU A 113 261.355 250.758 263.550 1.00 0.00 C +ATOM 114 CA ASP A 114 257.958 251.968 262.320 1.00 0.00 C +ATOM 115 CA VAL A 115 254.259 252.822 262.638 1.00 0.00 C +ATOM 116 CA GLU A 116 250.730 253.950 261.747 1.00 0.00 C +ATOM 117 CA ASP A 117 250.156 252.819 258.155 1.00 0.00 C +ATOM 118 CA GLU A 118 251.879 253.722 254.879 1.00 0.00 C +ATOM 119 CA GLY A 119 249.302 253.180 252.125 1.00 0.00 C +ATOM 120 CA ASP A 120 248.733 256.646 250.648 1.00 0.00 C +ATOM 121 CA LEU A 121 248.370 257.883 247.063 1.00 0.00 C +ATOM 122 CA GLY A 122 247.814 255.327 244.292 1.00 0.00 C +ATOM 123 CA THR A 123 247.575 254.183 240.666 1.00 0.00 C +ATOM 124 CA GLU A 124 247.829 250.381 240.670 1.00 0.00 C +ATOM 125 CA TYR A 125 244.743 249.096 242.499 1.00 0.00 C +ATOM 126 CA LEU A 126 242.897 245.797 242.030 1.00 0.00 C +ATOM 127 CA VAL A 127 243.229 242.612 239.965 1.00 0.00 C +ATOM 128 CA ARG A 128 242.963 239.002 241.156 1.00 0.00 C +ATOM 129 CA PRO A 129 246.526 237.663 240.998 1.00 0.00 C +ATOM 130 CA VAL A 130 249.608 237.780 238.761 1.00 0.00 C +ATOM 131 CA GLY A 131 250.339 235.773 235.605 1.00 0.00 C +ATOM 132 CA ARG A 132 253.436 233.983 234.294 1.00 0.00 C +ATOM 133 CA ALA A 133 256.464 231.682 234.521 1.00 0.00 C +ATOM 134 CA GLU A 134 258.124 229.760 237.361 1.00 0.00 C +ATOM 135 CA ASP A 135 256.253 227.494 239.787 1.00 0.00 C +ATOM 136 CA GLU A 136 257.296 223.860 239.317 1.00 0.00 C +ATOM 137 CA GLU A 137 255.738 220.793 237.679 1.00 0.00 C +ATOM 138 CA ASP A 138 256.979 220.302 234.111 1.00 0.00 C +ATOM 139 CA ALA A 139 254.684 219.973 231.087 1.00 0.00 C +ATOM 140 CA SER A 140 253.285 218.686 227.785 1.00 0.00 C +ATOM 141 CA ASP A 141 252.356 217.629 224.245 1.00 0.00 C +ATOM 142 CA PHE A 142 253.154 218.983 220.774 1.00 0.00 C +ATOM 143 CA GLU A 143 253.857 218.900 217.031 1.00 0.00 C +ATOM 144 CA PRO A 144 254.843 222.311 215.648 1.00 0.00 C +ATOM 145 CA GLU A 145 256.387 225.161 217.651 1.00 0.00 C +ATOM 146 CA GLU A 146 256.298 226.440 221.239 1.00 0.00 C +ATOM 147 CA ASN A 147 253.355 227.497 223.416 1.00 0.00 C +ATOM 148 CA GLY A 148 250.680 227.306 226.122 1.00 0.00 C +ATOM 149 CA VAL A 149 248.218 228.118 228.914 1.00 0.00 C +ATOM 150 CA GLU A 150 244.446 227.793 229.340 1.00 0.00 C +ATOM 151 CA GLU A 151 240.776 227.350 230.265 1.00 0.00 C +ATOM 152 CA ASP A 152 239.777 223.677 230.110 1.00 0.00 C +ATOM 153 CA ILE A 153 240.166 222.437 233.691 1.00 0.00 C +ATOM 154 CA ASP A 154 240.456 219.820 236.445 1.00 0.00 C +ATOM 155 CA GLU A 155 238.686 216.450 236.614 1.00 0.00 C +ATOM 156 CA GLY A 156 235.923 214.566 238.439 1.00 0.00 C +ATOM 157 CA GLU A 157 233.535 216.426 240.754 1.00 0.00 C +ATOM 158 CA ASP A 158 234.879 219.403 242.715 1.00 0.00 C +ATOM 159 CA ASP A 159 237.048 222.419 241.872 1.00 0.00 C +ATOM 160 CA GLU A 160 239.801 224.875 242.823 1.00 0.00 C +ATOM 161 CA ASN A 161 238.742 228.111 244.532 1.00 0.00 C +ATOM 162 CA ASP A 162 237.292 231.480 245.563 1.00 0.00 C +ATOM 163 CA ASN A 163 238.651 235.034 245.354 1.00 0.00 C +ATOM 164 CA SER A 164 237.425 237.798 247.672 1.00 0.00 C +ATOM 165 CA GLY A 165 238.649 240.376 250.196 1.00 0.00 C +ATOM 166 CA GLY A 166 237.699 241.840 253.583 1.00 0.00 C +ATOM 167 CA ALA A 167 239.202 240.071 256.604 1.00 0.00 C +ATOM 168 CA GLY A 168 242.907 240.281 257.468 1.00 0.00 C +ATOM 169 CA LYS A 169 245.970 242.334 256.509 1.00 0.00 C +ATOM 170 CA SER A 170 249.607 241.975 257.586 1.00 0.00 C +ATOM 171 CA GLU A 171 251.306 238.601 257.091 1.00 0.00 C +ATOM 172 CA ALA A 172 254.755 237.014 257.405 1.00 0.00 C +ATOM 173 CA PRO A 173 255.531 235.174 254.160 1.00 0.00 C +ATOM 174 CA PRO A 174 256.240 237.459 251.194 1.00 0.00 C +ATOM 175 CA LYS A 175 256.006 240.940 249.664 1.00 0.00 C +ATOM 176 CA ARG A 176 253.304 243.296 250.955 1.00 0.00 C +ATOM 177 CA LYS A 177 250.592 243.389 248.281 1.00 0.00 C +ATOM 178 CA ARG A 178 251.482 246.145 245.806 1.00 0.00 C +ATOM 179 CA ALA A 179 255.079 246.791 244.727 1.00 0.00 C +ATOM 180 CA PRO A 180 255.270 246.452 240.937 1.00 0.00 C +ATOM 181 CA GLU A 181 253.918 244.460 237.984 1.00 0.00 C +ATOM 182 CA GLU A 182 251.572 244.061 235.009 1.00 0.00 C +ATOM 183 CA ASP A 183 248.324 243.986 233.018 1.00 0.00 C +ATOM 184 CA GLU A 184 248.153 244.411 229.236 1.00 0.00 C +ATOM 185 CA GLU A 185 249.390 245.540 225.814 1.00 0.00 C +ATOM 186 CA ASP A 186 249.875 248.516 223.485 1.00 0.00 C +ATOM 187 CA SER A 187 249.756 252.086 224.811 1.00 0.00 C +ATOM 188 CA GLY A 188 247.922 254.693 226.898 1.00 0.00 C +ATOM 189 CA ASP A 189 249.615 257.858 228.175 1.00 0.00 C +ATOM 190 CA GLU A 190 249.287 261.634 228.561 1.00 0.00 C +ATOM 191 CA ASP A 191 247.385 264.884 229.145 1.00 0.00 C +ATOM 192 CA ASP A 192 244.444 264.527 231.540 1.00 0.00 C +ATOM 193 CA ASP A 193 242.343 262.796 234.206 1.00 0.00 C +ATOM 194 CA ARG A 194 241.164 262.716 237.828 1.00 0.00 C +ATOM 195 CA PRO A 195 244.056 261.918 240.177 1.00 0.00 C +ATOM 196 CA PRO A 196 247.058 262.201 242.506 1.00 0.00 C +ATOM 197 CA LYS A 197 250.555 263.299 241.465 1.00 0.00 C +ATOM 198 CA ARG A 198 253.899 262.300 239.938 1.00 0.00 C +TER 199 ARG A 198 +END diff --git a/Plants/Q9FGU5/Q9FGU5.dcd b/Plants/Q9FGU5/Q9FGU5.dcd new file mode 100644 index 0000000000000000000000000000000000000000..505a517a8f606d3fb067f3295b0e6cb6ec8beefd --- /dev/null +++ b/Plants/Q9FGU5/Q9FGU5.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5dec65cc4b2efa526061e8aa512496c1b6af1cb94e05a242032340a7e4f2737e +size 17000276 diff --git a/Plants/Q9FGU5/top.pdb b/Plants/Q9FGU5/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..28b228bb5c8971d45e140ba51bb55ba4f97b213b --- /dev/null +++ b/Plants/Q9FGU5/top.pdb @@ -0,0 +1,139 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 200.162 201.582 233.307 1.00 0.00 C +ATOM 2 CA GLU A 2 198.454 204.271 231.218 1.00 0.00 C +ATOM 3 CA GLY A 3 198.187 207.587 233.076 1.00 0.00 C +ATOM 4 CA LYS A 4 196.249 210.275 231.195 1.00 0.00 C +ATOM 5 CA GLY A 5 193.887 213.190 230.534 1.00 0.00 C +ATOM 6 CA ARG A 6 195.889 216.422 230.279 1.00 0.00 C +ATOM 7 CA VAL A 7 198.407 219.239 230.763 1.00 0.00 C +ATOM 8 CA GLY A 8 201.085 221.834 231.544 1.00 0.00 C +ATOM 9 CA SER A 9 200.271 225.484 230.815 1.00 0.00 C +ATOM 10 CA SER A 10 202.268 226.797 227.848 1.00 0.00 C +ATOM 11 CA SER A 11 205.575 228.575 227.200 1.00 0.00 C +ATOM 12 CA SER A 12 208.990 228.898 228.858 1.00 0.00 C +ATOM 13 CA THR A 13 211.621 230.993 227.068 1.00 0.00 C +ATOM 14 CA SER A 14 211.891 229.727 223.484 1.00 0.00 C +ATOM 15 CA SER A 15 213.144 231.921 220.633 1.00 0.00 C +ATOM 16 CA SER A 16 210.881 234.954 220.196 1.00 0.00 C +ATOM 17 CA PHE A 17 207.573 236.558 221.197 1.00 0.00 C +ATOM 18 CA THR A 18 205.137 234.493 223.274 1.00 0.00 C +ATOM 19 CA ALA A 19 203.019 235.161 226.370 1.00 0.00 C +ATOM 20 CA GLU A 20 202.560 238.441 228.253 1.00 0.00 C +ATOM 21 CA LEU A 21 205.028 238.752 231.140 1.00 0.00 C +ATOM 22 CA PHE A 22 206.818 241.509 233.065 1.00 0.00 C +ATOM 23 CA GLY A 23 205.658 243.386 236.171 1.00 0.00 C +ATOM 24 CA SER A 24 206.765 243.271 239.815 1.00 0.00 C +ATOM 25 CA LYS A 25 206.273 240.441 242.319 1.00 0.00 C +ATOM 26 CA ASP A 26 207.613 236.996 243.241 1.00 0.00 C +ATOM 27 CA PRO A 27 209.050 234.202 241.086 1.00 0.00 C +ATOM 28 CA SER A 28 207.280 233.530 237.780 1.00 0.00 C +ATOM 29 CA PRO A 29 206.154 233.279 234.149 1.00 0.00 C +ATOM 30 CA PRO A 30 209.239 234.067 232.056 1.00 0.00 C +ATOM 31 CA SER A 31 212.232 233.172 234.238 1.00 0.00 C +ATOM 32 CA SER A 32 215.910 233.216 235.231 1.00 0.00 C +ATOM 33 CA SER A 33 216.675 233.987 238.882 1.00 0.00 C +ATOM 34 CA SER A 34 216.260 236.312 241.872 1.00 0.00 C +ATOM 35 CA GLY A 35 216.852 235.479 245.542 1.00 0.00 C +ATOM 36 CA ILE A 36 215.653 232.190 247.046 1.00 0.00 C +ATOM 37 CA PHE A 37 214.142 229.131 248.743 1.00 0.00 C +ATOM 38 CA SER A 38 215.409 225.708 249.834 1.00 0.00 C +ATOM 39 CA THR A 39 216.636 225.196 253.405 1.00 0.00 C +ATOM 40 CA MET A 40 217.984 227.951 255.665 1.00 0.00 C +ATOM 41 CA PHE A 41 219.057 231.419 256.820 1.00 0.00 C +ATOM 42 CA PRO A 42 222.337 232.577 255.265 1.00 0.00 C +ATOM 43 CA HIS A 43 225.063 235.193 255.756 1.00 0.00 C +ATOM 44 CA PRO A 44 224.579 237.310 258.886 1.00 0.00 C +ATOM 45 CA SER A 45 222.260 240.252 259.585 1.00 0.00 C +ATOM 46 CA LYS A 46 221.326 243.651 261.031 1.00 0.00 C +ATOM 47 CA GLY A 47 221.267 247.412 260.426 1.00 0.00 C +ATOM 48 CA SER A 48 223.145 250.560 261.463 1.00 0.00 C +ATOM 49 CA ALA A 49 225.186 252.460 258.867 1.00 0.00 C +ATOM 50 CA ARG A 50 227.626 250.146 257.076 1.00 0.00 C +ATOM 51 CA ASP A 51 229.335 248.209 254.275 1.00 0.00 C +ATOM 52 CA GLY A 52 229.585 248.278 250.474 1.00 0.00 C +ATOM 53 CA SER A 53 229.623 251.645 248.690 1.00 0.00 C +ATOM 54 CA ASN A 54 231.793 253.120 245.928 1.00 0.00 C +ATOM 55 CA SER A 55 235.522 253.244 246.699 1.00 0.00 C +ATOM 56 CA LYS A 56 237.679 251.429 244.136 1.00 0.00 C +ATOM 57 CA HIS A 57 238.141 251.405 240.354 1.00 0.00 C +ATOM 58 CA GLY A 58 235.827 250.488 237.469 1.00 0.00 C +ATOM 59 CA SER A 59 237.231 250.240 233.936 1.00 0.00 C +ATOM 60 CA GLN A 60 239.667 251.578 231.331 1.00 0.00 C +ATOM 61 CA ALA A 61 242.856 249.519 231.002 1.00 0.00 C +ATOM 62 CA GLN A 62 242.750 246.144 232.766 1.00 0.00 C +ATOM 63 CA ARG A 63 246.055 244.968 234.253 1.00 0.00 C +ATOM 64 CA ARG A 64 248.713 246.488 236.520 1.00 0.00 C +ATOM 65 CA GLU A 65 247.752 245.492 240.070 1.00 0.00 C +ATOM 66 CA SER A 66 246.669 247.179 243.309 1.00 0.00 C +ATOM 67 CA LEU A 67 249.864 248.699 244.723 1.00 0.00 C +ATOM 68 CA ASN A 68 252.790 251.002 243.914 1.00 0.00 C +ATOM 69 CA ALA A 69 253.586 254.258 245.726 1.00 0.00 C +ATOM 70 CA GLN A 70 256.665 255.568 247.548 1.00 0.00 C +ATOM 71 CA GLU A 71 259.792 254.068 245.972 1.00 0.00 C +ATOM 72 CA ASP A 72 263.199 253.684 247.633 1.00 0.00 C +ATOM 73 CA ARG A 73 265.858 251.275 246.352 1.00 0.00 C +ATOM 74 CA VAL A 74 269.589 251.285 245.578 1.00 0.00 C +ATOM 75 CA GLU A 75 271.773 251.590 248.685 1.00 0.00 C +ATOM 76 CA PRO A 76 272.933 251.229 252.296 1.00 0.00 C +ATOM 77 CA CYS A 77 269.740 250.557 254.264 1.00 0.00 C +ATOM 78 CA HIS A 78 266.421 252.058 255.381 1.00 0.00 C +ATOM 79 CA LEU A 79 265.127 255.483 256.433 1.00 0.00 C +ATOM 80 CA SER A 80 261.516 255.938 257.559 1.00 0.00 C +ATOM 81 CA SER A 81 258.220 254.624 258.946 1.00 0.00 C +ATOM 82 CA SER A 82 258.004 253.877 262.676 1.00 0.00 C +ATOM 83 CA LEU A 83 255.935 254.601 265.792 1.00 0.00 C +ATOM 84 CA TYR A 84 252.343 255.539 266.649 1.00 0.00 C +ATOM 85 CA TYR A 85 252.312 257.797 269.717 1.00 0.00 C +ATOM 86 CA GLY A 86 254.684 260.281 271.367 1.00 0.00 C +ATOM 87 CA GLY A 87 258.339 259.250 271.677 1.00 0.00 C +ATOM 88 CA GLN A 88 261.194 257.601 269.767 1.00 0.00 C +ATOM 89 CA ASP A 89 263.100 259.799 267.308 1.00 0.00 C +ATOM 90 CA VAL A 90 264.188 258.724 263.818 1.00 0.00 C +ATOM 91 CA TYR A 91 267.584 258.483 262.108 1.00 0.00 C +ATOM 92 CA ALA A 92 271.332 258.694 261.456 1.00 0.00 C +ATOM 93 CA ARG A 93 273.164 255.364 261.719 1.00 0.00 C +ATOM 94 CA SER A 94 276.306 253.244 262.109 1.00 0.00 C +ATOM 95 CA THR A 95 277.977 253.109 265.530 1.00 0.00 C +ATOM 96 CA THR A 96 280.678 255.795 265.590 1.00 0.00 C +ATOM 97 CA ASN A 97 281.264 259.514 265.004 1.00 0.00 C +ATOM 98 CA GLN A 98 282.887 262.371 263.076 1.00 0.00 C +ATOM 99 CA THR A 99 284.408 263.603 259.807 1.00 0.00 C +ATOM 100 CA TYR A 100 286.270 262.201 256.793 1.00 0.00 C +ATOM 101 CA PRO A 101 289.755 260.867 257.559 1.00 0.00 C +ATOM 102 CA PRO A 102 291.811 261.054 254.357 1.00 0.00 C +ATOM 103 CA VAL A 103 294.849 263.141 255.321 1.00 0.00 C +ATOM 104 CA LYS A 104 298.510 262.996 254.273 1.00 0.00 C +ATOM 105 CA ASN A 105 301.478 264.779 255.863 1.00 0.00 C +ATOM 106 CA ASP A 106 302.264 268.347 254.782 1.00 0.00 C +ATOM 107 CA ARG A 107 305.841 269.528 255.354 1.00 0.00 C +ATOM 108 CA ARG A 108 307.696 270.631 258.494 1.00 0.00 C +ATOM 109 CA ARG A 109 307.575 267.620 260.825 1.00 0.00 C +ATOM 110 CA SER A 110 305.800 265.477 263.428 1.00 0.00 C +ATOM 111 CA GLY A 111 303.646 265.236 266.561 1.00 0.00 C +ATOM 112 CA GLU A 112 299.897 265.678 266.047 1.00 0.00 C +ATOM 113 CA ASP A 113 296.601 263.767 266.001 1.00 0.00 C +ATOM 114 CA ASP A 114 294.412 263.999 269.111 1.00 0.00 C +ATOM 115 CA ALA A 115 292.034 266.919 268.528 1.00 0.00 C +ATOM 116 CA ASN A 116 290.081 269.693 266.794 1.00 0.00 C +ATOM 117 CA GLY A 117 291.959 270.417 263.559 1.00 0.00 C +ATOM 118 CA GLN A 118 289.941 272.014 260.751 1.00 0.00 C +ATOM 119 CA ASN A 119 289.338 272.303 257.000 1.00 0.00 C +ATOM 120 CA PRO A 120 288.403 274.604 254.110 1.00 0.00 C +ATOM 121 CA GLN A 121 291.388 274.934 251.765 1.00 0.00 C +ATOM 122 CA ASP A 122 293.505 277.404 249.783 1.00 0.00 C +ATOM 123 CA VAL A 123 295.820 280.430 249.769 1.00 0.00 C +ATOM 124 CA SER A 124 297.961 281.480 252.741 1.00 0.00 C +ATOM 125 CA ARG A 125 298.104 278.951 255.587 1.00 0.00 C +ATOM 126 CA GLY A 126 296.485 277.340 258.636 1.00 0.00 C +ATOM 127 CA ASN A 127 296.796 279.638 261.660 1.00 0.00 C +ATOM 128 CA TRP A 128 296.668 277.482 264.798 1.00 0.00 C +ATOM 129 CA TRP A 129 298.561 274.434 266.081 1.00 0.00 C +ATOM 130 CA GLN A 130 299.256 271.731 268.675 1.00 0.00 C +ATOM 131 CA GLY A 131 297.065 270.559 271.563 1.00 0.00 C +ATOM 132 CA SER A 132 295.233 272.445 274.320 1.00 0.00 C +ATOM 133 CA LEU A 133 291.909 273.955 275.410 1.00 0.00 C +ATOM 134 CA TYR A 134 289.097 274.915 273.026 1.00 0.00 C +ATOM 135 CA TYR A 135 287.295 275.484 269.717 1.00 0.00 C +TER 136 TYR A 135 +END diff --git a/Plants/Q9FH00/Q9FH00.dcd b/Plants/Q9FH00/Q9FH00.dcd new file mode 100644 index 0000000000000000000000000000000000000000..353f4ee126773cc61198ac742ea0bc06d7e3d72f --- /dev/null +++ b/Plants/Q9FH00/Q9FH00.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:dc80ff2fc2f8d88b18e3d47dba1788757123a91043a460db5483f96d6ec8dfa5 +size 14000276 diff --git a/Plants/Q9FH00/top.pdb b/Plants/Q9FH00/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..537d1e1b981dfab7a6e4054e13257946b17477db --- /dev/null +++ b/Plants/Q9FH00/top.pdb @@ -0,0 +1,114 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 259.414 293.366 291.170 1.00 0.00 C +ATOM 2 CA GLU A 2 261.529 294.226 294.219 1.00 0.00 C +ATOM 3 CA LYS A 3 264.916 295.362 292.895 1.00 0.00 C +ATOM 4 CA GLU A 4 266.190 294.770 289.353 1.00 0.00 C +ATOM 5 CA PRO A 5 267.593 291.806 287.414 1.00 0.00 C +ATOM 6 CA LYS A 6 264.868 289.143 287.484 1.00 0.00 C +ATOM 7 CA GLN A 7 261.277 287.881 287.317 1.00 0.00 C +ATOM 8 CA GLU A 8 258.540 288.153 284.681 1.00 0.00 C +ATOM 9 CA PRO A 9 258.619 291.664 283.203 1.00 0.00 C +ATOM 10 CA GLU A 10 255.470 291.862 281.066 1.00 0.00 C +ATOM 11 CA GLU A 11 253.166 288.899 280.413 1.00 0.00 C +ATOM 12 CA GLY A 12 249.559 288.438 279.277 1.00 0.00 C +ATOM 13 CA ARG A 13 247.140 285.727 280.426 1.00 0.00 C +ATOM 14 CA ASP A 14 246.503 283.009 277.833 1.00 0.00 C +ATOM 15 CA LYS A 15 247.863 279.693 276.542 1.00 0.00 C +ATOM 16 CA TYR A 16 248.769 279.433 272.850 1.00 0.00 C +ATOM 17 CA GLU A 17 247.877 277.711 269.570 1.00 0.00 C +ATOM 18 CA PRO A 18 247.984 274.538 267.464 1.00 0.00 C +ATOM 19 CA HIS A 19 245.065 272.141 267.968 1.00 0.00 C +ATOM 20 CA GLN A 20 243.418 270.411 270.936 1.00 0.00 C +ATOM 21 CA HIS A 21 240.620 268.201 272.280 1.00 0.00 C +ATOM 22 CA GLN A 22 236.894 268.500 271.546 1.00 0.00 C +ATOM 23 CA PRO A 23 234.112 266.724 273.450 1.00 0.00 C +ATOM 24 CA PRO A 24 230.758 266.609 275.253 1.00 0.00 C +ATOM 25 CA TYR A 25 228.126 269.313 274.728 1.00 0.00 C +ATOM 26 CA ILE A 26 225.679 268.960 271.829 1.00 0.00 C +ATOM 27 CA SER A 27 224.021 268.029 268.527 1.00 0.00 C +ATOM 28 CA GLN A 28 220.952 268.884 266.437 1.00 0.00 C +ATOM 29 CA MET A 29 219.014 265.617 266.134 1.00 0.00 C +ATOM 30 CA GLN A 30 219.236 262.621 263.791 1.00 0.00 C +ATOM 31 CA PRO A 31 221.719 260.095 262.389 1.00 0.00 C +ATOM 32 CA VAL A 32 221.991 258.728 258.843 1.00 0.00 C +ATOM 33 CA THR A 33 219.111 259.864 256.622 1.00 0.00 C +ATOM 34 CA HIS A 34 218.737 263.182 254.785 1.00 0.00 C +ATOM 35 CA GLU A 35 217.188 266.112 252.908 1.00 0.00 C +ATOM 36 CA ALA A 36 215.795 268.404 255.615 1.00 0.00 C +ATOM 37 CA TYR A 37 218.530 269.247 258.130 1.00 0.00 C +ATOM 38 CA GLY A 38 222.151 270.433 258.158 1.00 0.00 C +ATOM 39 CA GLY A 39 225.791 270.110 257.082 1.00 0.00 C +ATOM 40 CA GLY A 40 229.088 271.363 258.523 1.00 0.00 C +ATOM 41 CA LEU A 41 231.702 268.594 258.662 1.00 0.00 C +ATOM 42 CA TYR A 42 234.017 265.578 258.908 1.00 0.00 C +ATOM 43 CA GLY A 43 233.300 264.036 262.317 1.00 0.00 C +ATOM 44 CA GLN A 44 235.370 265.143 265.319 1.00 0.00 C +ATOM 45 CA ASP A 45 239.045 264.899 266.291 1.00 0.00 C +ATOM 46 CA ASP A 46 242.464 265.397 264.686 1.00 0.00 C +ATOM 47 CA GLU A 47 243.526 267.093 261.443 1.00 0.00 C +ATOM 48 CA LYS A 48 242.709 267.692 257.770 1.00 0.00 C +ATOM 49 CA GLU A 49 243.031 266.919 254.054 1.00 0.00 C +ATOM 50 CA THR A 50 244.361 263.695 252.519 1.00 0.00 C +ATOM 51 CA THR A 51 246.615 260.719 251.761 1.00 0.00 C +ATOM 52 CA ASN A 52 250.401 260.375 252.027 1.00 0.00 C +ATOM 53 CA LEU A 53 253.450 258.091 251.999 1.00 0.00 C +ATOM 54 CA GLU A 54 255.079 257.941 248.558 1.00 0.00 C +ATOM 55 CA LYS A 55 254.724 258.916 244.892 1.00 0.00 C +ATOM 56 CA GLU A 56 257.366 258.552 242.172 1.00 0.00 C +ATOM 57 CA ALA A 57 259.501 255.976 240.350 1.00 0.00 C +ATOM 58 CA LYS A 58 261.685 253.979 237.950 1.00 0.00 C +ATOM 59 CA ASN A 59 264.258 251.181 237.684 1.00 0.00 C +ATOM 60 CA ILE A 60 263.663 248.168 239.939 1.00 0.00 C +ATOM 61 CA GLU A 61 260.620 245.879 239.803 1.00 0.00 C +ATOM 62 CA LYS A 62 256.848 245.837 240.335 1.00 0.00 C +ATOM 63 CA GLU A 63 253.818 246.772 238.223 1.00 0.00 C +ATOM 64 CA PRO A 64 252.714 243.863 236.024 1.00 0.00 C +ATOM 65 CA GLN A 65 249.910 242.094 234.148 1.00 0.00 C +ATOM 66 CA GLN A 66 248.615 240.729 230.835 1.00 0.00 C +ATOM 67 CA GLN A 67 249.984 237.552 229.238 1.00 0.00 C +ATOM 68 CA ARG A 68 250.933 233.960 228.393 1.00 0.00 C +ATOM 69 CA PRO A 69 251.244 232.609 224.844 1.00 0.00 C +ATOM 70 CA PRO A 70 253.222 234.249 222.031 1.00 0.00 C +ATOM 71 CA ALA A 71 251.526 234.490 218.628 1.00 0.00 C +ATOM 72 CA SER A 72 248.696 237.013 219.004 1.00 0.00 C +ATOM 73 CA ASP A 73 249.806 240.524 219.983 1.00 0.00 C +ATOM 74 CA THR A 74 247.895 242.846 217.644 1.00 0.00 C +ATOM 75 CA GLN A 75 244.107 242.967 217.258 1.00 0.00 C +ATOM 76 CA SER A 76 242.541 239.697 216.087 1.00 0.00 C +ATOM 77 CA ALA A 77 241.615 236.935 218.542 1.00 0.00 C +ATOM 78 CA ASP A 78 240.234 235.864 221.928 1.00 0.00 C +ATOM 79 CA GLY A 79 238.838 233.466 224.538 1.00 0.00 C +ATOM 80 CA PRO A 80 238.373 231.505 227.772 1.00 0.00 C +ATOM 81 CA ASP A 81 240.020 231.029 231.174 1.00 0.00 C +ATOM 82 CA GLU A 82 243.078 232.443 232.954 1.00 0.00 C +ATOM 83 CA VAL A 83 245.443 233.900 235.561 1.00 0.00 C +ATOM 84 CA LYS A 84 248.850 232.698 236.773 1.00 0.00 C +ATOM 85 CA THR A 85 252.070 230.668 236.918 1.00 0.00 C +ATOM 86 CA LEU A 86 252.547 228.387 233.904 1.00 0.00 C +ATOM 87 CA THR A 87 255.554 228.338 231.565 1.00 0.00 C +ATOM 88 CA PRO A 88 259.002 227.022 232.512 1.00 0.00 C +ATOM 89 CA LYS A 89 259.648 223.724 230.717 1.00 0.00 C +ATOM 90 CA HIS A 90 261.279 221.466 233.318 1.00 0.00 C +ATOM 91 CA LYS A 91 264.388 222.934 234.959 1.00 0.00 C +ATOM 92 CA GLN A 92 267.466 224.506 233.356 1.00 0.00 C +ATOM 93 CA PRO A 93 270.748 222.602 233.011 1.00 0.00 C +ATOM 94 CA ALA A 94 274.536 222.659 233.412 1.00 0.00 C +ATOM 95 CA SER A 95 276.032 219.497 231.901 1.00 0.00 C +ATOM 96 CA SER A 96 276.080 216.325 229.793 1.00 0.00 C +ATOM 97 CA GLY A 97 277.125 214.376 226.690 1.00 0.00 C +ATOM 98 CA ASP A 98 277.904 210.675 227.151 1.00 0.00 C +ATOM 99 CA ARG A 99 280.870 209.334 229.130 1.00 0.00 C +ATOM 100 CA ASP A 100 280.988 205.696 230.255 1.00 0.00 C +ATOM 101 CA VAL A 101 281.027 202.217 231.809 1.00 0.00 C +ATOM 102 CA ASP A 102 280.318 201.825 235.532 1.00 0.00 C +ATOM 103 CA ILE A 103 276.722 202.944 236.109 1.00 0.00 C +ATOM 104 CA THR A 104 274.492 201.317 233.482 1.00 0.00 C +ATOM 105 CA GLY A 105 273.139 198.079 234.965 1.00 0.00 C +ATOM 106 CA GLN A 106 269.718 196.665 235.866 1.00 0.00 C +ATOM 107 CA SER A 107 269.745 195.508 239.496 1.00 0.00 C +ATOM 108 CA TYR A 108 268.993 197.154 242.849 1.00 0.00 C +ATOM 109 CA ILE A 109 266.226 198.339 245.184 1.00 0.00 C +ATOM 110 CA GLN A 110 262.909 196.646 245.988 1.00 0.00 C +TER 111 GLN A 110 +END diff --git a/Plants/Q9FLJ3/Q9FLJ3.dcd b/Plants/Q9FLJ3/Q9FLJ3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..bd9b47c4067dd56fef242206ba1aa9c57b83b0b6 --- /dev/null +++ b/Plants/Q9FLJ3/Q9FLJ3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f4ccaaa5773b5ae0ddc6104a4b4171b1323eeac28d2bc09cf8152ad6bda6cb14 +size 10040276 diff --git a/Plants/Q9FLJ3/top.pdb b/Plants/Q9FLJ3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..d94e832e278823b73f6047de7010ffacdd96de6d --- /dev/null +++ b/Plants/Q9FLJ3/top.pdb @@ -0,0 +1,81 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 287.409 283.506 240.833 1.00 0.00 C +ATOM 2 CA SER A 2 284.676 281.127 242.009 1.00 0.00 C +ATOM 3 CA GLY A 3 280.930 281.769 242.277 1.00 0.00 C +ATOM 4 CA LYS A 4 277.972 281.197 239.944 1.00 0.00 C +ATOM 5 CA ARG A 5 275.891 284.260 239.049 1.00 0.00 C +ATOM 6 CA SER A 6 276.291 287.944 238.162 1.00 0.00 C +ATOM 7 CA ASN A 7 274.818 290.862 240.120 1.00 0.00 C +ATOM 8 CA VAL A 8 272.262 290.998 242.942 1.00 0.00 C +ATOM 9 CA GLY A 9 272.709 291.562 246.684 1.00 0.00 C +ATOM 10 CA GLY A 10 274.251 288.353 248.041 1.00 0.00 C +ATOM 11 CA GLY A 11 274.712 284.690 247.098 1.00 0.00 C +ATOM 12 CA LYS A 12 273.980 281.217 245.713 1.00 0.00 C +ATOM 13 CA SER A 13 272.340 277.927 244.714 1.00 0.00 C +ATOM 14 CA GLY A 14 268.552 278.189 244.401 1.00 0.00 C +ATOM 15 CA GLY A 15 265.536 279.549 242.511 1.00 0.00 C +ATOM 16 CA ALA A 16 264.153 276.718 240.368 1.00 0.00 C +ATOM 17 CA GLY A 17 262.406 273.472 239.404 1.00 0.00 C +ATOM 18 CA GLY A 18 260.582 270.643 237.619 1.00 0.00 C +ATOM 19 CA LYS A 19 260.882 270.733 233.822 1.00 0.00 C +ATOM 20 CA SER A 20 262.399 273.417 231.583 1.00 0.00 C +ATOM 21 CA GLY A 21 265.376 272.519 229.381 1.00 0.00 C +ATOM 22 CA GLY A 22 266.872 269.063 229.955 1.00 0.00 C +ATOM 23 CA GLY A 23 264.328 266.369 230.843 1.00 0.00 C +ATOM 24 CA GLY A 24 263.562 263.742 233.494 1.00 0.00 C +ATOM 25 CA GLN A 25 262.113 260.372 232.466 1.00 0.00 C +ATOM 26 CA SER A 26 258.819 259.929 230.605 1.00 0.00 C +ATOM 27 CA SER A 27 255.349 261.484 230.844 1.00 0.00 C +ATOM 28 CA GLY A 28 252.886 260.788 228.021 1.00 0.00 C +ATOM 29 CA GLY A 29 251.898 257.145 228.540 1.00 0.00 C +ATOM 30 CA GLY A 30 248.480 256.940 230.209 1.00 0.00 C +ATOM 31 CA LYS A 31 247.348 256.715 233.840 1.00 0.00 C +ATOM 32 CA SER A 32 245.621 253.965 235.833 1.00 0.00 C +ATOM 33 CA GLY A 33 243.493 252.716 238.736 1.00 0.00 C +ATOM 34 CA GLY A 34 241.276 249.631 238.453 1.00 0.00 C +ATOM 35 CA GLY A 35 241.012 246.011 239.611 1.00 0.00 C +ATOM 36 CA GLY A 36 240.031 243.300 242.102 1.00 0.00 C +ATOM 37 CA ALA A 37 237.878 242.693 245.186 1.00 0.00 C +ATOM 38 CA GLY A 38 238.217 240.194 248.042 1.00 0.00 C +ATOM 39 CA ALA A 39 235.377 237.660 248.204 1.00 0.00 C +ATOM 40 CA GLY A 40 233.461 235.364 250.565 1.00 0.00 C +ATOM 41 CA ASN A 41 229.799 235.140 251.590 1.00 0.00 C +ATOM 42 CA MET A 42 226.978 233.551 249.582 1.00 0.00 C +ATOM 43 CA VAL A 43 226.655 231.153 246.639 1.00 0.00 C +ATOM 44 CA ALA A 44 225.955 227.830 244.911 1.00 0.00 C +ATOM 45 CA PRO A 45 227.809 224.508 245.115 1.00 0.00 C +ATOM 46 CA GLY A 46 230.620 223.267 247.367 1.00 0.00 C +ATOM 47 CA THR A 47 233.321 225.112 249.321 1.00 0.00 C +ATOM 48 CA ASN A 48 235.124 224.813 252.664 1.00 0.00 C +ATOM 49 CA GLY A 49 238.460 223.604 254.051 1.00 0.00 C +ATOM 50 CA GLY A 50 242.138 224.531 254.415 1.00 0.00 C +ATOM 51 CA ALA A 51 242.863 228.271 254.417 1.00 0.00 C +ATOM 52 CA TYR A 52 245.689 228.736 256.931 1.00 0.00 C +ATOM 53 CA ILE A 53 247.923 230.035 259.731 1.00 0.00 C +ATOM 54 CA SER A 54 248.744 233.752 259.578 1.00 0.00 C +ATOM 55 CA ARG A 55 247.837 237.434 259.209 1.00 0.00 C +ATOM 56 CA GLY A 56 246.477 240.964 259.669 1.00 0.00 C +ATOM 57 CA GLY A 57 245.100 242.289 256.373 1.00 0.00 C +ATOM 58 CA PHE A 58 242.009 243.739 254.683 1.00 0.00 C +ATOM 59 CA GLU A 59 238.391 242.820 253.922 1.00 0.00 C +ATOM 60 CA SER A 60 235.003 241.199 254.567 1.00 0.00 C +ATOM 61 CA ASN A 61 233.208 238.211 256.104 1.00 0.00 C +ATOM 62 CA PRO A 62 233.963 234.682 257.325 1.00 0.00 C +ATOM 63 CA GLN A 63 233.998 234.808 261.133 1.00 0.00 C +ATOM 64 CA GLY A 64 235.798 231.874 262.767 1.00 0.00 C +ATOM 65 CA TYR A 65 239.007 231.015 260.902 1.00 0.00 C +ATOM 66 CA PHE A 66 242.543 231.356 262.281 1.00 0.00 C +ATOM 67 CA SER A 67 243.217 229.747 265.668 1.00 0.00 C +ATOM 68 CA ASN A 68 244.240 231.120 269.072 1.00 0.00 C +ATOM 69 CA LEU A 69 242.574 231.531 272.474 1.00 0.00 C +ATOM 70 CA HIS A 70 243.284 230.931 276.169 1.00 0.00 C +ATOM 71 CA GLY A 71 240.371 231.626 278.524 1.00 0.00 C +ATOM 72 CA SER A 72 238.756 229.023 280.789 1.00 0.00 C +ATOM 73 CA GLY A 73 237.893 226.175 283.168 1.00 0.00 C +ATOM 74 CA GLN A 74 235.957 224.986 286.226 1.00 0.00 C +ATOM 75 CA SER A 75 237.585 221.972 287.894 1.00 0.00 C +ATOM 76 CA LYS A 76 237.776 218.202 287.377 1.00 0.00 C +ATOM 77 CA LYS A 77 236.787 215.258 285.171 1.00 0.00 C +TER 78 LYS A 77 +END diff --git a/Plants/Q9FM74/Q9FM74.dcd b/Plants/Q9FM74/Q9FM74.dcd new file mode 100644 index 0000000000000000000000000000000000000000..dfc3d366543143237579752cccf3b71ea2a14372 --- /dev/null +++ b/Plants/Q9FM74/Q9FM74.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:fc2fd1ebf9a4adcc08fecb43b495fc2f029bfe852d61754f76660863ff00afc6 +size 18680276 diff --git a/Plants/Q9FM74/top.pdb b/Plants/Q9FM74/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..cc70bc1ac7c69847f15a82f003a78ab13e37847f --- /dev/null +++ b/Plants/Q9FM74/top.pdb @@ -0,0 +1,153 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 241.132 214.650 249.590 1.00 0.00 C +ATOM 2 CA ASP A 2 238.002 215.874 247.796 1.00 0.00 C +ATOM 3 CA THR A 3 236.606 218.578 250.088 1.00 0.00 C +ATOM 4 CA SER A 4 233.003 218.499 251.326 1.00 0.00 C +ATOM 5 CA VAL A 5 230.534 221.366 250.884 1.00 0.00 C +ATOM 6 CA MET A 6 230.251 223.781 253.816 1.00 0.00 C +ATOM 7 CA GLN A 7 233.159 226.212 253.430 1.00 0.00 C +ATOM 8 CA THR A 8 235.279 228.106 255.967 1.00 0.00 C +ATOM 9 CA ASN A 9 235.837 230.689 258.711 1.00 0.00 C +ATOM 10 CA LEU A 10 233.600 233.701 258.046 1.00 0.00 C +ATOM 11 CA PRO A 11 231.683 235.440 260.841 1.00 0.00 C +ATOM 12 CA LYS A 12 231.198 239.144 260.091 1.00 0.00 C +ATOM 13 CA VAL A 13 234.047 241.289 258.749 1.00 0.00 C +ATOM 14 CA GLU A 14 236.708 243.915 258.014 1.00 0.00 C +ATOM 15 CA ASP A 15 237.397 243.520 254.288 1.00 0.00 C +ATOM 16 CA ASN A 16 236.317 240.299 252.563 1.00 0.00 C +ATOM 17 CA ASP A 17 238.741 237.361 252.627 1.00 0.00 C +ATOM 18 CA GLU A 18 241.375 236.624 255.279 1.00 0.00 C +ATOM 19 CA TRP A 19 243.363 233.460 254.537 1.00 0.00 C +ATOM 20 CA ASP A 20 246.260 232.670 256.883 1.00 0.00 C +ATOM 21 CA THR A 21 248.238 229.562 257.857 1.00 0.00 C +ATOM 22 CA ASP A 22 248.157 229.470 261.665 1.00 0.00 C +ATOM 23 CA GLY A 23 250.994 228.535 264.029 1.00 0.00 C +ATOM 24 CA PHE A 24 252.338 226.096 266.630 1.00 0.00 C +ATOM 25 CA VAL A 25 250.409 222.817 266.423 1.00 0.00 C +ATOM 26 CA ILE A 26 252.331 219.630 267.239 1.00 0.00 C +ATOM 27 CA PRO A 27 255.794 220.526 268.552 1.00 0.00 C +ATOM 28 CA SER A 28 258.961 221.758 270.274 1.00 0.00 C +ATOM 29 CA LEU A 29 259.344 225.533 269.922 1.00 0.00 C +ATOM 30 CA GLU A 30 259.227 228.987 268.319 1.00 0.00 C +ATOM 31 CA ILE A 31 262.433 230.311 266.744 1.00 0.00 C +ATOM 32 CA GLU A 32 263.163 233.851 267.950 1.00 0.00 C +ATOM 33 CA GLU A 33 264.306 234.842 271.447 1.00 0.00 C +ATOM 34 CA ASP A 34 268.025 234.062 271.714 1.00 0.00 C +ATOM 35 CA LYS A 35 271.244 235.907 270.848 1.00 0.00 C +ATOM 36 CA VAL A 36 273.110 238.228 273.225 1.00 0.00 C +ATOM 37 CA ASN A 37 270.575 240.715 274.604 1.00 0.00 C +ATOM 38 CA ASN A 38 268.582 242.970 272.266 1.00 0.00 C +ATOM 39 CA ASN A 39 268.406 246.178 270.220 1.00 0.00 C +ATOM 40 CA ASN A 40 265.994 245.510 267.348 1.00 0.00 C +ATOM 41 CA ASP A 41 266.947 242.485 265.235 1.00 0.00 C +ATOM 42 CA SER A 42 270.323 240.769 264.817 1.00 0.00 C +ATOM 43 CA GLU A 43 273.182 238.407 263.946 1.00 0.00 C +ATOM 44 CA VAL A 44 276.011 237.336 261.630 1.00 0.00 C +ATOM 45 CA GLU A 45 279.741 236.735 262.127 1.00 0.00 C +ATOM 46 CA THR A 46 281.515 235.587 265.297 1.00 0.00 C +ATOM 47 CA SER A 47 285.178 236.427 264.672 1.00 0.00 C +ATOM 48 CA LYS A 48 287.924 239.053 264.391 1.00 0.00 C +ATOM 49 CA PRO A 49 291.089 240.011 262.499 1.00 0.00 C +ATOM 50 CA SER A 50 292.064 237.875 259.499 1.00 0.00 C +ATOM 51 CA SER A 51 291.733 240.011 256.361 1.00 0.00 C +ATOM 52 CA PRO A 52 290.326 243.448 255.510 1.00 0.00 C +ATOM 53 CA LYS A 53 289.054 245.939 258.097 1.00 0.00 C +ATOM 54 CA SER A 54 289.319 249.466 259.515 1.00 0.00 C +ATOM 55 CA LYS A 55 291.584 251.926 257.691 1.00 0.00 C +ATOM 56 CA ALA A 56 291.714 255.072 255.545 1.00 0.00 C +ATOM 57 CA GLU A 57 288.172 255.921 254.425 1.00 0.00 C +ATOM 58 CA GLU A 58 285.050 254.353 255.944 1.00 0.00 C +ATOM 59 CA ASN A 59 283.847 252.244 258.880 1.00 0.00 C +ATOM 60 CA ILE A 60 280.816 251.111 260.891 1.00 0.00 C +ATOM 61 CA TYR A 61 279.186 249.799 264.075 1.00 0.00 C +ATOM 62 CA LEU A 62 278.205 246.145 264.516 1.00 0.00 C +ATOM 63 CA GLY A 63 278.221 244.739 260.975 1.00 0.00 C +ATOM 64 CA PRO A 64 274.888 243.220 259.927 1.00 0.00 C +ATOM 65 CA HIS A 65 273.602 243.170 256.341 1.00 0.00 C +ATOM 66 CA GLY A 66 274.543 243.020 252.652 1.00 0.00 C +ATOM 67 CA ALA A 67 271.926 244.161 250.129 1.00 0.00 C +ATOM 68 CA PRO A 68 269.739 247.234 249.586 1.00 0.00 C +ATOM 69 CA PRO A 69 268.571 250.450 247.912 1.00 0.00 C +ATOM 70 CA SER A 70 265.108 251.499 246.718 1.00 0.00 C +ATOM 71 CA GLN A 71 262.380 252.391 244.213 1.00 0.00 C +ATOM 72 CA LEU A 72 261.335 254.084 240.963 1.00 0.00 C +ATOM 73 CA GLN A 73 259.549 257.403 241.521 1.00 0.00 C +ATOM 74 CA ASP A 74 256.072 256.636 242.877 1.00 0.00 C +ATOM 75 CA GLY A 75 253.561 255.032 245.253 1.00 0.00 C +ATOM 76 CA GLY A 76 251.611 251.888 246.162 1.00 0.00 C +ATOM 77 CA SER A 77 248.111 251.498 244.709 1.00 0.00 C +ATOM 78 CA ASN A 78 244.532 251.901 245.953 1.00 0.00 C +ATOM 79 CA THR A 79 243.547 253.983 248.988 1.00 0.00 C +ATOM 80 CA SER A 80 240.491 255.987 250.065 1.00 0.00 C +ATOM 81 CA SER A 81 238.665 257.496 247.081 1.00 0.00 C +ATOM 82 CA ARG A 82 235.094 256.264 246.590 1.00 0.00 C +ATOM 83 CA LYS A 83 234.198 252.694 245.606 1.00 0.00 C +ATOM 84 CA GLN A 84 233.978 248.967 244.846 1.00 0.00 C +ATOM 85 CA ARG A 85 230.682 247.142 244.280 1.00 0.00 C +ATOM 86 CA PHE A 86 230.341 246.734 240.507 1.00 0.00 C +ATOM 87 CA LYS A 87 230.577 244.233 237.643 1.00 0.00 C +ATOM 88 CA GLN A 88 230.354 245.981 234.265 1.00 0.00 C +ATOM 89 CA MET A 89 233.551 247.068 232.500 1.00 0.00 C +ATOM 90 CA LEU A 90 235.214 250.495 232.510 1.00 0.00 C +ATOM 91 CA LYS A 91 234.477 253.433 234.822 1.00 0.00 C +ATOM 92 CA GLU A 92 234.998 252.939 238.564 1.00 0.00 C +ATOM 93 CA ALA A 93 238.530 251.871 239.511 1.00 0.00 C +ATOM 94 CA ASP A 94 241.970 253.117 238.446 1.00 0.00 C +ATOM 95 CA GLN A 95 244.748 255.157 236.823 1.00 0.00 C +ATOM 96 CA LYS A 96 246.466 257.828 234.717 1.00 0.00 C +ATOM 97 CA MET A 97 247.801 261.390 234.925 1.00 0.00 C +ATOM 98 CA SER A 98 247.808 263.312 231.635 1.00 0.00 C +ATOM 99 CA GLY A 99 245.757 261.484 228.995 1.00 0.00 C +ATOM 100 CA SER A 100 242.091 261.851 228.023 1.00 0.00 C +ATOM 101 CA GLY A 101 242.064 261.539 224.226 1.00 0.00 C +ATOM 102 CA ARG A 102 238.449 261.203 223.072 1.00 0.00 C +ATOM 103 CA GLU A 103 234.795 260.155 222.808 1.00 0.00 C +ATOM 104 CA ASN A 104 232.844 256.994 221.960 1.00 0.00 C +ATOM 105 CA LYS A 105 229.414 257.163 223.612 1.00 0.00 C +ATOM 106 CA MET A 106 225.810 256.553 222.540 1.00 0.00 C +ATOM 107 CA ALA A 107 224.552 257.334 219.029 1.00 0.00 C +ATOM 108 CA ASN A 108 221.157 258.991 219.523 1.00 0.00 C +ATOM 109 CA LEU A 109 219.635 259.502 222.979 1.00 0.00 C +ATOM 110 CA ARG A 110 217.574 258.758 226.095 1.00 0.00 C +ATOM 111 CA GLU A 111 217.499 257.067 229.508 1.00 0.00 C +ATOM 112 CA LEU A 112 218.595 259.208 232.463 1.00 0.00 C +ATOM 113 CA VAL A 113 220.255 257.866 235.619 1.00 0.00 C +ATOM 114 CA GLY A 114 220.020 259.167 239.192 1.00 0.00 C +ATOM 115 CA GLY A 115 221.136 262.035 241.439 1.00 0.00 C +ATOM 116 CA GLY A 116 221.477 265.567 242.827 1.00 0.00 C +ATOM 117 CA ALA A 117 223.101 269.012 242.740 1.00 0.00 C +ATOM 118 CA GLY A 118 224.645 270.538 245.871 1.00 0.00 C +ATOM 119 CA ALA A 119 225.924 274.061 245.187 1.00 0.00 C +ATOM 120 CA GLU A 120 224.819 277.249 243.419 1.00 0.00 C +ATOM 121 CA LYS A 121 223.968 276.139 239.875 1.00 0.00 C +ATOM 122 CA GLY A 122 225.237 272.813 238.517 1.00 0.00 C +ATOM 123 CA THR A 123 229.038 272.806 238.255 1.00 0.00 C +ATOM 124 CA ASN A 124 231.394 275.785 237.955 1.00 0.00 C +ATOM 125 CA MET A 125 233.679 276.262 234.943 1.00 0.00 C +ATOM 126 CA GLY A 126 236.244 273.446 234.873 1.00 0.00 C +ATOM 127 CA LYS A 127 238.896 271.913 237.139 1.00 0.00 C +ATOM 128 CA GLY A 128 239.379 268.146 237.444 1.00 0.00 C +ATOM 129 CA VAL A 129 239.126 267.464 241.184 1.00 0.00 C +ATOM 130 CA SER A 130 239.271 266.143 244.754 1.00 0.00 C +ATOM 131 CA ARG A 131 240.581 268.463 247.478 1.00 0.00 C +ATOM 132 CA ASP A 132 243.182 267.529 250.101 1.00 0.00 C +ATOM 133 CA TRP A 133 246.044 265.435 251.494 1.00 0.00 C +ATOM 134 CA LEU A 134 247.247 262.421 253.490 1.00 0.00 C +ATOM 135 CA ASP A 135 247.107 261.536 257.193 1.00 0.00 C +ATOM 136 CA PRO A 136 248.953 263.695 259.732 1.00 0.00 C +ATOM 137 CA HIS A 137 249.258 267.193 261.210 1.00 0.00 C +ATOM 138 CA CYS A 138 249.692 269.488 258.200 1.00 0.00 C +ATOM 139 CA HIS A 139 251.482 272.065 256.040 1.00 0.00 C +ATOM 140 CA GLU A 140 250.898 275.548 254.609 1.00 0.00 C +ATOM 141 CA SER A 141 250.560 275.473 250.815 1.00 0.00 C +ATOM 142 CA GLN A 142 250.172 272.411 248.581 1.00 0.00 C +ATOM 143 CA PHE A 143 252.077 269.126 248.886 1.00 0.00 C +ATOM 144 CA GLU A 144 254.463 266.345 247.842 1.00 0.00 C +ATOM 145 CA LYS A 145 254.594 263.891 250.754 1.00 0.00 C +ATOM 146 CA ARG A 146 255.477 265.375 254.151 1.00 0.00 C +ATOM 147 CA ARG A 147 258.333 263.494 255.830 1.00 0.00 C +ATOM 148 CA LEU A 148 261.983 263.972 254.848 1.00 0.00 C +ATOM 149 CA PRO A 149 263.710 267.129 256.099 1.00 0.00 C +TER 150 PRO A 149 +END diff --git a/Plants/Q9FNP3/Q9FNP3.dcd b/Plants/Q9FNP3/Q9FNP3.dcd new file mode 100644 index 0000000000000000000000000000000000000000..8d795a0aa4ae1676e5c2c750ee1903c6e6d8c7d3 --- /dev/null +++ b/Plants/Q9FNP3/Q9FNP3.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:0430c53381b2229d22c8a4f9ac3b029cc6a02c5467c7c55b55b86edd5d78a570 +size 4640276 diff --git a/Plants/Q9FNP3/top.pdb b/Plants/Q9FNP3/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..fe85115188e998ebe1bc85689a26b518e6597263 --- /dev/null +++ b/Plants/Q9FNP3/top.pdb @@ -0,0 +1,36 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 271.675 248.442 257.690 1.00 0.00 C +ATOM 2 CA SER A 2 268.678 248.833 260.009 1.00 0.00 C +ATOM 3 CA GLY A 3 267.063 252.164 260.910 1.00 0.00 C +ATOM 4 CA VAL A 4 266.727 255.390 262.910 1.00 0.00 C +ATOM 5 CA PRO A 5 266.557 259.169 263.360 1.00 0.00 C +ATOM 6 CA LYS A 6 262.967 260.325 262.824 1.00 0.00 C +ATOM 7 CA ARG A 7 259.623 261.762 261.696 1.00 0.00 C +ATOM 8 CA SER A 8 256.226 260.047 261.514 1.00 0.00 C +ATOM 9 CA HIS A 9 254.609 259.346 258.136 1.00 0.00 C +ATOM 10 CA GLU A 10 253.324 257.452 255.090 1.00 0.00 C +ATOM 11 CA GLU A 11 251.277 256.921 251.921 1.00 0.00 C +ATOM 12 CA GLY A 12 251.096 256.135 248.197 1.00 0.00 C +ATOM 13 CA VAL A 13 251.164 253.824 245.169 1.00 0.00 C +ATOM 14 CA THR A 14 248.636 251.093 244.352 1.00 0.00 C +ATOM 15 CA HIS A 15 248.928 247.566 245.762 1.00 0.00 C +ATOM 16 CA PRO A 16 247.279 244.227 244.957 1.00 0.00 C +ATOM 17 CA SER A 17 245.826 241.952 247.647 1.00 0.00 C +ATOM 18 CA SER A 18 244.850 238.359 246.838 1.00 0.00 C +ATOM 19 CA SER A 19 244.723 237.036 243.268 1.00 0.00 C +ATOM 20 CA SER A 20 243.733 239.572 240.602 1.00 0.00 C +ATOM 21 CA SER A 21 243.837 241.973 237.646 1.00 0.00 C +ATOM 22 CA VAL A 22 245.049 245.568 237.292 1.00 0.00 C +ATOM 23 CA ALA A 23 245.356 248.912 239.092 1.00 0.00 C +ATOM 24 CA LYS A 24 242.092 250.565 240.152 1.00 0.00 C +ATOM 25 CA TYR A 25 243.011 252.899 243.020 1.00 0.00 C +ATOM 26 CA PRO A 26 243.222 253.625 246.754 1.00 0.00 C +ATOM 27 CA HIS A 27 241.955 253.027 250.297 1.00 0.00 C +ATOM 28 CA GLU A 28 240.610 249.695 251.563 1.00 0.00 C +ATOM 29 CA ASP A 29 240.268 246.680 249.259 1.00 0.00 C +ATOM 30 CA SER A 30 239.636 243.225 247.782 1.00 0.00 C +ATOM 31 CA GLY A 31 236.600 241.374 246.414 1.00 0.00 C +ATOM 32 CA SER A 32 233.403 242.841 247.879 1.00 0.00 C +TER 33 SER A 32 +END diff --git a/Plants/Q9FNV0/Q9FNV0.dcd b/Plants/Q9FNV0/Q9FNV0.dcd new file mode 100644 index 0000000000000000000000000000000000000000..f12e0f84be4853d4420e580429084a13a0a1124b --- /dev/null +++ b/Plants/Q9FNV0/Q9FNV0.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:1dbd2786fc4f3ce990c2b6fc90d0ebbb9a9599f656fef6639b1996c5f7a669e8 +size 86560276 diff --git a/Plants/Q9FNV0/top.pdb b/Plants/Q9FNV0/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..935cd44cd826961453c00931c0a6fe27d6959143 --- /dev/null +++ b/Plants/Q9FNV0/top.pdb @@ -0,0 +1,358 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 900.000 900.000 900.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 464.593 440.415 537.449 1.00 0.00 C +ATOM 2 CA ARG A 2 466.558 437.955 535.303 1.00 0.00 C +ATOM 3 CA MET A 3 464.145 436.757 532.610 1.00 0.00 C +ATOM 4 CA THR A 4 464.744 433.084 531.792 1.00 0.00 C +ATOM 5 CA THR A 5 464.652 429.440 532.901 1.00 0.00 C +ATOM 6 CA THR A 6 462.165 426.643 533.613 1.00 0.00 C +ATOM 7 CA PRO A 7 462.344 423.399 531.623 1.00 0.00 C +ATOM 8 CA ALA A 8 459.407 420.983 531.382 1.00 0.00 C +ATOM 9 CA ARG A 9 457.981 419.470 534.575 1.00 0.00 C +ATOM 10 CA GLU A 10 459.590 421.131 537.603 1.00 0.00 C +ATOM 11 CA PRO A 11 459.201 418.656 540.472 1.00 0.00 C +ATOM 12 CA ARG A 12 456.918 418.665 543.523 1.00 0.00 C +ATOM 13 CA GLU A 13 455.383 415.884 545.627 1.00 0.00 C +ATOM 14 CA PRO A 14 453.833 412.407 545.772 1.00 0.00 C +ATOM 15 CA TYR A 15 450.213 412.659 544.611 1.00 0.00 C +ATOM 16 CA ARG A 16 449.482 413.439 540.954 1.00 0.00 C +ATOM 17 CA ARG A 17 451.061 414.453 537.637 1.00 0.00 C +ATOM 18 CA GLU A 18 451.448 413.609 533.942 1.00 0.00 C +ATOM 19 CA GLY A 19 453.705 411.800 531.462 1.00 0.00 C +ATOM 20 CA ARG A 20 452.658 408.331 530.282 1.00 0.00 C +ATOM 21 CA ASP A 21 449.953 405.713 529.700 1.00 0.00 C +ATOM 22 CA SER A 22 446.870 403.595 530.429 1.00 0.00 C +ATOM 23 CA HIS A 23 445.640 401.053 527.872 1.00 0.00 C +ATOM 24 CA ALA A 24 443.639 401.495 524.660 1.00 0.00 C +ATOM 25 CA ARG A 25 442.844 404.633 522.651 1.00 0.00 C +ATOM 26 CA HIS A 26 443.313 408.401 522.344 1.00 0.00 C +ATOM 27 CA PRO A 27 444.733 410.557 519.542 1.00 0.00 C +ATOM 28 CA HIS A 28 446.143 412.080 516.347 1.00 0.00 C +ATOM 29 CA SER A 29 447.721 409.742 513.785 1.00 0.00 C +ATOM 30 CA SER A 30 446.819 406.067 513.341 1.00 0.00 C +ATOM 31 CA TYR A 31 446.013 403.559 516.093 1.00 0.00 C +ATOM 32 CA ARG A 32 446.210 399.901 517.140 1.00 0.00 C +ATOM 33 CA SER A 33 443.350 397.385 517.184 1.00 0.00 C +ATOM 34 CA ARG A 34 441.659 394.006 516.690 1.00 0.00 C +ATOM 35 CA ARG A 35 440.580 391.114 514.458 1.00 0.00 C +ATOM 36 CA ASP A 36 442.416 387.776 514.388 1.00 0.00 C +ATOM 37 CA ASP A 37 445.109 385.932 516.354 1.00 0.00 C +ATOM 38 CA PRO A 38 447.882 385.659 518.952 1.00 0.00 C +ATOM 39 CA PRO A 39 447.229 383.927 522.282 1.00 0.00 C +ATOM 40 CA SER A 40 445.457 380.607 522.873 1.00 0.00 C +ATOM 41 CA PRO A 41 444.758 379.969 526.563 1.00 0.00 C +ATOM 42 CA ARG A 42 445.282 382.847 529.004 1.00 0.00 C +ATOM 43 CA ARG A 43 442.506 384.714 530.826 1.00 0.00 C +ATOM 44 CA TRP A 44 444.039 387.861 532.330 1.00 0.00 C +ATOM 45 CA ARG A 45 446.081 390.937 531.390 1.00 0.00 C +ATOM 46 CA ASP A 46 449.272 392.959 530.891 1.00 0.00 C +ATOM 47 CA ASP A 47 450.883 393.834 534.231 1.00 0.00 C +ATOM 48 CA ARG A 48 453.659 396.359 533.574 1.00 0.00 C +ATOM 49 CA ARG A 49 454.721 399.559 535.347 1.00 0.00 C +ATOM 50 CA HIS A 50 453.518 401.125 538.605 1.00 0.00 C +ATOM 51 CA GLU A 51 456.135 400.856 541.361 1.00 0.00 C +ATOM 52 CA SER A 52 458.214 397.812 540.396 1.00 0.00 C +ATOM 53 CA ASP A 53 460.378 396.659 537.480 1.00 0.00 C +ATOM 54 CA ARG A 54 459.747 396.431 533.730 1.00 0.00 C +ATOM 55 CA SER A 55 461.584 398.998 531.596 1.00 0.00 C +ATOM 56 CA HIS A 56 460.523 398.361 527.992 1.00 0.00 C +ATOM 57 CA HIS A 57 461.463 399.791 524.588 1.00 0.00 C +ATOM 58 CA ARG A 58 463.273 402.016 522.081 1.00 0.00 C +ATOM 59 CA ARG A 59 461.715 402.856 518.707 1.00 0.00 C +ATOM 60 CA ARG A 60 458.207 404.316 518.427 1.00 0.00 C +ATOM 61 CA ALA A 61 455.692 405.552 521.008 1.00 0.00 C +ATOM 62 CA GLU A 62 453.100 406.603 523.594 1.00 0.00 C +ATOM 63 CA GLU A 63 450.731 409.587 523.616 1.00 0.00 C +ATOM 64 CA GLY A 64 449.583 412.655 525.563 1.00 0.00 C +ATOM 65 CA ALA A 65 449.240 415.936 523.657 1.00 0.00 C +ATOM 66 CA ASP A 66 449.197 419.524 522.377 1.00 0.00 C +ATOM 67 CA ALA A 67 446.116 421.409 523.591 1.00 0.00 C +ATOM 68 CA GLY A 68 446.349 425.151 522.914 1.00 0.00 C +ATOM 69 CA ASP A 69 447.137 427.159 519.773 1.00 0.00 C +ATOM 70 CA ARG A 70 449.276 427.556 516.645 1.00 0.00 C +ATOM 71 CA ASP A 71 447.433 430.075 514.461 1.00 0.00 C +ATOM 72 CA GLU A 72 445.256 432.743 516.091 1.00 0.00 C +ATOM 73 CA ARG A 73 441.754 432.421 514.625 1.00 0.00 C +ATOM 74 CA ARG A 74 437.950 432.449 514.425 1.00 0.00 C +ATOM 75 CA ASN A 75 434.808 431.392 512.546 1.00 0.00 C +ATOM 76 CA ARG A 76 432.513 430.055 515.278 1.00 0.00 C +ATOM 77 CA PRO A 77 428.921 430.103 516.547 1.00 0.00 C +ATOM 78 CA SER A 78 425.558 431.083 515.051 1.00 0.00 C +ATOM 79 CA HIS A 79 424.638 433.358 512.136 1.00 0.00 C +ATOM 80 CA SER A 80 425.210 434.668 508.604 1.00 0.00 C +ATOM 81 CA GLN A 81 423.820 433.335 505.317 1.00 0.00 C +ATOM 82 CA ASP A 82 422.325 436.083 503.143 1.00 0.00 C +ATOM 83 CA ALA A 83 422.254 437.892 499.791 1.00 0.00 C +ATOM 84 CA GLN A 84 421.949 441.670 499.401 1.00 0.00 C +ATOM 85 CA ALA A 85 423.097 445.138 500.483 1.00 0.00 C +ATOM 86 CA ARG A 86 423.876 447.814 497.885 1.00 0.00 C +ATOM 87 CA ARG A 87 421.711 449.284 495.116 1.00 0.00 C +ATOM 88 CA ASP A 88 419.184 449.150 492.267 1.00 0.00 C +ATOM 89 CA GLY A 89 419.835 445.841 490.495 1.00 0.00 C +ATOM 90 CA PRO A 90 417.779 442.678 489.964 1.00 0.00 C +ATOM 91 CA ASP A 91 418.319 440.147 492.761 1.00 0.00 C +ATOM 92 CA PRO A 92 415.752 437.921 494.485 1.00 0.00 C +ATOM 93 CA VAL A 93 413.125 436.627 492.048 1.00 0.00 C +ATOM 94 CA ARG A 94 411.421 438.497 489.199 1.00 0.00 C +ATOM 95 CA GLY A 95 412.060 438.815 485.456 1.00 0.00 C +ATOM 96 CA ASP A 96 411.938 442.317 483.961 1.00 0.00 C +ATOM 97 CA GLY A 97 412.860 442.298 480.264 1.00 0.00 C +ATOM 98 CA THR A 98 416.516 442.589 479.231 1.00 0.00 C +ATOM 99 CA ARG A 99 418.348 441.925 475.957 1.00 0.00 C +ATOM 100 CA ARG A 100 421.566 443.954 476.169 1.00 0.00 C +ATOM 101 CA ASN A 101 423.857 444.278 479.196 1.00 0.00 C +ATOM 102 CA GLY A 102 426.927 446.357 480.074 1.00 0.00 C +ATOM 103 CA PRO A 103 427.549 449.158 482.581 1.00 0.00 C +ATOM 104 CA ASP A 104 425.638 452.093 484.080 1.00 0.00 C +ATOM 105 CA PRO A 105 426.043 455.034 486.468 1.00 0.00 C +ATOM 106 CA VAL A 106 427.893 457.703 488.461 1.00 0.00 C +ATOM 107 CA ARG A 107 429.331 460.360 486.139 1.00 0.00 C +ATOM 108 CA TRP A 108 426.881 463.092 485.117 1.00 0.00 C +ATOM 109 CA ASP A 109 423.657 464.036 483.318 1.00 0.00 C +ATOM 110 CA GLY A 110 419.931 463.241 483.387 1.00 0.00 C +ATOM 111 CA LYS A 111 417.973 464.339 480.309 1.00 0.00 C +ATOM 112 CA ARG A 112 414.962 466.474 479.364 1.00 0.00 C +ATOM 113 CA PRO A 113 414.807 470.210 478.634 1.00 0.00 C +ATOM 114 CA ASP A 114 412.697 471.817 481.370 1.00 0.00 C +ATOM 115 CA ASP A 115 409.510 473.667 482.338 1.00 0.00 C +ATOM 116 CA ALA A 116 408.166 476.679 480.431 1.00 0.00 C +ATOM 117 CA ASP A 117 406.046 479.845 480.448 1.00 0.00 C +ATOM 118 CA PRO A 118 404.677 480.857 483.856 1.00 0.00 C +ATOM 119 CA ALA A 119 407.595 480.930 486.304 1.00 0.00 C +ATOM 120 CA ARG A 120 411.028 482.561 486.573 1.00 0.00 C +ATOM 121 CA TRP A 121 414.832 482.715 486.701 1.00 0.00 C +ATOM 122 CA GLU A 122 417.264 479.791 486.945 1.00 0.00 C +ATOM 123 CA GLY A 123 416.797 476.022 486.642 1.00 0.00 C +ATOM 124 CA LYS A 124 416.746 472.221 486.887 1.00 0.00 C +ATOM 125 CA ARG A 125 418.983 469.707 488.673 1.00 0.00 C +ATOM 126 CA SER A 126 417.167 468.806 491.899 1.00 0.00 C +ATOM 127 CA ASP A 127 413.557 467.763 492.526 1.00 0.00 C +ATOM 128 CA ASP A 128 411.560 465.985 489.812 1.00 0.00 C +ATOM 129 CA PRO A 129 408.038 465.255 488.553 1.00 0.00 C +ATOM 130 CA ASP A 130 404.321 464.742 489.212 1.00 0.00 C +ATOM 131 CA PRO A 131 402.499 464.140 492.504 1.00 0.00 C +ATOM 132 CA VAL A 132 404.357 464.331 495.824 1.00 0.00 C +ATOM 133 CA ARG A 133 403.760 464.314 499.587 1.00 0.00 C +ATOM 134 CA ARG A 134 406.027 463.099 502.398 1.00 0.00 C +ATOM 135 CA GLU A 135 408.457 465.338 504.295 1.00 0.00 C +ATOM 136 CA GLY A 136 411.660 465.332 502.233 1.00 0.00 C +ATOM 137 CA LYS A 137 411.505 466.102 498.505 1.00 0.00 C +ATOM 138 CA PRO A 138 411.561 462.668 496.854 1.00 0.00 C +ATOM 139 CA PRO A 139 411.845 459.063 495.654 1.00 0.00 C +ATOM 140 CA SER A 140 410.596 458.158 492.170 1.00 0.00 C +ATOM 141 CA ASP A 141 406.953 458.569 491.131 1.00 0.00 C +ATOM 142 CA VAL A 142 404.472 456.418 489.200 1.00 0.00 C +ATOM 143 CA LYS A 143 402.320 454.303 486.873 1.00 0.00 C +ATOM 144 CA ASP A 144 401.469 451.071 485.044 1.00 0.00 C +ATOM 145 CA ASP A 145 400.373 447.799 486.660 1.00 0.00 C +ATOM 146 CA LEU A 146 397.705 445.081 486.751 1.00 0.00 C +ATOM 147 CA PRO A 147 396.209 441.577 486.792 1.00 0.00 C +ATOM 148 CA VAL A 148 398.872 439.048 487.808 1.00 0.00 C +ATOM 149 CA ARG A 149 401.437 437.951 490.402 1.00 0.00 C +ATOM 150 CA HIS A 150 402.797 434.395 490.543 1.00 0.00 C +ATOM 151 CA GLU A 151 406.202 432.700 490.776 1.00 0.00 C +ATOM 152 CA ARG A 152 408.561 432.699 487.784 1.00 0.00 C +ATOM 153 CA SER A 153 406.854 431.642 484.546 1.00 0.00 C +ATOM 154 CA PRO A 154 408.469 433.692 481.771 1.00 0.00 C +ATOM 155 CA ARG A 155 409.394 431.562 478.751 1.00 0.00 C +ATOM 156 CA GLY A 156 411.821 433.541 476.581 1.00 0.00 C +ATOM 157 CA THR A 157 413.863 436.363 475.038 1.00 0.00 C +ATOM 158 CA LYS A 158 417.303 435.569 473.604 1.00 0.00 C +ATOM 159 CA ARG A 159 417.762 434.960 469.871 1.00 0.00 C +ATOM 160 CA PHE A 160 420.265 436.027 467.204 1.00 0.00 C +ATOM 161 CA SER A 161 421.529 439.621 467.255 1.00 0.00 C +ATOM 162 CA GLU A 162 425.174 440.710 467.054 1.00 0.00 C +ATOM 163 CA THR A 163 426.169 441.589 463.483 1.00 0.00 C +ATOM 164 CA ARG A 164 429.866 442.513 463.451 1.00 0.00 C +ATOM 165 CA GLU A 165 432.588 441.930 466.052 1.00 0.00 C +ATOM 166 CA ALA A 166 433.843 442.995 469.488 1.00 0.00 C +ATOM 167 CA TRP A 167 436.611 442.676 472.087 1.00 0.00 C +ATOM 168 CA GLN A 168 438.383 439.328 471.682 1.00 0.00 C +ATOM 169 CA PRO A 169 441.817 437.687 471.857 1.00 0.00 C +ATOM 170 CA ARG A 170 445.485 438.317 472.672 1.00 0.00 C +ATOM 171 CA SER A 171 447.867 435.930 470.899 1.00 0.00 C +ATOM 172 CA SER A 172 447.457 435.402 467.148 1.00 0.00 C +ATOM 173 CA PHE A 173 443.944 434.582 465.921 1.00 0.00 C +ATOM 174 CA PHE A 174 440.683 433.469 467.547 1.00 0.00 C +ATOM 175 CA GLN A 175 437.773 431.835 465.708 1.00 0.00 C +ATOM 176 CA HIS A 176 438.207 429.669 462.605 1.00 0.00 C +ATOM 177 CA ASP A 177 438.253 431.906 459.521 1.00 0.00 C +ATOM 178 CA ALA A 178 439.420 434.458 456.944 1.00 0.00 C +ATOM 179 CA ARG A 179 441.579 437.500 457.720 1.00 0.00 C +ATOM 180 CA ASP A 180 445.292 437.509 456.864 1.00 0.00 C +ATOM 181 CA SER A 181 446.647 434.826 454.523 1.00 0.00 C +ATOM 182 CA ALA A 182 448.802 431.935 455.754 1.00 0.00 C +ATOM 183 CA GLY A 183 451.678 430.932 453.464 1.00 0.00 C +ATOM 184 CA HIS A 184 455.230 429.835 454.300 1.00 0.00 C +ATOM 185 CA GLY A 185 457.205 431.566 457.059 1.00 0.00 C +ATOM 186 CA GLY A 186 461.011 431.734 457.072 1.00 0.00 C +ATOM 187 CA ARG A 187 464.258 430.146 455.868 1.00 0.00 C +ATOM 188 CA ARG A 188 466.981 432.478 457.159 1.00 0.00 C +ATOM 189 CA TYR A 189 469.447 434.831 455.457 1.00 0.00 C +ATOM 190 CA GLY A 190 469.688 434.831 451.655 1.00 0.00 C +ATOM 191 CA ARG A 191 470.888 438.189 450.314 1.00 0.00 C +ATOM 192 CA GLN A 192 471.634 439.495 446.813 1.00 0.00 C +ATOM 193 CA ASP A 193 470.675 436.746 444.355 1.00 0.00 C +ATOM 194 CA TYR A 194 473.497 436.053 441.891 1.00 0.00 C +ATOM 195 CA GLY A 195 474.405 434.264 438.653 1.00 0.00 C +ATOM 196 CA ARG A 196 477.670 432.644 437.543 1.00 0.00 C +ATOM 197 CA HIS A 197 480.497 435.131 436.958 1.00 0.00 C +ATOM 198 CA ARG A 198 483.957 433.561 437.237 1.00 0.00 C +ATOM 199 CA GLY A 199 485.262 433.121 433.685 1.00 0.00 C +ATOM 200 CA GLN A 200 484.130 435.666 431.086 1.00 0.00 C +ATOM 201 CA ASN A 201 481.866 438.038 429.146 1.00 0.00 C +ATOM 202 CA GLU A 202 479.761 440.591 431.034 1.00 0.00 C +ATOM 203 CA HIS A 203 476.127 440.960 432.119 1.00 0.00 C +ATOM 204 CA LEU A 204 473.673 442.170 429.468 1.00 0.00 C +ATOM 205 CA ASP A 205 470.754 443.707 431.376 1.00 0.00 C +ATOM 206 CA ASP A 206 471.907 447.095 432.682 1.00 0.00 C +ATOM 207 CA LYS A 207 473.391 449.969 430.668 1.00 0.00 C +ATOM 208 CA GLU A 208 473.733 453.697 431.376 1.00 0.00 C +ATOM 209 CA LYS A 209 472.014 456.973 432.287 1.00 0.00 C +ATOM 210 CA ALA A 210 469.098 459.209 431.281 1.00 0.00 C +ATOM 211 CA GLU A 211 468.998 462.536 433.134 1.00 0.00 C +ATOM 212 CA GLN A 212 469.036 466.338 432.881 1.00 0.00 C +ATOM 213 CA ALA A 213 467.363 469.578 431.778 1.00 0.00 C +ATOM 214 CA GLN A 214 464.883 469.016 428.941 1.00 0.00 C +ATOM 215 CA GLN A 215 465.362 465.559 427.413 1.00 0.00 C +ATOM 216 CA GLN A 216 468.767 465.767 425.716 1.00 0.00 C +ATOM 217 CA ASN A 217 471.837 463.994 427.113 1.00 0.00 C +ATOM 218 CA ASP A 218 473.535 461.243 425.096 1.00 0.00 C +ATOM 219 CA VAL A 219 473.221 457.577 426.085 1.00 0.00 C +ATOM 220 CA ASP A 220 475.239 454.733 424.550 1.00 0.00 C +ATOM 221 CA SER A 221 476.247 451.759 422.393 1.00 0.00 C +ATOM 222 CA THR A 222 476.917 449.195 419.655 1.00 0.00 C +ATOM 223 CA TRP A 223 475.942 445.524 419.352 1.00 0.00 C +ATOM 224 CA LYS A 224 473.299 442.822 418.874 1.00 0.00 C +ATOM 225 CA HIS A 225 470.097 441.803 417.078 1.00 0.00 C +ATOM 226 CA ASP A 226 466.790 442.824 418.672 1.00 0.00 C +ATOM 227 CA GLY A 227 465.234 445.066 421.330 1.00 0.00 C +ATOM 228 CA PHE A 228 467.777 447.823 422.000 1.00 0.00 C +ATOM 229 CA PHE A 229 469.976 450.932 421.887 1.00 0.00 C +ATOM 230 CA LYS A 230 469.690 454.427 420.399 1.00 0.00 C +ATOM 231 CA LEU A 231 467.675 457.194 422.073 1.00 0.00 C +ATOM 232 CA GLU A 232 465.911 458.021 425.347 1.00 0.00 C +ATOM 233 CA GLU A 233 462.153 457.588 425.801 1.00 0.00 C +ATOM 234 CA GLU A 234 461.075 454.147 424.569 1.00 0.00 C +ATOM 235 CA VAL A 235 457.274 453.877 424.528 1.00 0.00 C +ATOM 236 CA PRO A 236 455.510 451.088 422.624 1.00 0.00 C +ATOM 237 CA VAL A 237 456.562 448.296 420.255 1.00 0.00 C +ATOM 238 CA ALA A 238 457.211 446.722 416.846 1.00 0.00 C +ATOM 239 CA LYS A 239 456.101 446.403 413.216 1.00 0.00 C +ATOM 240 CA ARG A 240 452.963 444.456 412.280 1.00 0.00 C +ATOM 241 CA ARG A 241 452.332 440.705 412.510 1.00 0.00 C +ATOM 242 CA PRO A 242 454.845 438.756 410.411 1.00 0.00 C +ATOM 243 CA GLY A 243 458.445 439.180 411.584 1.00 0.00 C +ATOM 244 CA PHE A 244 462.010 440.490 411.280 1.00 0.00 C +ATOM 245 CA LYS A 245 464.666 443.141 411.935 1.00 0.00 C +ATOM 246 CA GLU A 246 463.837 446.814 412.520 1.00 0.00 C +ATOM 247 CA MET A 247 465.058 450.393 412.054 1.00 0.00 C +ATOM 248 CA GLY A 248 466.772 453.232 413.930 1.00 0.00 C +ATOM 249 CA MET A 249 469.452 455.128 411.997 1.00 0.00 C +ATOM 250 CA PRO A 250 468.745 458.259 409.943 1.00 0.00 C +ATOM 251 CA ARG A 251 467.711 460.964 412.419 1.00 0.00 C +ATOM 252 CA GLU A 252 467.183 460.094 416.090 1.00 0.00 C +ATOM 253 CA GLU A 253 465.985 463.070 418.146 1.00 0.00 C +ATOM 254 CA GLN A 254 468.898 465.376 418.992 1.00 0.00 C +ATOM 255 CA GLU A 255 471.956 463.905 417.260 1.00 0.00 C +ATOM 256 CA SER A 256 475.353 465.492 417.937 1.00 0.00 C +ATOM 257 CA GLY A 257 478.104 463.528 419.694 1.00 0.00 C +ATOM 258 CA PHE A 258 479.857 460.149 419.861 1.00 0.00 C +ATOM 259 CA ALA A 259 481.202 459.318 416.395 1.00 0.00 C +ATOM 260 CA GLU A 260 484.316 460.585 414.602 1.00 0.00 C +ATOM 261 CA PRO A 261 486.165 461.469 411.390 1.00 0.00 C +ATOM 262 CA ASP A 262 486.694 460.245 407.821 1.00 0.00 C +ATOM 263 CA THR A 263 486.062 458.614 404.436 1.00 0.00 C +ATOM 264 CA ARG A 264 483.615 456.753 402.185 1.00 0.00 C +ATOM 265 CA SER A 265 481.343 454.554 400.060 1.00 0.00 C +ATOM 266 CA ARG A 266 479.574 452.407 397.457 1.00 0.00 C +ATOM 267 CA LYS A 267 477.775 449.161 396.595 1.00 0.00 C +ATOM 268 CA PRO A 268 478.175 447.901 393.022 1.00 0.00 C +ATOM 269 CA ASN A 269 479.831 450.578 390.875 1.00 0.00 C +ATOM 270 CA GLN A 270 482.190 452.817 388.891 1.00 0.00 C +ATOM 271 CA PRO A 271 483.569 455.269 391.461 1.00 0.00 C +ATOM 272 CA GLY A 272 481.182 458.212 391.861 1.00 0.00 C +ATOM 273 CA LEU A 273 481.289 461.565 393.666 1.00 0.00 C +ATOM 274 CA THR A 274 479.007 464.574 393.161 1.00 0.00 C +ATOM 275 CA SER A 275 479.053 465.223 389.407 1.00 0.00 C +ATOM 276 CA GLY A 276 480.584 468.563 388.396 1.00 0.00 C +ATOM 277 CA MET A 277 478.480 471.414 386.996 1.00 0.00 C +ATOM 278 CA GLY A 278 476.151 472.290 384.110 1.00 0.00 C +ATOM 279 CA GLU A 279 478.072 472.014 380.831 1.00 0.00 C +ATOM 280 CA GLU A 280 479.779 470.301 377.887 1.00 0.00 C +ATOM 281 CA ARG A 281 481.935 471.865 375.163 1.00 0.00 C +ATOM 282 CA ARG A 282 484.558 474.612 375.459 1.00 0.00 C +ATOM 283 CA ASN A 283 486.388 476.681 372.835 1.00 0.00 C +ATOM 284 CA TYR A 284 487.082 480.418 373.094 1.00 0.00 C +ATOM 285 CA HIS A 285 484.430 482.760 371.680 1.00 0.00 C +ATOM 286 CA SER A 286 481.844 483.929 369.137 1.00 0.00 C +ATOM 287 CA ARG A 287 478.434 483.589 370.802 1.00 0.00 C +ATOM 288 CA GLU A 288 476.135 486.615 370.535 1.00 0.00 C +ATOM 289 CA PHE A 289 476.805 489.964 372.224 1.00 0.00 C +ATOM 290 CA ILE A 290 476.670 493.759 371.923 1.00 0.00 C +ATOM 291 CA ARG A 291 475.439 495.764 368.925 1.00 0.00 C +ATOM 292 CA PRO A 292 475.261 499.088 367.072 1.00 0.00 C +ATOM 293 CA ASP A 293 477.053 501.564 369.346 1.00 0.00 C +ATOM 294 CA ASP A 294 480.141 500.425 371.265 1.00 0.00 C +ATOM 295 CA ARG A 295 480.281 502.548 374.426 1.00 0.00 C +ATOM 296 CA ASP A 296 478.437 503.484 377.626 1.00 0.00 C +ATOM 297 CA THR A 297 474.871 504.642 376.948 1.00 0.00 C +ATOM 298 CA ARG A 298 472.183 502.159 378.008 1.00 0.00 C +ATOM 299 CA ARG A 299 471.216 500.358 374.792 1.00 0.00 C +ATOM 300 CA GLY A 300 469.293 497.201 373.870 1.00 0.00 C +ATOM 301 CA PHE A 301 468.519 495.271 370.677 1.00 0.00 C +ATOM 302 CA SER A 302 470.704 492.152 370.554 1.00 0.00 C +ATOM 303 CA ASP A 303 468.386 489.186 369.961 1.00 0.00 C +ATOM 304 CA TYR A 304 469.734 485.634 370.249 1.00 0.00 C +ATOM 305 CA ARG A 305 470.391 482.623 368.008 1.00 0.00 C +ATOM 306 CA SER A 306 472.080 483.825 364.812 1.00 0.00 C +ATOM 307 CA ALA A 307 469.505 483.927 362.006 1.00 0.00 C +ATOM 308 CA GLY A 308 466.031 483.300 363.438 1.00 0.00 C +ATOM 309 CA GLN A 309 463.494 485.557 365.166 1.00 0.00 C +ATOM 310 CA ARG A 310 462.740 488.639 367.276 1.00 0.00 C +ATOM 311 CA ASN A 311 463.180 492.415 367.024 1.00 0.00 C +ATOM 312 CA GLY A 312 465.515 494.926 365.363 1.00 0.00 C +ATOM 313 CA TYR A 313 466.381 498.505 364.383 1.00 0.00 C +ATOM 314 CA ASP A 314 465.736 501.022 367.169 1.00 0.00 C +ATOM 315 CA SER A 315 462.135 501.671 368.232 1.00 0.00 C +ATOM 316 CA ARG A 316 459.022 499.787 367.105 1.00 0.00 C +ATOM 317 CA GLY A 317 457.308 496.420 367.597 1.00 0.00 C +ATOM 318 CA ARG A 318 457.787 494.426 364.386 1.00 0.00 C +ATOM 319 CA GLY A 319 455.780 494.619 361.153 1.00 0.00 C +ATOM 320 CA PHE A 320 454.334 491.159 360.479 1.00 0.00 C +ATOM 321 CA ALA A 321 454.340 490.637 356.705 1.00 0.00 C +ATOM 322 CA GLY A 322 451.123 492.259 355.466 1.00 0.00 C +ATOM 323 CA ARG A 323 447.528 492.278 356.727 1.00 0.00 C +ATOM 324 CA GLY A 324 446.962 493.794 360.176 1.00 0.00 C +ATOM 325 CA GLY A 325 443.937 495.723 361.458 1.00 0.00 C +ATOM 326 CA ARG A 326 440.155 496.131 361.673 1.00 0.00 C +ATOM 327 CA GLY A 327 438.629 492.737 360.858 1.00 0.00 C +ATOM 328 CA ARG A 328 439.649 491.445 357.422 1.00 0.00 C +ATOM 329 CA ASP A 329 438.056 488.418 355.743 1.00 0.00 C +ATOM 330 CA ARG A 330 440.386 487.181 352.994 1.00 0.00 C +ATOM 331 CA PHE A 331 443.958 486.329 351.977 1.00 0.00 C +ATOM 332 CA ASP A 332 447.404 487.756 352.754 1.00 0.00 C +ATOM 333 CA TYR A 333 450.611 485.743 352.328 1.00 0.00 C +ATOM 334 CA GLN A 334 449.893 482.973 349.812 1.00 0.00 C +ATOM 335 CA TYR A 335 450.795 481.473 346.428 1.00 0.00 C +ATOM 336 CA GLY A 336 453.752 479.281 345.446 1.00 0.00 C +ATOM 337 CA GLY A 337 457.436 480.215 345.174 1.00 0.00 C +ATOM 338 CA LYS A 338 459.437 482.475 342.850 1.00 0.00 C +ATOM 339 CA LYS A 339 462.807 483.903 341.792 1.00 0.00 C +ATOM 340 CA GLN A 340 464.739 486.659 343.579 1.00 0.00 C +ATOM 341 CA HIS A 341 462.315 488.267 346.039 1.00 0.00 C +ATOM 342 CA ALA A 342 463.395 488.191 349.692 1.00 0.00 C +ATOM 343 CA ARG A 343 466.463 488.713 351.890 1.00 0.00 C +ATOM 344 CA GLY A 344 468.764 490.923 353.973 1.00 0.00 C +ATOM 345 CA CYS A 345 469.573 494.211 352.227 1.00 0.00 C +ATOM 346 CA TRP A 346 470.649 496.282 349.215 1.00 0.00 C +ATOM 347 CA ARG A 347 473.401 498.668 350.332 1.00 0.00 C +ATOM 348 CA THR A 348 472.589 502.346 350.903 1.00 0.00 C +ATOM 349 CA ASN A 349 472.233 506.096 350.332 1.00 0.00 C +ATOM 350 CA ARG A 350 468.981 507.532 348.960 1.00 0.00 C +ATOM 351 CA GLU A 351 466.121 505.500 350.444 1.00 0.00 C +ATOM 352 CA MET A 352 463.866 502.584 351.408 1.00 0.00 C +ATOM 353 CA GLU A 353 460.499 501.039 350.516 1.00 0.00 C +ATOM 354 CA ALA A 354 458.923 499.573 353.660 1.00 0.00 C +TER 355 ALA A 354 +END diff --git a/Plants/Q9FNW1/Q9FNW1.dcd b/Plants/Q9FNW1/Q9FNW1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..54e1960a527f3624d1f7f38548e1ae6311f62976 --- /dev/null +++ b/Plants/Q9FNW1/Q9FNW1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:acf18280d5911ba79871c4f27ba325f85b7978b5c6853d14a6fe93fa13551395 +size 21200276 diff --git a/Plants/Q9FNW1/top.pdb b/Plants/Q9FNW1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..5a1d85b01542a1796012aaddaf94a49dda35bd31 --- /dev/null +++ b/Plants/Q9FNW1/top.pdb @@ -0,0 +1,174 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 272.395 300.752 175.238 1.00 0.00 C +ATOM 2 CA GLN A 2 270.059 302.909 177.338 1.00 0.00 C +ATOM 3 CA GLU A 3 267.624 303.328 180.238 1.00 0.00 C +ATOM 4 CA GLU A 4 264.174 302.377 178.932 1.00 0.00 C +ATOM 5 CA LYS A 5 260.926 300.405 178.655 1.00 0.00 C +ATOM 6 CA LYS A 6 258.759 298.290 180.968 1.00 0.00 C +ATOM 7 CA ALA A 7 259.869 299.035 184.536 1.00 0.00 C +ATOM 8 CA GLY A 8 263.231 300.113 185.969 1.00 0.00 C +ATOM 9 CA LYS A 9 264.372 299.636 189.573 1.00 0.00 C +ATOM 10 CA SER A 10 264.409 301.997 192.563 1.00 0.00 C +ATOM 11 CA ILE A 11 266.357 300.600 195.524 1.00 0.00 C +ATOM 12 CA LYS A 12 268.562 297.681 196.587 1.00 0.00 C +ATOM 13 CA GLU A 13 271.223 296.993 199.225 1.00 0.00 C +ATOM 14 CA PRO A 14 273.585 299.459 200.916 1.00 0.00 C +ATOM 15 CA ALA A 15 272.813 303.190 200.856 1.00 0.00 C +ATOM 16 CA ALA A 16 275.092 304.769 203.469 1.00 0.00 C +ATOM 17 CA THR A 17 276.899 301.984 205.338 1.00 0.00 C +ATOM 18 CA ILE A 18 278.008 303.416 208.690 1.00 0.00 C +ATOM 19 CA GLY A 19 281.788 303.886 208.589 1.00 0.00 C +ATOM 20 CA ALA A 20 285.013 304.434 206.636 1.00 0.00 C +ATOM 21 CA SER A 21 286.898 303.984 203.356 1.00 0.00 C +ATOM 22 CA ALA A 22 289.767 302.638 201.241 1.00 0.00 C +ATOM 23 CA LYS A 23 289.141 301.541 197.646 1.00 0.00 C +ATOM 24 CA VAL A 24 290.624 304.170 195.322 1.00 0.00 C +ATOM 25 CA TRP A 25 292.689 305.541 192.428 1.00 0.00 C +ATOM 26 CA HIS A 26 293.007 303.568 189.184 1.00 0.00 C +ATOM 27 CA GLU A 27 291.146 304.027 185.891 1.00 0.00 C +ATOM 28 CA GLU A 28 292.038 301.009 183.744 1.00 0.00 C +ATOM 29 CA ASN A 29 290.330 298.928 181.048 1.00 0.00 C +ATOM 30 CA GLN A 30 288.693 296.999 178.200 1.00 0.00 C +ATOM 31 CA GLY A 31 287.619 294.308 175.726 1.00 0.00 C +ATOM 32 CA HIS A 32 285.278 291.968 173.838 1.00 0.00 C +ATOM 33 CA CYS A 33 285.303 288.292 174.840 1.00 0.00 C +ATOM 34 CA PRO A 34 284.147 286.453 177.970 1.00 0.00 C +ATOM 35 CA ARG A 35 284.321 282.647 178.017 1.00 0.00 C +ATOM 36 CA GLU A 36 282.446 279.515 179.106 1.00 0.00 C +ATOM 37 CA ALA A 37 280.015 278.733 181.934 1.00 0.00 C +ATOM 38 CA GLU A 38 279.392 280.550 185.224 1.00 0.00 C +ATOM 39 CA ARG A 39 278.068 278.459 188.121 1.00 0.00 C +ATOM 40 CA MET A 40 277.847 276.874 191.578 1.00 0.00 C +ATOM 41 CA THR A 41 277.198 276.946 195.332 1.00 0.00 C +ATOM 42 CA ALA A 42 275.180 278.227 198.299 1.00 0.00 C +ATOM 43 CA ARG A 43 272.843 275.479 199.525 1.00 0.00 C +ATOM 44 CA ASP A 44 269.492 275.423 201.338 1.00 0.00 C +ATOM 45 CA PRO A 45 269.455 278.015 204.130 1.00 0.00 C +ATOM 46 CA MET A 46 266.669 278.942 206.557 1.00 0.00 C +ATOM 47 CA GLN A 47 265.163 278.835 210.055 1.00 0.00 C +ATOM 48 CA LYS A 48 264.780 277.745 213.686 1.00 0.00 C +ATOM 49 CA GLU A 49 264.921 279.487 217.071 1.00 0.00 C +ATOM 50 CA LEU A 50 262.401 279.471 219.929 1.00 0.00 C +ATOM 51 CA ALA A 51 258.616 279.787 220.228 1.00 0.00 C +ATOM 52 CA THR A 52 256.985 276.471 219.299 1.00 0.00 C +ATOM 53 CA GLN A 53 254.735 273.398 219.393 1.00 0.00 C +ATOM 54 CA LYS A 54 251.800 273.373 221.822 1.00 0.00 C +ATOM 55 CA LYS A 55 248.565 271.786 220.583 1.00 0.00 C +ATOM 56 CA ASP A 56 247.093 274.215 218.043 1.00 0.00 C +ATOM 57 CA ALA A 57 243.628 273.166 216.855 1.00 0.00 C +ATOM 58 CA LYS A 58 240.104 273.225 218.302 1.00 0.00 C +ATOM 59 CA MET A 59 240.095 274.113 222.006 1.00 0.00 C +ATOM 60 CA SER A 60 239.532 271.550 224.769 1.00 0.00 C +ATOM 61 CA GLN A 61 240.048 267.899 223.811 1.00 0.00 C +ATOM 62 CA ALA A 62 243.715 267.239 223.012 1.00 0.00 C +ATOM 63 CA GLU A 63 245.050 263.809 222.028 1.00 0.00 C +ATOM 64 CA LEU A 64 245.082 260.068 222.753 1.00 0.00 C +ATOM 65 CA ASP A 65 247.340 258.128 225.130 1.00 0.00 C +ATOM 66 CA LYS A 66 250.138 259.621 227.242 1.00 0.00 C +ATOM 67 CA GLN A 67 253.758 258.595 227.834 1.00 0.00 C +ATOM 68 CA ALA A 68 256.732 259.927 225.859 1.00 0.00 C +ATOM 69 CA ALA A 69 259.272 261.637 228.126 1.00 0.00 C +ATOM 70 CA ARG A 70 262.898 262.472 228.945 1.00 0.00 C +ATOM 71 CA GLN A 71 262.963 263.731 232.540 1.00 0.00 C +ATOM 72 CA HIS A 72 264.904 261.626 235.053 1.00 0.00 C +ATOM 73 CA ASN A 73 265.957 259.167 237.767 1.00 0.00 C +ATOM 74 CA THR A 74 265.898 256.299 240.275 1.00 0.00 C +ATOM 75 CA ALA A 75 268.102 253.197 240.464 1.00 0.00 C +ATOM 76 CA ALA A 76 268.551 250.355 237.967 1.00 0.00 C +ATOM 77 CA LYS A 77 265.193 249.012 236.770 1.00 0.00 C +ATOM 78 CA GLN A 78 265.443 248.123 233.073 1.00 0.00 C +ATOM 79 CA ALA A 79 266.343 248.147 229.371 1.00 0.00 C +ATOM 80 CA ALA A 80 263.861 250.439 227.610 1.00 0.00 C +ATOM 81 CA THR A 81 261.537 253.244 226.493 1.00 0.00 C +ATOM 82 CA ALA A 82 258.044 254.053 227.780 1.00 0.00 C +ATOM 83 CA GLY A 83 257.669 253.913 231.569 1.00 0.00 C +ATOM 84 CA HIS A 84 259.268 254.028 235.025 1.00 0.00 C +ATOM 85 CA MET A 85 258.768 254.429 238.781 1.00 0.00 C +ATOM 86 CA GLY A 86 258.939 251.233 240.848 1.00 0.00 C +ATOM 87 CA GLN A 87 256.693 248.499 239.435 1.00 0.00 C +ATOM 88 CA GLY A 88 255.614 245.891 241.993 1.00 0.00 C +ATOM 89 CA HIS A 89 257.410 243.523 244.377 1.00 0.00 C +ATOM 90 CA HIS A 90 259.501 244.137 247.502 1.00 0.00 C +ATOM 91 CA THR A 91 260.556 243.811 251.148 1.00 0.00 C +ATOM 92 CA PRO A 92 259.574 246.537 253.622 1.00 0.00 C +ATOM 93 CA GLY A 93 260.167 246.802 257.376 1.00 0.00 C +ATOM 94 CA THR A 94 258.901 243.557 258.921 1.00 0.00 C +ATOM 95 CA ALA A 95 257.594 239.988 258.670 1.00 0.00 C +ATOM 96 CA THR A 96 255.570 238.956 261.728 1.00 0.00 C +ATOM 97 CA TYR A 97 252.529 241.039 262.693 1.00 0.00 C +ATOM 98 CA SER A 98 249.840 240.776 260.006 1.00 0.00 C +ATOM 99 CA THR A 99 246.174 241.556 259.320 1.00 0.00 C +ATOM 100 CA THR A 100 242.941 241.247 257.328 1.00 0.00 C +ATOM 101 CA GLY A 101 239.478 242.521 258.276 1.00 0.00 C +ATOM 102 CA GLU A 102 236.527 240.563 259.682 1.00 0.00 C +ATOM 103 CA HIS A 103 233.743 238.079 260.455 1.00 0.00 C +ATOM 104 CA GLY A 104 231.282 238.486 257.575 1.00 0.00 C +ATOM 105 CA GLN A 105 227.776 239.305 258.822 1.00 0.00 C +ATOM 106 CA PRO A 106 224.114 238.255 258.863 1.00 0.00 C +ATOM 107 CA MET A 107 220.883 236.851 260.313 1.00 0.00 C +ATOM 108 CA GLY A 108 220.221 234.744 263.418 1.00 0.00 C +ATOM 109 CA ALA A 109 220.487 231.925 265.967 1.00 0.00 C +ATOM 110 CA HIS A 110 220.914 230.115 269.292 1.00 0.00 C +ATOM 111 CA GLN A 111 219.249 231.661 272.352 1.00 0.00 C +ATOM 112 CA THR A 112 220.963 231.259 275.730 1.00 0.00 C +ATOM 113 CA SER A 113 224.677 230.607 275.183 1.00 0.00 C +ATOM 114 CA ALA A 114 228.430 230.380 274.567 1.00 0.00 C +ATOM 115 CA MET A 115 231.770 229.695 276.268 1.00 0.00 C +ATOM 116 CA PRO A 116 234.309 232.517 276.591 1.00 0.00 C +ATOM 117 CA GLY A 117 234.764 236.058 277.921 1.00 0.00 C +ATOM 118 CA HIS A 118 231.695 237.441 279.706 1.00 0.00 C +ATOM 119 CA GLY A 119 229.154 238.082 282.472 1.00 0.00 C +ATOM 120 CA THR A 120 226.670 235.641 284.015 1.00 0.00 C +ATOM 121 CA GLY A 121 222.974 234.727 284.158 1.00 0.00 C +ATOM 122 CA GLN A 122 219.764 232.694 284.441 1.00 0.00 C +ATOM 123 CA PRO A 123 218.695 230.481 287.352 1.00 0.00 C +ATOM 124 CA THR A 124 221.082 228.854 289.836 1.00 0.00 C +ATOM 125 CA GLY A 125 221.504 230.180 293.383 1.00 0.00 C +ATOM 126 CA HIS A 126 219.042 229.232 296.132 1.00 0.00 C +ATOM 127 CA VAL A 127 217.481 225.822 296.805 1.00 0.00 C +ATOM 128 CA THR A 128 214.295 223.775 297.223 1.00 0.00 C +ATOM 129 CA GLU A 129 213.511 220.109 297.905 1.00 0.00 C +ATOM 130 CA GLY A 130 215.537 218.182 300.492 1.00 0.00 C +ATOM 131 CA VAL A 131 219.133 217.321 301.412 1.00 0.00 C +ATOM 132 CA VAL A 132 222.394 217.333 303.382 1.00 0.00 C +ATOM 133 CA GLY A 133 226.083 218.038 304.022 1.00 0.00 C +ATOM 134 CA SER A 134 229.180 219.290 305.854 1.00 0.00 C +ATOM 135 CA HIS A 135 230.971 218.807 309.182 1.00 0.00 C +ATOM 136 CA PRO A 136 231.634 215.308 310.538 1.00 0.00 C +ATOM 137 CA ILE A 137 235.097 213.720 310.580 1.00 0.00 C +ATOM 138 CA GLY A 138 238.860 213.931 310.018 1.00 0.00 C +ATOM 139 CA THR A 139 242.105 212.811 311.670 1.00 0.00 C +ATOM 140 CA ASN A 140 244.444 209.803 311.709 1.00 0.00 C +ATOM 141 CA ARG A 141 243.031 206.425 312.760 1.00 0.00 C +ATOM 142 CA GLY A 142 243.017 203.821 315.541 1.00 0.00 C +ATOM 143 CA PRO A 143 241.394 204.578 318.904 1.00 0.00 C +ATOM 144 CA GLY A 144 241.448 202.078 321.778 1.00 0.00 C +ATOM 145 CA GLY A 145 239.026 199.716 323.531 1.00 0.00 C +ATOM 146 CA THR A 146 238.348 196.836 321.130 1.00 0.00 C +ATOM 147 CA ALA A 147 237.065 193.439 322.282 1.00 0.00 C +ATOM 148 CA THR A 148 234.741 190.458 321.801 1.00 0.00 C +ATOM 149 CA ALA A 149 232.022 188.037 322.925 1.00 0.00 C +ATOM 150 CA HIS A 150 229.545 188.428 325.792 1.00 0.00 C +ATOM 151 CA ASN A 151 231.080 191.039 328.104 1.00 0.00 C +ATOM 152 CA THR A 152 230.101 190.973 331.786 1.00 0.00 C +ATOM 153 CA ARG A 153 230.651 193.587 334.502 1.00 0.00 C +ATOM 154 CA ALA A 154 233.102 196.096 333.014 1.00 0.00 C +ATOM 155 CA GLY A 155 232.477 199.339 331.115 1.00 0.00 C +ATOM 156 CA GLY A 156 231.943 200.447 327.508 1.00 0.00 C +ATOM 157 CA ASN A 157 229.507 200.213 324.588 1.00 0.00 C +ATOM 158 CA PRO A 158 231.236 201.754 321.563 1.00 0.00 C +ATOM 159 CA ASN A 159 231.050 199.164 318.775 1.00 0.00 C +ATOM 160 CA ASP A 160 228.739 196.277 317.857 1.00 0.00 C +ATOM 161 CA TYR A 161 225.156 196.838 319.025 1.00 0.00 C +ATOM 162 CA GLY A 162 223.592 199.954 320.562 1.00 0.00 C +ATOM 163 CA TYR A 163 220.262 201.170 321.958 1.00 0.00 C +ATOM 164 CA GLY A 164 217.527 198.724 320.934 1.00 0.00 C +ATOM 165 CA THR A 165 216.615 196.391 323.805 1.00 0.00 C +ATOM 166 CA GLY A 166 216.847 192.743 324.879 1.00 0.00 C +ATOM 167 CA GLY A 167 214.912 189.486 324.467 1.00 0.00 C +ATOM 168 CA THR A 168 213.184 186.329 325.718 1.00 0.00 C +ATOM 169 CA TYR A 169 211.678 185.260 329.050 1.00 0.00 C +ATOM 170 CA ASN A 170 208.093 183.970 329.066 1.00 0.00 C +TER 171 ASN A 170 +END diff --git a/Plants/Q9FP55/Q9FP55.dcd b/Plants/Q9FP55/Q9FP55.dcd new file mode 100644 index 0000000000000000000000000000000000000000..1aa1b899d1716968caabcfe4bd302381b5d67a9e --- /dev/null +++ b/Plants/Q9FP55/Q9FP55.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:8a55a064725b3d57ff7e3316e8efe4d2c0124a3b288061f61957fe5b7f83f43d +size 8000276 diff --git a/Plants/Q9FP55/top.pdb b/Plants/Q9FP55/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..f14b21d9933b9a626d493180afb0e07a3bd2bddb --- /dev/null +++ b/Plants/Q9FP55/top.pdb @@ -0,0 +1,64 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 216.994 247.324 221.340 1.00 0.00 C +ATOM 2 CA ALA A 2 217.666 249.936 224.031 1.00 0.00 C +ATOM 3 CA LYS A 3 219.282 249.341 227.430 1.00 0.00 C +ATOM 4 CA SER A 4 216.953 247.724 229.975 1.00 0.00 C +ATOM 5 CA LYS A 5 219.004 246.388 232.895 1.00 0.00 C +ATOM 6 CA ASN A 6 217.376 243.311 234.443 1.00 0.00 C +ATOM 7 CA HIS A 7 219.902 241.742 236.825 1.00 0.00 C +ATOM 8 CA THR A 8 221.185 243.268 240.072 1.00 0.00 C +ATOM 9 CA ALA A 9 221.331 244.667 243.613 1.00 0.00 C +ATOM 10 CA HIS A 10 221.768 242.730 246.864 1.00 0.00 C +ATOM 11 CA ASN A 11 224.537 244.060 249.120 1.00 0.00 C +ATOM 12 CA GLN A 12 224.112 246.309 252.166 1.00 0.00 C +ATOM 13 CA SER A 13 224.363 244.872 255.686 1.00 0.00 C +ATOM 14 CA TYR A 14 227.497 246.128 257.451 1.00 0.00 C +ATOM 15 CA LYS A 15 231.252 245.722 257.953 1.00 0.00 C +ATOM 16 CA ALA A 16 233.512 247.343 255.349 1.00 0.00 C +ATOM 17 CA HIS A 17 236.057 246.668 252.595 1.00 0.00 C +ATOM 18 CA LYS A 18 239.636 245.368 252.482 1.00 0.00 C +ATOM 19 CA ASN A 19 241.115 244.150 255.775 1.00 0.00 C +ATOM 20 CA GLY A 20 239.310 241.999 258.351 1.00 0.00 C +ATOM 21 CA ILE A 21 241.703 241.043 261.156 1.00 0.00 C +ATOM 22 CA LYS A 22 245.493 240.689 261.324 1.00 0.00 C +ATOM 23 CA LYS A 23 247.157 238.009 259.187 1.00 0.00 C +ATOM 24 CA PRO A 24 250.956 238.299 259.152 1.00 0.00 C +ATOM 25 CA LYS A 25 253.291 238.435 262.160 1.00 0.00 C +ATOM 26 CA ARG A 26 256.727 236.844 262.583 1.00 0.00 C +ATOM 27 CA HIS A 27 258.579 234.370 264.811 1.00 0.00 C +ATOM 28 CA ARG A 28 262.199 235.435 265.337 1.00 0.00 C +ATOM 29 CA GLN A 29 264.082 236.917 268.299 1.00 0.00 C +ATOM 30 CA THR A 30 266.449 239.830 267.640 1.00 0.00 C +ATOM 31 CA SER A 31 270.042 238.640 267.209 1.00 0.00 C +ATOM 32 CA THR A 32 273.237 240.600 267.895 1.00 0.00 C +ATOM 33 CA LYS A 33 274.906 241.457 264.579 1.00 0.00 C +ATOM 34 CA GLY A 34 273.018 243.484 261.963 1.00 0.00 C +ATOM 35 CA MET A 35 271.528 246.951 262.488 1.00 0.00 C +ATOM 36 CA ASP A 36 269.224 249.821 263.472 1.00 0.00 C +ATOM 37 CA PRO A 37 266.887 252.289 265.194 1.00 0.00 C +ATOM 38 CA LYS A 38 266.962 255.711 263.521 1.00 0.00 C +ATOM 39 CA PHE A 39 264.426 258.361 264.550 1.00 0.00 C +ATOM 40 CA LEU A 40 265.673 261.945 264.208 1.00 0.00 C +ATOM 41 CA ARG A 41 267.840 265.022 263.615 1.00 0.00 C +ATOM 42 CA ASN A 42 265.544 267.420 261.746 1.00 0.00 C +ATOM 43 CA GLN A 43 262.810 267.264 259.097 1.00 0.00 C +ATOM 44 CA ARG A 44 263.062 265.710 255.628 1.00 0.00 C +ATOM 45 CA TYR A 45 260.445 266.716 253.048 1.00 0.00 C +ATOM 46 CA SER A 46 257.005 265.987 251.581 1.00 0.00 C +ATOM 47 CA ARG A 47 256.394 262.325 250.726 1.00 0.00 C +ATOM 48 CA LYS A 48 259.567 260.400 249.863 1.00 0.00 C +ATOM 49 CA HIS A 49 260.516 256.831 248.928 1.00 0.00 C +ATOM 50 CA ASN A 50 261.395 255.641 245.417 1.00 0.00 C +ATOM 51 CA LYS A 51 258.621 255.398 242.817 1.00 0.00 C +ATOM 52 CA LYS A 52 259.560 257.394 239.710 1.00 0.00 C +ATOM 53 CA SER A 53 261.377 255.463 236.974 1.00 0.00 C +ATOM 54 CA GLY A 54 263.930 254.471 234.325 1.00 0.00 C +ATOM 55 CA GLU A 55 263.946 256.777 231.292 1.00 0.00 C +ATOM 56 CA ALA A 56 264.793 259.749 229.063 1.00 0.00 C +ATOM 57 CA GLU A 57 265.831 261.282 225.733 1.00 0.00 C +ATOM 58 CA SER A 58 265.734 261.110 221.928 1.00 0.00 C +ATOM 59 CA GLU A 59 262.593 262.371 220.178 1.00 0.00 C +ATOM 60 CA GLU A 60 263.647 264.489 217.191 1.00 0.00 C +TER 61 GLU A 60 +END diff --git a/Plants/Q9FP91/Q9FP91.dcd b/Plants/Q9FP91/Q9FP91.dcd new file mode 100644 index 0000000000000000000000000000000000000000..4bd3540cb32ecb8a9e437205f1437d6235836692 --- /dev/null +++ b/Plants/Q9FP91/Q9FP91.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:4131f6d5d905c94455dd064e9cfae4240ac56acc7ea538ad415c9c87f1e2566d +size 8960276 diff --git a/Plants/Q9FP91/top.pdb b/Plants/Q9FP91/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..be470f5ce87f9c735a64a904d0c192055011b58b --- /dev/null +++ b/Plants/Q9FP91/top.pdb @@ -0,0 +1,72 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 232.140 272.096 236.970 1.00 0.00 C +ATOM 2 CA ASP A 2 235.850 272.843 237.414 1.00 0.00 C +ATOM 3 CA ASP A 3 237.750 269.638 236.622 1.00 0.00 C +ATOM 4 CA PHE A 4 238.398 266.380 234.755 1.00 0.00 C +ATOM 5 CA GLU A 5 240.775 267.061 231.856 1.00 0.00 C +ATOM 6 CA GLU A 6 243.176 264.171 231.230 1.00 0.00 C +ATOM 7 CA HIS A 7 245.708 264.358 234.071 1.00 0.00 C +ATOM 8 CA GLY A 8 248.553 262.581 235.878 1.00 0.00 C +ATOM 9 CA ILE A 9 248.041 259.550 238.129 1.00 0.00 C +ATOM 10 CA SER A 10 245.993 259.593 241.342 1.00 0.00 C +ATOM 11 CA SER A 11 245.955 259.193 245.130 1.00 0.00 C +ATOM 12 CA ARG A 12 244.087 260.474 248.194 1.00 0.00 C +ATOM 13 CA GLU A 13 241.511 263.213 247.580 1.00 0.00 C +ATOM 14 CA ASP A 14 239.913 266.168 245.783 1.00 0.00 C +ATOM 15 CA SER A 15 236.545 267.817 246.457 1.00 0.00 C +ATOM 16 CA ASP A 16 236.815 271.501 245.524 1.00 0.00 C +ATOM 17 CA CYS A 17 236.485 274.498 243.195 1.00 0.00 C +ATOM 18 CA SER A 18 238.104 277.606 241.701 1.00 0.00 C +ATOM 19 CA LYS A 19 239.806 279.485 244.545 1.00 0.00 C +ATOM 20 CA ALA A 20 237.075 280.339 247.061 1.00 0.00 C +ATOM 21 CA ASN A 21 238.139 280.272 250.719 1.00 0.00 C +ATOM 22 CA CYS A 22 241.766 281.184 251.446 1.00 0.00 C +ATOM 23 CA SER A 23 243.812 278.679 249.433 1.00 0.00 C +ATOM 24 CA ILE A 24 245.913 275.891 250.958 1.00 0.00 C +ATOM 25 CA SER A 25 247.249 273.513 248.298 1.00 0.00 C +ATOM 26 CA ASN A 26 248.542 269.929 248.345 1.00 0.00 C +ATOM 27 CA TYR A 27 251.733 268.007 247.547 1.00 0.00 C +ATOM 28 CA VAL A 28 252.816 264.646 248.977 1.00 0.00 C +ATOM 29 CA PRO A 29 255.870 264.422 251.245 1.00 0.00 C +ATOM 30 CA SER A 30 255.908 261.723 253.934 1.00 0.00 C +ATOM 31 CA LYS A 31 257.785 258.418 253.667 1.00 0.00 C +ATOM 32 CA ASP A 32 256.517 255.320 255.487 1.00 0.00 C +ATOM 33 CA ALA A 33 253.311 253.278 255.238 1.00 0.00 C +ATOM 34 CA THR A 34 252.332 251.226 258.295 1.00 0.00 C +ATOM 35 CA GLY A 35 254.721 249.849 260.924 1.00 0.00 C +ATOM 36 CA GLU A 36 255.805 247.488 263.711 1.00 0.00 C +ATOM 37 CA HIS A 37 257.490 244.401 262.245 1.00 0.00 C +ATOM 38 CA SER A 38 258.811 241.489 260.175 1.00 0.00 C +ATOM 39 CA ALA A 39 256.733 240.970 257.024 1.00 0.00 C +ATOM 40 CA GLY A 40 257.462 240.044 253.400 1.00 0.00 C +ATOM 41 CA LYS A 41 257.836 236.580 251.859 1.00 0.00 C +ATOM 42 CA ASP A 42 256.837 233.399 253.703 1.00 0.00 C +ATOM 43 CA ASN A 43 257.886 231.483 256.824 1.00 0.00 C +ATOM 44 CA SER A 44 255.589 230.471 259.691 1.00 0.00 C +ATOM 45 CA SER A 45 251.855 229.714 259.646 1.00 0.00 C +ATOM 46 CA ALA A 46 250.340 231.736 256.793 1.00 0.00 C +ATOM 47 CA GLU A 47 251.778 235.238 256.371 1.00 0.00 C +ATOM 48 CA SER A 48 249.890 237.835 258.423 1.00 0.00 C +ATOM 49 CA GLU A 49 246.531 237.132 260.078 1.00 0.00 C +ATOM 50 CA SER A 50 243.829 235.691 257.812 1.00 0.00 C +ATOM 51 CA ASN A 51 244.814 235.273 254.155 1.00 0.00 C +ATOM 52 CA ARG A 52 246.866 233.907 251.250 1.00 0.00 C +ATOM 53 CA VAL A 53 249.455 234.190 248.470 1.00 0.00 C +ATOM 54 CA GLU A 54 250.418 231.506 245.942 1.00 0.00 C +ATOM 55 CA VAL A 55 250.081 227.958 247.288 1.00 0.00 C +ATOM 56 CA GLN A 56 251.818 225.482 249.605 1.00 0.00 C +ATOM 57 CA GLN A 57 250.350 223.240 252.314 1.00 0.00 C +ATOM 58 CA SER A 58 252.777 222.386 255.124 1.00 0.00 C +ATOM 59 CA SER A 59 256.321 223.492 254.268 1.00 0.00 C +ATOM 60 CA ASP A 60 259.430 221.421 255.019 1.00 0.00 C +ATOM 61 CA SER A 61 262.295 219.393 256.500 1.00 0.00 C +ATOM 62 CA ALA A 62 264.484 221.667 258.633 1.00 0.00 C +ATOM 63 CA ILE A 63 264.551 225.295 257.472 1.00 0.00 C +ATOM 64 CA ASN A 64 263.604 227.975 254.934 1.00 0.00 C +ATOM 65 CA LYS A 65 263.278 231.346 253.189 1.00 0.00 C +ATOM 66 CA MET A 66 263.912 230.622 249.503 1.00 0.00 C +ATOM 67 CA LYS A 67 264.795 233.333 246.976 1.00 0.00 C +ATOM 68 CA VAL A 68 262.983 232.923 243.650 1.00 0.00 C +TER 69 VAL A 68 +END diff --git a/Plants/Q9FR31/Q9FR31.dcd b/Plants/Q9FR31/Q9FR31.dcd new file mode 100644 index 0000000000000000000000000000000000000000..e6f698e71fd901842bdbc863ea7b96700cb07b3b --- /dev/null +++ b/Plants/Q9FR31/Q9FR31.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:05b28cc8762c17a1ea4c8be1af38559932179caa497e5a3dfbca34abc52a848d +size 7280276 diff --git a/Plants/Q9FR31/top.pdb b/Plants/Q9FR31/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..1f05d48cc8d683b275e42077eb30588caa0c1b33 --- /dev/null +++ b/Plants/Q9FR31/top.pdb @@ -0,0 +1,58 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 257.018 236.576 236.252 1.00 0.00 C +ATOM 2 CA ALA A 2 254.956 233.406 235.785 1.00 0.00 C +ATOM 3 CA LYS A 3 251.325 232.269 235.591 1.00 0.00 C +ATOM 4 CA SER A 4 249.519 229.414 237.353 1.00 0.00 C +ATOM 5 CA LYS A 5 250.425 227.237 240.346 1.00 0.00 C +ATOM 6 CA ASN A 6 250.764 223.576 241.346 1.00 0.00 C +ATOM 7 CA HIS A 7 252.014 220.092 240.443 1.00 0.00 C +ATOM 8 CA THR A 8 251.437 217.418 243.095 1.00 0.00 C +ATOM 9 CA ALA A 9 248.691 215.312 244.688 1.00 0.00 C +ATOM 10 CA HIS A 10 246.093 217.818 245.907 1.00 0.00 C +ATOM 11 CA ASN A 11 244.232 221.120 245.527 1.00 0.00 C +ATOM 12 CA GLN A 12 244.764 224.249 243.418 1.00 0.00 C +ATOM 13 CA SER A 13 243.527 227.133 241.257 1.00 0.00 C +ATOM 14 CA TYR A 14 241.874 230.517 241.833 1.00 0.00 C +ATOM 15 CA LYS A 15 241.565 233.429 244.270 1.00 0.00 C +ATOM 16 CA ALA A 16 239.171 236.344 244.811 1.00 0.00 C +ATOM 17 CA HIS A 17 238.138 238.918 247.423 1.00 0.00 C +ATOM 18 CA ARG A 18 236.936 237.826 250.870 1.00 0.00 C +ATOM 19 CA ASN A 19 233.336 236.590 251.054 1.00 0.00 C +ATOM 20 CA GLY A 20 232.077 237.254 254.588 1.00 0.00 C +ATOM 21 CA ILE A 21 231.673 240.110 257.078 1.00 0.00 C +ATOM 22 CA LYS A 22 234.887 241.792 258.243 1.00 0.00 C +ATOM 23 CA LYS A 23 236.999 243.291 261.037 1.00 0.00 C +ATOM 24 CA PRO A 24 236.757 246.905 262.219 1.00 0.00 C +ATOM 25 CA ARG A 25 239.663 247.707 264.549 1.00 0.00 C +ATOM 26 CA LYS A 26 243.267 247.726 263.312 1.00 0.00 C +ATOM 27 CA HIS A 27 246.022 246.733 265.749 1.00 0.00 C +ATOM 28 CA ARG A 28 249.730 246.239 265.025 1.00 0.00 C +ATOM 29 CA HIS A 29 252.293 243.421 264.977 1.00 0.00 C +ATOM 30 CA SER A 30 255.080 243.661 267.565 1.00 0.00 C +ATOM 31 CA SER A 31 256.284 247.133 268.571 1.00 0.00 C +ATOM 32 CA THR A 32 256.960 249.065 265.357 1.00 0.00 C +ATOM 33 CA LYS A 33 259.881 250.786 263.619 1.00 0.00 C +ATOM 34 CA GLY A 34 261.273 249.389 260.360 1.00 0.00 C +ATOM 35 CA MET A 35 261.770 250.943 256.917 1.00 0.00 C +ATOM 36 CA ASP A 36 261.228 251.927 253.276 1.00 0.00 C +ATOM 37 CA PRO A 37 259.524 255.255 252.544 1.00 0.00 C +ATOM 38 CA LYS A 38 259.590 257.609 249.549 1.00 0.00 C +ATOM 39 CA PHE A 39 257.614 260.123 247.477 1.00 0.00 C +ATOM 40 CA LEU A 40 260.008 262.570 245.806 1.00 0.00 C +ATOM 41 CA ARG A 41 263.285 264.120 244.631 1.00 0.00 C +ATOM 42 CA ASN A 42 264.407 267.202 246.571 1.00 0.00 C +ATOM 43 CA GLN A 43 262.051 270.043 247.516 1.00 0.00 C +ATOM 44 CA ARG A 44 259.863 273.072 246.774 1.00 0.00 C +ATOM 45 CA TYR A 45 260.771 276.764 246.530 1.00 0.00 C +ATOM 46 CA ALA A 46 257.522 278.754 246.517 1.00 0.00 C +ATOM 47 CA ARG A 47 255.858 279.778 243.246 1.00 0.00 C +ATOM 48 CA LYS A 48 252.945 282.188 243.717 1.00 0.00 C +ATOM 49 CA HIS A 49 251.000 284.392 246.141 1.00 0.00 C +ATOM 50 CA ASN A 50 250.579 287.660 248.053 1.00 0.00 C +ATOM 51 CA PRO A 51 251.288 291.205 246.852 1.00 0.00 C +ATOM 52 CA LYS A 52 249.512 293.075 244.047 1.00 0.00 C +ATOM 53 CA GLU A 53 248.089 296.196 245.705 1.00 0.00 C +ATOM 54 CA CYS A 54 244.469 296.667 244.613 1.00 0.00 C +TER 55 CYS A 54 +END diff --git a/Plants/Q9FRH1/Q9FRH1.dcd b/Plants/Q9FRH1/Q9FRH1.dcd new file mode 100644 index 0000000000000000000000000000000000000000..211c9b9b7d2f05733bab0d6bb1f0d2c122697422 --- /dev/null +++ b/Plants/Q9FRH1/Q9FRH1.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:549786438217d392500ae8d4001da2d06582485fc480a708eff23ce2aa479c5f +size 11600276 diff --git a/Plants/Q9FRH1/top.pdb b/Plants/Q9FRH1/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..9bfc1af6aaac40360150c602a6913e630e3d1f0e --- /dev/null +++ b/Plants/Q9FRH1/top.pdb @@ -0,0 +1,94 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA MET A 1 258.135 271.455 230.252 1.00 0.00 C +ATOM 2 CA GLU A 2 257.678 268.905 233.046 1.00 0.00 C +ATOM 3 CA LEU A 3 254.543 268.085 235.050 1.00 0.00 C +ATOM 4 CA GLN A 4 251.749 268.051 237.640 1.00 0.00 C +ATOM 5 CA ARG A 5 249.784 264.801 237.337 1.00 0.00 C +ATOM 6 CA ASN A 6 246.958 262.558 238.562 1.00 0.00 C +ATOM 7 CA ARG A 7 247.628 260.861 241.906 1.00 0.00 C +ATOM 8 CA ARG A 8 247.264 257.102 241.403 1.00 0.00 C +ATOM 9 CA ILE A 9 247.198 253.299 241.621 1.00 0.00 C +ATOM 10 CA LYS A 10 247.435 249.975 243.468 1.00 0.00 C +ATOM 11 CA ARG A 11 249.644 247.558 241.520 1.00 0.00 C +ATOM 12 CA PHE A 12 253.011 247.197 239.773 1.00 0.00 C +ATOM 13 CA PRO A 13 256.183 249.290 239.505 1.00 0.00 C +ATOM 14 CA HIS A 14 257.208 252.386 237.536 1.00 0.00 C +ATOM 15 CA GLY A 15 255.992 255.558 239.261 1.00 0.00 C +ATOM 16 CA ALA A 16 254.331 255.598 242.690 1.00 0.00 C +ATOM 17 CA TYR A 17 255.601 257.633 245.650 1.00 0.00 C +ATOM 18 CA ARG A 18 257.363 255.344 248.135 1.00 0.00 C +ATOM 19 CA ASP A 19 257.366 252.247 250.354 1.00 0.00 C +ATOM 20 CA THR A 20 256.615 248.541 250.813 1.00 0.00 C +ATOM 21 CA ALA A 21 259.301 245.867 251.205 1.00 0.00 C +ATOM 22 CA ASP A 22 260.416 244.878 254.711 1.00 0.00 C +ATOM 23 CA GLU A 23 259.302 242.603 257.558 1.00 0.00 C +ATOM 24 CA PRO A 24 259.389 243.023 261.344 1.00 0.00 C +ATOM 25 CA HIS A 25 260.149 245.816 263.821 1.00 0.00 C +ATOM 26 CA VAL A 26 263.387 245.478 265.801 1.00 0.00 C +ATOM 27 CA LEU A 27 264.997 243.984 268.914 1.00 0.00 C +ATOM 28 CA ALA A 28 268.605 242.873 268.404 1.00 0.00 C +ATOM 29 CA LEU A 29 268.839 240.353 265.556 1.00 0.00 C +ATOM 30 CA PRO A 30 268.069 238.166 262.533 1.00 0.00 C +ATOM 31 CA LEU A 31 271.034 236.297 261.040 1.00 0.00 C +ATOM 32 CA PRO A 32 273.962 235.522 258.728 1.00 0.00 C +ATOM 33 CA PRO A 33 276.644 232.937 257.927 1.00 0.00 C +ATOM 34 CA GLY A 34 279.749 231.896 259.874 1.00 0.00 C +ATOM 35 CA ASP A 35 281.966 233.980 262.167 1.00 0.00 C +ATOM 36 CA ARG A 36 280.356 237.354 262.902 1.00 0.00 C +ATOM 37 CA ILE A 37 277.869 239.581 261.065 1.00 0.00 C +ATOM 38 CA ARG A 38 275.957 242.874 260.945 1.00 0.00 C +ATOM 39 CA ARG A 39 273.715 243.182 257.880 1.00 0.00 C +ATOM 40 CA GLN A 40 273.563 245.499 254.860 1.00 0.00 C +ATOM 41 CA GLY A 41 270.120 245.059 253.290 1.00 0.00 C +ATOM 42 CA GLY A 42 267.105 247.349 252.861 1.00 0.00 C +ATOM 43 CA ARG A 43 265.088 250.571 253.112 1.00 0.00 C +ATOM 44 CA GLY A 44 263.745 253.907 254.371 1.00 0.00 C +ATOM 45 CA TYR A 45 265.139 255.188 257.677 1.00 0.00 C +ATOM 46 CA PRO A 46 265.404 256.023 261.385 1.00 0.00 C +ATOM 47 CA ASN A 47 263.793 253.047 263.135 1.00 0.00 C +ATOM 48 CA PRO A 48 260.125 253.024 262.104 1.00 0.00 C +ATOM 49 CA ALA A 49 256.382 252.622 261.519 1.00 0.00 C +ATOM 50 CA SER A 50 253.181 253.902 259.897 1.00 0.00 C +ATOM 51 CA THR A 51 250.004 252.314 261.276 1.00 0.00 C +ATOM 52 CA VAL A 52 247.137 251.014 263.422 1.00 0.00 C +ATOM 53 CA TYR A 53 243.999 251.066 261.263 1.00 0.00 C +ATOM 54 CA PRO A 54 243.110 249.680 257.827 1.00 0.00 C +ATOM 55 CA PRO A 55 243.479 246.994 255.150 1.00 0.00 C +ATOM 56 CA PRO A 56 242.961 244.148 252.670 1.00 0.00 C +ATOM 57 CA GLU A 57 244.308 244.946 249.197 1.00 0.00 C +ATOM 58 CA LEU A 58 244.305 242.258 246.497 1.00 0.00 C +ATOM 59 CA ALA A 59 242.859 242.097 242.976 1.00 0.00 C +ATOM 60 CA SER A 60 245.146 239.744 241.040 1.00 0.00 C +ATOM 61 CA ARG A 61 247.000 237.073 243.025 1.00 0.00 C +ATOM 62 CA TRP A 62 246.690 236.166 246.713 1.00 0.00 C +ATOM 63 CA GLN A 63 246.280 236.063 250.499 1.00 0.00 C +ATOM 64 CA GLY A 64 244.339 237.432 253.479 1.00 0.00 C +ATOM 65 CA GLY A 65 240.885 235.965 254.136 1.00 0.00 C +ATOM 66 CA ALA A 66 237.862 237.431 255.933 1.00 0.00 C +ATOM 67 CA SER A 67 235.642 239.079 253.311 1.00 0.00 C +ATOM 68 CA LYS A 68 235.224 241.446 250.355 1.00 0.00 C +ATOM 69 CA PHE A 69 235.372 245.033 249.081 1.00 0.00 C +ATOM 70 CA SER A 70 234.633 247.109 245.973 1.00 0.00 C +ATOM 71 CA SER A 71 234.487 249.481 242.995 1.00 0.00 C +ATOM 72 CA GLY A 72 236.186 252.802 243.769 1.00 0.00 C +ATOM 73 CA GLU A 73 237.215 256.470 243.713 1.00 0.00 C +ATOM 74 CA GLY A 74 237.059 259.645 241.613 1.00 0.00 C +ATOM 75 CA PRO A 75 234.992 262.371 239.935 1.00 0.00 C +ATOM 76 CA ASP A 76 235.936 262.978 236.294 1.00 0.00 C +ATOM 77 CA ASP A 77 236.002 259.935 234.002 1.00 0.00 C +ATOM 78 CA VAL A 78 236.307 256.421 235.442 1.00 0.00 C +ATOM 79 CA SER A 79 233.532 253.819 235.655 1.00 0.00 C +ATOM 80 CA ARG A 80 231.471 254.522 238.781 1.00 0.00 C +ATOM 81 CA PRO A 81 228.879 255.136 241.506 1.00 0.00 C +ATOM 82 CA GLY A 82 228.262 257.542 244.394 1.00 0.00 C +ATOM 83 CA LYS A 83 226.476 256.618 247.631 1.00 0.00 C +ATOM 84 CA GLY A 84 222.667 256.632 247.564 1.00 0.00 C +ATOM 85 CA HIS A 85 219.232 258.229 247.974 1.00 0.00 C +ATOM 86 CA ALA A 86 215.808 257.774 249.582 1.00 0.00 C +ATOM 87 CA SER A 87 213.975 261.101 249.879 1.00 0.00 C +ATOM 88 CA GLY A 88 214.944 263.900 247.484 1.00 0.00 C +ATOM 89 CA LYS A 89 217.224 263.481 244.460 1.00 0.00 C +ATOM 90 CA ARG A 90 219.076 264.786 241.397 1.00 0.00 C +TER 91 ARG A 90 +END diff --git a/Plants/Q9FS23/Q9FS23.dcd b/Plants/Q9FS23/Q9FS23.dcd new file mode 100644 index 0000000000000000000000000000000000000000..546b0ac14bc4f0965656c9d445ba5ad97040e4cb --- /dev/null +++ b/Plants/Q9FS23/Q9FS23.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5da87368cec86787755c6031b383bd9595f5a664aa78a357c68b4802058b50e1 +size 10520276 diff --git a/Plants/Q9FS23/top.pdb b/Plants/Q9FS23/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..1c4d38bb88d6b127b18e8e3fccb90077b60bbf94 --- /dev/null +++ b/Plants/Q9FS23/top.pdb @@ -0,0 +1,85 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA GLY A 1 240.976 260.561 251.160 1.00 0.00 C +ATOM 2 CA THR A 2 240.838 261.136 254.924 1.00 0.00 C +ATOM 3 CA SER A 3 238.405 259.907 257.586 1.00 0.00 C +ATOM 4 CA HIS A 4 235.164 257.950 257.160 1.00 0.00 C +ATOM 5 CA GLY A 5 231.754 256.250 257.134 1.00 0.00 C +ATOM 6 CA GLU A 6 229.298 257.467 254.487 1.00 0.00 C +ATOM 7 CA HIS A 7 229.206 261.249 254.935 1.00 0.00 C +ATOM 8 CA SER A 8 231.983 263.190 256.678 1.00 0.00 C +ATOM 9 CA GLU A 9 234.556 265.641 258.051 1.00 0.00 C +ATOM 10 CA TYR A 10 236.178 268.624 256.322 1.00 0.00 C +ATOM 11 CA LYS A 11 238.666 271.508 256.396 1.00 0.00 C +ATOM 12 CA GLY A 12 241.906 272.581 254.702 1.00 0.00 C +ATOM 13 CA GLU A 13 245.571 271.941 253.882 1.00 0.00 C +ATOM 14 CA HIS A 14 246.765 268.526 252.688 1.00 0.00 C +ATOM 15 CA HIS A 15 250.573 268.559 252.794 1.00 0.00 C +ATOM 16 CA GLY A 16 252.782 266.322 254.946 1.00 0.00 C +ATOM 17 CA GLU A 17 254.599 264.353 257.655 1.00 0.00 C +ATOM 18 CA HIS A 18 254.952 262.730 261.084 1.00 0.00 C +ATOM 19 CA LYS A 19 256.135 261.345 264.430 1.00 0.00 C +ATOM 20 CA GLY A 20 258.151 258.387 265.734 1.00 0.00 C +ATOM 21 CA GLU A 21 256.683 255.347 267.500 1.00 0.00 C +ATOM 22 CA TYR A 22 256.660 252.562 264.900 1.00 0.00 C +ATOM 23 CA LYS A 23 255.497 249.048 265.803 1.00 0.00 C +ATOM 24 CA GLY A 24 252.760 247.062 267.558 1.00 0.00 C +ATOM 25 CA GLU A 25 249.108 247.481 266.557 1.00 0.00 C +ATOM 26 CA HIS A 26 245.595 248.771 265.842 1.00 0.00 C +ATOM 27 CA LYS A 27 242.748 246.296 266.374 1.00 0.00 C +ATOM 28 CA PRO A 28 243.305 242.874 264.795 1.00 0.00 C +ATOM 29 CA GLU A 29 241.044 239.996 263.734 1.00 0.00 C +ATOM 30 CA HIS A 30 237.842 240.648 261.775 1.00 0.00 C +ATOM 31 CA HIS A 31 236.252 243.865 260.493 1.00 0.00 C +ATOM 32 CA GLY A 32 233.226 242.879 258.398 1.00 0.00 C +ATOM 33 CA GLU A 33 229.438 243.285 258.447 1.00 0.00 C +ATOM 34 CA GLU A 34 227.839 241.496 261.407 1.00 0.00 C +ATOM 35 CA HIS A 35 228.001 239.412 264.592 1.00 0.00 C +ATOM 36 CA LYS A 36 229.536 237.364 267.415 1.00 0.00 C +ATOM 37 CA GLU A 37 232.349 235.404 265.754 1.00 0.00 C +ATOM 38 CA GLY A 38 235.113 234.871 263.187 1.00 0.00 C +ATOM 39 CA PHE A 39 236.021 232.194 260.633 1.00 0.00 C +ATOM 40 CA VAL A 40 238.441 233.218 257.874 1.00 0.00 C +ATOM 41 CA GLU A 41 241.480 231.375 256.500 1.00 0.00 C +ATOM 42 CA LYS A 42 245.028 231.370 255.112 1.00 0.00 C +ATOM 43 CA ILE A 43 246.048 233.429 252.073 1.00 0.00 C +ATOM 44 CA LYS A 44 248.418 236.404 251.848 1.00 0.00 C +ATOM 45 CA ASP A 45 248.651 239.657 253.818 1.00 0.00 C +ATOM 46 CA LYS A 46 251.048 242.181 252.269 1.00 0.00 C +ATOM 47 CA LEU A 47 250.822 245.830 253.342 1.00 0.00 C +ATOM 48 CA HIS A 48 249.731 248.584 255.737 1.00 0.00 C +ATOM 49 CA GLY A 49 248.606 252.142 256.506 1.00 0.00 C +ATOM 50 CA GLU A 50 245.355 253.954 255.692 1.00 0.00 C +ATOM 51 CA GLY A 51 242.670 251.963 253.864 1.00 0.00 C +ATOM 52 CA GLY A 52 242.086 248.583 252.205 1.00 0.00 C +ATOM 53 CA GLU A 53 241.273 244.866 251.999 1.00 0.00 C +ATOM 54 CA GLY A 54 241.053 243.878 248.326 1.00 0.00 C +ATOM 55 CA GLU A 55 239.007 245.927 245.850 1.00 0.00 C +ATOM 56 CA LYS A 56 240.072 247.157 242.405 1.00 0.00 C +ATOM 57 CA LYS A 57 243.389 248.555 241.156 1.00 0.00 C +ATOM 58 CA LYS A 58 244.767 250.446 238.149 1.00 0.00 C +ATOM 59 CA LYS A 59 247.359 253.162 237.501 1.00 0.00 C +ATOM 60 CA LYS A 60 251.005 252.057 237.424 1.00 0.00 C +ATOM 61 CA GLU A 61 254.436 253.415 238.374 1.00 0.00 C +ATOM 62 CA LYS A 62 257.770 251.707 237.682 1.00 0.00 C +ATOM 63 CA LYS A 63 260.263 251.961 234.811 1.00 0.00 C +ATOM 64 CA LYS A 64 259.232 250.716 231.361 1.00 0.00 C +ATOM 65 CA LYS A 65 259.987 251.086 227.645 1.00 0.00 C +ATOM 66 CA HIS A 66 261.392 253.262 224.850 1.00 0.00 C +ATOM 67 CA GLU A 67 264.888 253.998 223.526 1.00 0.00 C +ATOM 68 CA ASP A 68 267.874 256.107 224.597 1.00 0.00 C +ATOM 69 CA GLY A 69 268.809 258.332 227.545 1.00 0.00 C +ATOM 70 CA HIS A 70 270.504 256.853 230.620 1.00 0.00 C +ATOM 71 CA GLY A 71 269.310 253.343 231.497 1.00 0.00 C +ATOM 72 CA HIS A 72 269.622 249.698 232.563 1.00 0.00 C +ATOM 73 CA ASP A 73 271.907 247.029 234.035 1.00 0.00 C +ATOM 74 CA SER A 74 274.365 246.400 236.878 1.00 0.00 C +ATOM 75 CA SER A 75 276.277 243.134 236.441 1.00 0.00 C +ATOM 76 CA SER A 76 279.871 241.926 236.821 1.00 0.00 C +ATOM 77 CA SER A 77 280.333 239.216 234.183 1.00 0.00 C +ATOM 78 CA SER A 78 280.303 239.189 230.373 1.00 0.00 C +ATOM 79 CA ASP A 79 283.252 239.612 227.998 1.00 0.00 C +ATOM 80 CA SER A 80 286.911 239.676 226.938 1.00 0.00 C +ATOM 81 CA ASP A 81 288.907 239.522 223.696 1.00 0.00 C +TER 82 ASP A 81 +END diff --git a/Plants/Q9FSY9/Q9FSY9.dcd b/Plants/Q9FSY9/Q9FSY9.dcd new file mode 100644 index 0000000000000000000000000000000000000000..1a4b486f839bafb0db8658b5544b613c46bce9fc --- /dev/null +++ b/Plants/Q9FSY9/Q9FSY9.dcd @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c2b9e95502a105cc9363a7f4917ac399abee666182360b399818cd416c10ccf9 +size 5000276 diff --git a/Plants/Q9FSY9/top.pdb b/Plants/Q9FSY9/top.pdb new file mode 100644 index 0000000000000000000000000000000000000000..4743b02dd1536b9215121de74f739a38a31f23c7 --- /dev/null +++ b/Plants/Q9FSY9/top.pdb @@ -0,0 +1,39 @@ +REMARK 1 CREATED WITH OPENMM 8.2, 2026-10-06 +CRYST1 500.000 500.000 500.000 90.00 90.00 90.00 P 1 1 +ATOM 1 CA HIS A 1 242.979 232.976 238.551 1.00 0.00 C +ATOM 2 CA THR A 2 239.348 232.668 239.664 1.00 0.00 C +ATOM 3 CA SER A 3 236.357 233.344 241.926 1.00 0.00 C +ATOM 4 CA PRO A 4 236.078 237.130 242.248 1.00 0.00 C +ATOM 5 CA PRO A 5 238.275 240.190 242.817 1.00 0.00 C +ATOM 6 CA TYR A 6 238.981 243.330 240.778 1.00 0.00 C +ATOM 7 CA ILE A 7 240.751 245.923 242.935 1.00 0.00 C +ATOM 8 CA PRO A 8 239.606 248.636 245.353 1.00 0.00 C +ATOM 9 CA HIS A 9 240.468 248.122 249.029 1.00 0.00 C +ATOM 10 CA PRO A 10 241.549 249.506 252.410 1.00 0.00 C +ATOM 11 CA VAL A 11 244.883 249.183 254.225 1.00 0.00 C +ATOM 12 CA TYR A 12 248.349 249.837 252.785 1.00 0.00 C +ATOM 13 CA HIS A 13 251.068 251.354 254.981 1.00 0.00 C +ATOM 14 CA SER A 14 252.087 255.017 255.228 1.00 0.00 C +ATOM 15 CA PRO A 15 249.614 257.603 253.919 1.00 0.00 C +ATOM 16 CA PRO A 16 246.236 258.613 252.474 1.00 0.00 C +ATOM 17 CA PRO A 17 244.224 257.209 249.559 1.00 0.00 C +ATOM 18 CA THR A 18 244.279 253.568 248.441 1.00 0.00 C +ATOM 19 CA PRO A 19 247.359 252.232 246.639 1.00 0.00 C +ATOM 20 CA THR A 20 248.256 253.745 243.260 1.00 0.00 C +ATOM 21 CA LYS A 21 250.631 251.590 241.203 1.00 0.00 C +ATOM 22 CA LYS A 22 254.323 251.557 242.141 1.00 0.00 C +ATOM 23 CA PRO A 23 256.221 250.089 245.100 1.00 0.00 C +ATOM 24 CA TYR A 24 258.533 252.776 246.498 1.00 0.00 C +ATOM 25 CA LEU A 25 258.105 255.826 248.741 1.00 0.00 C +ATOM 26 CA TYR A 26 259.270 258.759 250.876 1.00 0.00 C +ATOM 27 CA SER A 27 257.106 261.045 253.023 1.00 0.00 C +ATOM 28 CA SER A 28 257.755 262.325 256.552 1.00 0.00 C +ATOM 29 CA PRO A 29 260.518 260.370 258.301 1.00 0.00 C +ATOM 30 CA PRO A 30 259.618 257.281 260.342 1.00 0.00 C +ATOM 31 CA PRO A 31 258.714 253.756 261.472 1.00 0.00 C +ATOM 32 CA PRO A 32 261.464 251.401 260.286 1.00 0.00 C +ATOM 33 CA TYR A 33 262.512 247.979 258.980 1.00 0.00 C +ATOM 34 CA HIS A 34 262.386 244.356 260.152 1.00 0.00 C +ATOM 35 CA TYR A 35 262.098 240.703 259.109 1.00 0.00 C +TER 36 TYR A 35 +END