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- pdbs/chunk_41/A0A023GUT0.pdb +0 -0
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- pdbs/chunk_41/A0A140LFQ9.pdb +0 -0
pdbs/chunk_41/A0A023GUT0.pdb
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pdbs/chunk_41/A0A060WRY3.pdb
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| 1 |
+
HEADER 01-JUN-22
|
| 2 |
+
TITLE ALPHAFOLD MONOMER V2.0 PREDICTION FOR CHEMOKINE INTERLEUKIN-8-LIKE
|
| 3 |
+
TITLE 2 DOMAIN-CONTAINING PROTEIN (A0A060WRY3)
|
| 4 |
+
COMPND MOL_ID: 1;
|
| 5 |
+
COMPND 2 MOLECULE: CHEMOKINE INTERLEUKIN-8-LIKE DOMAIN-CONTAINING PROTEIN;
|
| 6 |
+
COMPND 3 CHAIN: A
|
| 7 |
+
SOURCE MOL_ID: 1;
|
| 8 |
+
SOURCE 2 ORGANISM_SCIENTIFIC: ONCORHYNCHUS MYKISS;
|
| 9 |
+
SOURCE 3 ORGANISM_TAXID: 8022
|
| 10 |
+
REMARK 1
|
| 11 |
+
REMARK 1 REFERENCE 1
|
| 12 |
+
REMARK 1 AUTH JOHN JUMPER, RICHARD EVANS, ALEXANDER PRITZEL, TIM GREEN,
|
| 13 |
+
REMARK 1 AUTH 2 MICHAEL FIGURNOV, OLAF RONNEBERGER, KATHRYN TUNYASUVUNAKOOL,
|
| 14 |
+
REMARK 1 AUTH 3 RUSS BATES, AUGUSTIN ZIDEK, ANNA POTAPENKO, ALEX BRIDGLAND,
|
| 15 |
+
REMARK 1 AUTH 4 CLEMENS MEYER, SIMON A A KOHL, ANDREW J BALLARD,
|
| 16 |
+
REMARK 1 AUTH 5 ANDREW COWIE, BERNARDINO ROMERA-PAREDES, STANISLAV NIKOLOV,
|
| 17 |
+
REMARK 1 AUTH 6 RISHUB JAIN, JONAS ADLER, TREVOR BACK, STIG PETERSEN,
|
| 18 |
+
REMARK 1 AUTH 7 DAVID REIMAN, ELLEN CLANCY, MICHAL ZIELINSKI,
|
| 19 |
+
REMARK 1 AUTH 8 MARTIN STEINEGGER, MICHALINA PACHOLSKA, TAMAS BERGHAMMER,
|
| 20 |
+
REMARK 1 AUTH 9 DAVID SILVER, ORIOL VINYALS, ANDREW W SENIOR,
|
| 21 |
+
REMARK 1 AUTH10 KORAY KAVUKCUOGLU, PUSHMEET KOHLI, DEMIS HASSABIS
|
| 22 |
+
REMARK 1 TITL HIGHLY ACCURATE PROTEIN STRUCTURE PREDICTION WITH ALPHAFOLD
|
| 23 |
+
REMARK 1 REF NATURE V. 596 583 2021
|
| 24 |
+
REMARK 1 REFN ISSN 0028-0836
|
| 25 |
+
REMARK 1 PMID 34265844
|
| 26 |
+
REMARK 1 DOI 10.1038/s41586-021-03819-2
|
| 27 |
+
REMARK 1
|
| 28 |
+
REMARK 1 DISCLAIMERS
|
| 29 |
+
REMARK 1 ALPHAFOLD DATA, COPYRIGHT (2021) DEEPMIND TECHNOLOGIES LIMITED. THE
|
| 30 |
+
REMARK 1 INFORMATION PROVIDED IS THEORETICAL MODELLING ONLY AND CAUTION SHOULD
|
| 31 |
+
REMARK 1 BE EXERCISED IN ITS USE. IT IS PROVIDED "AS-IS" WITHOUT ANY WARRANTY
|
| 32 |
+
REMARK 1 OF ANY KIND, WHETHER EXPRESSED OR IMPLIED. NO WARRANTY IS GIVEN THAT
|
| 33 |
+
REMARK 1 USE OF THE INFORMATION SHALL NOT INFRINGE THE RIGHTS OF ANY THIRD
|
| 34 |
+
REMARK 1 PARTY. THE INFORMATION IS NOT INTENDED TO BE A SUBSTITUTE FOR
|
| 35 |
+
REMARK 1 PROFESSIONAL MEDICAL ADVICE, DIAGNOSIS, OR TREATMENT, AND DOES NOT
|
| 36 |
+
REMARK 1 CONSTITUTE MEDICAL OR OTHER PROFESSIONAL ADVICE. IT IS AVAILABLE FOR
|
| 37 |
+
REMARK 1 ACADEMIC AND COMMERCIAL PURPOSES, UNDER CC-BY 4.0 LICENCE.
|
| 38 |
+
DBREF XXXX A 1 95 UNP A0A060WRY3 A0A060WRY3_ONCMY 1 95
|
| 39 |
+
SEQRES 1 A 95 MET SER ILE ARG MET SER ALA SER LEU VAL VAL VAL LEU
|
| 40 |
+
SEQRES 2 A 95 LEU ALA LEU LEU THR ILE THR GLU GLU MET SER LEU ARG
|
| 41 |
+
SEQRES 3 A 95 GLY MET GLY ALA ASP LEU ARG CYS ARG CYS ILE GLU THR
|
| 42 |
+
SEQRES 4 A 95 GLU SER ARG ARG ILE GLY LYS LEU ILE LYS LYS VAL GLU
|
| 43 |
+
SEQRES 5 A 95 MET PHE PRO PRO SER SER HIS CYS ARG ASP THR GLU ILE
|
| 44 |
+
SEQRES 6 A 95 ILE ALA THR LEU SER LYS SER GLY GLN GLU ILE CYS LEU
|
| 45 |
+
SEQRES 7 A 95 ASP VAL SER ALA PRO TRP VAL LYS LYS VAL ILE GLU LYS
|
| 46 |
+
SEQRES 8 A 95 MET LEU ALA LYS
|
| 47 |
+
CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1
|
| 48 |
+
ORIGX1 1.000000 0.000000 0.000000 0.00000
|
| 49 |
+
ORIGX2 0.000000 1.000000 0.000000 0.00000
|
| 50 |
+
ORIGX3 0.000000 0.000000 1.000000 0.00000
|
| 51 |
+
SCALE1 1.000000 0.000000 0.000000 0.00000
|
| 52 |
+
SCALE2 0.000000 1.000000 0.000000 0.00000
|
| 53 |
+
SCALE3 0.000000 0.000000 1.000000 0.00000
|
| 54 |
+
MODEL 1
|
| 55 |
+
ATOM 1 N MET A 1 44.925 10.024 33.812 1.00 49.78 N
|
| 56 |
+
ATOM 2 CA MET A 1 43.475 10.321 33.742 1.00 49.78 C
|
| 57 |
+
ATOM 3 C MET A 1 42.976 10.369 32.294 1.00 49.78 C
|
| 58 |
+
ATOM 4 CB MET A 1 43.120 11.597 34.522 1.00 49.78 C
|
| 59 |
+
ATOM 5 O MET A 1 42.018 9.675 31.984 1.00 49.78 O
|
| 60 |
+
ATOM 6 CG MET A 1 41.759 11.451 35.209 1.00 49.78 C
|
| 61 |
+
ATOM 7 SD MET A 1 41.814 10.452 36.723 1.00 49.78 S
|
| 62 |
+
ATOM 8 CE MET A 1 41.897 11.779 37.966 1.00 49.78 C
|
| 63 |
+
ATOM 9 N SER A 2 43.669 11.079 31.392 1.00 52.69 N
|
| 64 |
+
ATOM 10 CA SER A 2 43.248 11.294 29.992 1.00 52.69 C
|
| 65 |
+
ATOM 11 C SER A 2 43.115 10.032 29.125 1.00 52.69 C
|
| 66 |
+
ATOM 12 CB SER A 2 44.220 12.270 29.312 1.00 52.69 C
|
| 67 |
+
ATOM 13 O SER A 2 42.199 9.954 28.319 1.00 52.69 O
|
| 68 |
+
ATOM 14 OG SER A 2 44.456 13.371 30.170 1.00 52.69 O
|
| 69 |
+
ATOM 15 N ILE A 3 43.962 9.014 29.330 1.00 53.44 N
|
| 70 |
+
ATOM 16 CA ILE A 3 43.920 7.743 28.569 1.00 53.44 C
|
| 71 |
+
ATOM 17 C ILE A 3 42.689 6.894 28.940 1.00 53.44 C
|
| 72 |
+
ATOM 18 CB ILE A 3 45.235 6.949 28.794 1.00 53.44 C
|
| 73 |
+
ATOM 19 O ILE A 3 42.139 6.169 28.118 1.00 53.44 O
|
| 74 |
+
ATOM 20 CG1 ILE A 3 46.472 7.770 28.353 1.00 53.44 C
|
| 75 |
+
ATOM 21 CG2 ILE A 3 45.213 5.599 28.053 1.00 53.44 C
|
| 76 |
+
ATOM 22 CD1 ILE A 3 47.807 7.195 28.845 1.00 53.44 C
|
| 77 |
+
ATOM 23 N ARG A 4 42.220 6.993 30.193 1.00 59.00 N
|
| 78 |
+
ATOM 24 CA ARG A 4 41.008 6.290 30.646 1.00 59.00 C
|
| 79 |
+
ATOM 25 C ARG A 4 39.750 6.982 30.119 1.00 59.00 C
|
| 80 |
+
ATOM 26 CB ARG A 4 40.979 6.146 32.178 1.00 59.00 C
|
| 81 |
+
ATOM 27 O ARG A 4 38.802 6.302 29.760 1.00 59.00 O
|
| 82 |
+
ATOM 28 CG ARG A 4 42.174 5.341 32.720 1.00 59.00 C
|
| 83 |
+
ATOM 29 CD ARG A 4 42.139 5.188 34.250 1.00 59.00 C
|
| 84 |
+
ATOM 30 NE ARG A 4 41.307 4.053 34.695 1.00 59.00 N
|
| 85 |
+
ATOM 31 NH1 ARG A 4 41.458 4.419 36.966 1.00 59.00 N
|
| 86 |
+
ATOM 32 NH2 ARG A 4 40.412 2.605 36.214 1.00 59.00 N
|
| 87 |
+
ATOM 33 CZ ARG A 4 41.065 3.701 35.950 1.00 59.00 C
|
| 88 |
+
ATOM 34 N MET A 5 39.775 8.315 30.019 1.00 58.47 N
|
| 89 |
+
ATOM 35 CA MET A 5 38.704 9.102 29.397 1.00 58.47 C
|
| 90 |
+
ATOM 36 C MET A 5 38.563 8.797 27.904 1.00 58.47 C
|
| 91 |
+
ATOM 37 CB MET A 5 38.954 10.603 29.605 1.00 58.47 C
|
| 92 |
+
ATOM 38 O MET A 5 37.439 8.630 27.444 1.00 58.47 O
|
| 93 |
+
ATOM 39 CG MET A 5 38.491 11.067 30.988 1.00 58.47 C
|
| 94 |
+
ATOM 40 SD MET A 5 39.299 12.575 31.595 1.00 58.47 S
|
| 95 |
+
ATOM 41 CE MET A 5 38.787 13.783 30.340 1.00 58.47 C
|
| 96 |
+
ATOM 42 N SER A 6 39.672 8.668 27.164 1.00 61.84 N
|
| 97 |
+
ATOM 43 CA SER A 6 39.616 8.286 25.747 1.00 61.84 C
|
| 98 |
+
ATOM 44 C SER A 6 39.112 6.855 25.563 1.00 61.84 C
|
| 99 |
+
ATOM 45 CB SER A 6 40.967 8.483 25.053 1.00 61.84 C
|
| 100 |
+
ATOM 46 O SER A 6 38.269 6.627 24.702 1.00 61.84 O
|
| 101 |
+
ATOM 47 OG SER A 6 41.983 7.709 25.656 1.00 61.84 O
|
| 102 |
+
ATOM 48 N ALA A 7 39.542 5.911 26.408 1.00 67.94 N
|
| 103 |
+
ATOM 49 CA ALA A 7 39.039 4.538 26.380 1.00 67.94 C
|
| 104 |
+
ATOM 50 C ALA A 7 37.523 4.471 26.638 1.00 67.94 C
|
| 105 |
+
ATOM 51 CB ALA A 7 39.831 3.698 27.389 1.00 67.94 C
|
| 106 |
+
ATOM 52 O ALA A 7 36.808 3.816 25.886 1.00 67.94 O
|
| 107 |
+
ATOM 53 N SER A 8 37.014 5.200 27.638 1.00 70.44 N
|
| 108 |
+
ATOM 54 CA SER A 8 35.571 5.277 27.904 1.00 70.44 C
|
| 109 |
+
ATOM 55 C SER A 8 34.796 5.899 26.743 1.00 70.44 C
|
| 110 |
+
ATOM 56 CB SER A 8 35.291 6.093 29.167 1.00 70.44 C
|
| 111 |
+
ATOM 57 O SER A 8 33.723 5.412 26.400 1.00 70.44 O
|
| 112 |
+
ATOM 58 OG SER A 8 35.856 5.471 30.305 1.00 70.44 O
|
| 113 |
+
ATOM 59 N LEU A 9 35.339 6.944 26.110 1.00 73.88 N
|
| 114 |
+
ATOM 60 CA LEU A 9 34.699 7.598 24.967 1.00 73.88 C
|
| 115 |
+
ATOM 61 C LEU A 9 34.605 6.656 23.758 1.00 73.88 C
|
| 116 |
+
ATOM 62 CB LEU A 9 35.478 8.879 24.611 1.00 73.88 C
|
| 117 |
+
ATOM 63 O LEU A 9 33.569 6.598 23.104 1.00 73.88 O
|
| 118 |
+
ATOM 64 CG LEU A 9 34.562 9.977 24.046 1.00 73.88 C
|
| 119 |
+
ATOM 65 CD1 LEU A 9 33.902 10.755 25.190 1.00 73.88 C
|
| 120 |
+
ATOM 66 CD2 LEU A 9 35.372 10.963 23.206 1.00 73.88 C
|
| 121 |
+
ATOM 67 N VAL A 10 35.665 5.884 23.499 1.00 77.19 N
|
| 122 |
+
ATOM 68 CA VAL A 10 35.708 4.887 22.418 1.00 77.19 C
|
| 123 |
+
ATOM 69 C VAL A 10 34.720 3.748 22.678 1.00 77.19 C
|
| 124 |
+
ATOM 70 CB VAL A 10 37.146 4.362 22.226 1.00 77.19 C
|
| 125 |
+
ATOM 71 O VAL A 10 34.015 3.343 21.761 1.00 77.19 O
|
| 126 |
+
ATOM 72 CG1 VAL A 10 37.225 3.184 21.247 1.00 77.19 C
|
| 127 |
+
ATOM 73 CG2 VAL A 10 38.057 5.464 21.665 1.00 77.19 C
|
| 128 |
+
ATOM 74 N VAL A 11 34.607 3.268 23.921 1.00 77.56 N
|
| 129 |
+
ATOM 75 CA VAL A 11 33.638 2.220 24.291 1.00 77.56 C
|
| 130 |
+
ATOM 76 C VAL A 11 32.195 2.711 24.140 1.00 77.56 C
|
| 131 |
+
ATOM 77 CB VAL A 11 33.915 1.707 25.718 1.00 77.56 C
|
| 132 |
+
ATOM 78 O VAL A 11 31.361 1.985 23.608 1.00 77.56 O
|
| 133 |
+
ATOM 79 CG1 VAL A 11 32.828 0.755 26.236 1.00 77.56 C
|
| 134 |
+
ATOM 80 CG2 VAL A 11 35.240 0.933 25.763 1.00 77.56 C
|
| 135 |
+
ATOM 81 N VAL A 12 31.900 3.952 24.543 1.00 76.94 N
|
| 136 |
+
ATOM 82 CA VAL A 12 30.574 4.564 24.348 1.00 76.94 C
|
| 137 |
+
ATOM 83 C VAL A 12 30.261 4.739 22.861 1.00 76.94 C
|
| 138 |
+
ATOM 84 CB VAL A 12 30.476 5.902 25.109 1.00 76.94 C
|
| 139 |
+
ATOM 85 O VAL A 12 29.153 4.430 22.434 1.00 76.94 O
|
| 140 |
+
ATOM 86 CG1 VAL A 12 29.216 6.705 24.759 1.00 76.94 C
|
| 141 |
+
ATOM 87 CG2 VAL A 12 30.443 5.652 26.624 1.00 76.94 C
|
| 142 |
+
ATOM 88 N LEU A 13 31.234 5.173 22.055 1.00 71.25 N
|
| 143 |
+
ATOM 89 CA LEU A 13 31.064 5.319 20.608 1.00 71.25 C
|
| 144 |
+
ATOM 90 C LEU A 13 30.795 3.968 19.925 1.00 71.25 C
|
| 145 |
+
ATOM 91 CB LEU A 13 32.315 6.005 20.031 1.00 71.25 C
|
| 146 |
+
ATOM 92 O LEU A 13 29.898 3.872 19.093 1.00 71.25 O
|
| 147 |
+
ATOM 93 CG LEU A 13 32.079 6.620 18.641 1.00 71.25 C
|
| 148 |
+
ATOM 94 CD1 LEU A 13 31.364 7.970 18.754 1.00 71.25 C
|
| 149 |
+
ATOM 95 CD2 LEU A 13 33.419 6.848 17.941 1.00 71.25 C
|
| 150 |
+
ATOM 96 N LEU A 14 31.522 2.914 20.310 1.00 70.25 N
|
| 151 |
+
ATOM 97 CA LEU A 14 31.301 1.554 19.809 1.00 70.25 C
|
| 152 |
+
ATOM 98 C LEU A 14 29.927 1.009 20.220 1.00 70.25 C
|
| 153 |
+
ATOM 99 CB LEU A 14 32.432 0.634 20.305 1.00 70.25 C
|
| 154 |
+
ATOM 100 O LEU A 14 29.256 0.397 19.396 1.00 70.25 O
|
| 155 |
+
ATOM 101 CG LEU A 14 33.783 0.863 19.602 1.00 70.25 C
|
| 156 |
+
ATOM 102 CD1 LEU A 14 34.892 0.138 20.368 1.00 70.25 C
|
| 157 |
+
ATOM 103 CD2 LEU A 14 33.779 0.338 18.164 1.00 70.25 C
|
| 158 |
+
ATOM 104 N ALA A 15 29.475 1.281 21.447 1.00 69.38 N
|
| 159 |
+
ATOM 105 CA ALA A 15 28.144 0.892 21.912 1.00 69.38 C
|
| 160 |
+
ATOM 106 C ALA A 15 27.013 1.641 21.182 1.00 69.38 C
|
| 161 |
+
ATOM 107 CB ALA A 15 28.078 1.116 23.427 1.00 69.38 C
|
| 162 |
+
ATOM 108 O ALA A 15 25.955 1.069 20.949 1.00 69.38 O
|
| 163 |
+
ATOM 109 N LEU A 16 27.223 2.900 20.783 1.00 63.22 N
|
| 164 |
+
ATOM 110 CA LEU A 16 26.255 3.653 19.974 1.00 63.22 C
|
| 165 |
+
ATOM 111 C LEU A 16 26.136 3.093 18.548 1.00 63.22 C
|
| 166 |
+
ATOM 112 CB LEU A 16 26.656 5.138 19.950 1.00 63.22 C
|
| 167 |
+
ATOM 113 O LEU A 16 25.044 3.092 17.983 1.00 63.22 O
|
| 168 |
+
ATOM 114 CG LEU A 16 26.381 5.881 21.270 1.00 63.22 C
|
| 169 |
+
ATOM 115 CD1 LEU A 16 27.151 7.202 21.293 1.00 63.22 C
|
| 170 |
+
ATOM 116 CD2 LEU A 16 24.893 6.196 21.445 1.00 63.22 C
|
| 171 |
+
ATOM 117 N LEU A 17 27.234 2.583 17.981 1.00 61.03 N
|
| 172 |
+
ATOM 118 CA LEU A 17 27.246 1.990 16.640 1.00 61.03 C
|
| 173 |
+
ATOM 119 C LEU A 17 26.539 0.631 16.567 1.00 61.03 C
|
| 174 |
+
ATOM 120 CB LEU A 17 28.697 1.876 16.138 1.00 61.03 C
|
| 175 |
+
ATOM 121 O LEU A 17 26.108 0.253 15.486 1.00 61.03 O
|
| 176 |
+
ATOM 122 CG LEU A 17 29.363 3.221 15.801 1.00 61.03 C
|
| 177 |
+
ATOM 123 CD1 LEU A 17 30.854 2.998 15.539 1.00 61.03 C
|
| 178 |
+
ATOM 124 CD2 LEU A 17 28.753 3.882 14.562 1.00 61.03 C
|
| 179 |
+
ATOM 125 N THR A 18 26.377 -0.095 17.677 1.00 58.91 N
|
| 180 |
+
ATOM 126 CA THR A 18 25.624 -1.364 17.685 1.00 58.91 C
|
| 181 |
+
ATOM 127 C THR A 18 24.110 -1.174 17.811 1.00 58.91 C
|
| 182 |
+
ATOM 128 CB THR A 18 26.127 -2.326 18.773 1.00 58.91 C
|
| 183 |
+
ATOM 129 O THR A 18 23.371 -2.138 17.663 1.00 58.91 O
|
| 184 |
+
ATOM 130 CG2 THR A 18 27.596 -2.704 18.579 1.00 58.91 C
|
| 185 |
+
ATOM 131 OG1 THR A 18 26.020 -1.755 20.057 1.00 58.91 O
|
| 186 |
+
ATOM 132 N ILE A 19 23.627 0.045 18.087 1.00 57.66 N
|
| 187 |
+
ATOM 133 CA ILE A 19 22.185 0.353 18.213 1.00 57.66 C
|
| 188 |
+
ATOM 134 C ILE A 19 21.548 0.618 16.831 1.00 57.66 C
|
| 189 |
+
ATOM 135 CB ILE A 19 21.956 1.494 19.248 1.00 57.66 C
|
| 190 |
+
ATOM 136 O ILE A 19 20.338 0.788 16.724 1.00 57.66 O
|
| 191 |
+
ATOM 137 CG1 ILE A 19 22.563 1.124 20.624 1.00 57.66 C
|
| 192 |
+
ATOM 138 CG2 ILE A 19 20.462 1.820 19.466 1.00 57.66 C
|
| 193 |
+
ATOM 139 CD1 ILE A 19 22.640 2.287 21.624 1.00 57.66 C
|
| 194 |
+
ATOM 140 N THR A 20 22.328 0.635 15.745 1.00 55.59 N
|
| 195 |
+
ATOM 141 CA THR A 20 21.803 0.891 14.391 1.00 55.59 C
|
| 196 |
+
ATOM 142 C THR A 20 21.289 -0.351 13.661 1.00 55.59 C
|
| 197 |
+
ATOM 143 CB THR A 20 22.815 1.644 13.524 1.00 55.59 C
|
| 198 |
+
ATOM 144 O THR A 20 20.745 -0.223 12.564 1.00 55.59 O
|
| 199 |
+
ATOM 145 CG2 THR A 20 23.121 3.033 14.087 1.00 55.59 C
|
| 200 |
+
ATOM 146 OG1 THR A 20 24.022 0.931 13.480 1.00 55.59 O
|
| 201 |
+
ATOM 147 N GLU A 21 21.369 -1.542 14.254 1.00 56.22 N
|
| 202 |
+
ATOM 148 CA GLU A 21 20.671 -2.710 13.716 1.00 56.22 C
|
| 203 |
+
ATOM 149 C GLU A 21 19.221 -2.720 14.195 1.00 56.22 C
|
| 204 |
+
ATOM 150 CB GLU A 21 21.388 -4.020 14.079 1.00 56.22 C
|
| 205 |
+
ATOM 151 O GLU A 21 18.953 -3.258 15.253 1.00 56.22 O
|
| 206 |
+
ATOM 152 CG GLU A 21 22.711 -4.201 13.321 1.00 56.22 C
|
| 207 |
+
ATOM 153 CD GLU A 21 22.848 -5.621 12.749 1.00 56.22 C
|
| 208 |
+
ATOM 154 OE1 GLU A 21 23.030 -5.732 11.514 1.00 56.22 O
|
| 209 |
+
ATOM 155 OE2 GLU A 21 22.777 -6.590 13.540 1.00 56.22 O
|
| 210 |
+
ATOM 156 N GLU A 22 18.322 -2.086 13.433 1.00 54.28 N
|
| 211 |
+
ATOM 157 CA GLU A 22 16.977 -2.582 13.063 1.00 54.28 C
|
| 212 |
+
ATOM 158 C GLU A 22 16.341 -1.623 12.027 1.00 54.28 C
|
| 213 |
+
ATOM 159 CB GLU A 22 15.993 -2.833 14.240 1.00 54.28 C
|
| 214 |
+
ATOM 160 O GLU A 22 15.227 -1.131 12.196 1.00 54.28 O
|
| 215 |
+
ATOM 161 CG GLU A 22 16.269 -4.075 15.112 1.00 54.28 C
|
| 216 |
+
ATOM 162 CD GLU A 22 15.011 -4.751 15.657 1.00 54.28 C
|
| 217 |
+
ATOM 163 OE1 GLU A 22 14.921 -5.998 15.549 1.00 54.28 O
|
| 218 |
+
ATOM 164 OE2 GLU A 22 14.135 -4.033 16.194 1.00 54.28 O
|
| 219 |
+
ATOM 165 N MET A 23 17.029 -1.329 10.919 1.00 49.75 N
|
| 220 |
+
ATOM 166 CA MET A 23 16.343 -0.816 9.726 1.00 49.75 C
|
| 221 |
+
ATOM 167 C MET A 23 16.171 -1.968 8.753 1.00 49.75 C
|
| 222 |
+
ATOM 168 CB MET A 23 17.001 0.451 9.157 1.00 49.75 C
|
| 223 |
+
ATOM 169 O MET A 23 17.123 -2.464 8.156 1.00 49.75 O
|
| 224 |
+
ATOM 170 CG MET A 23 16.110 1.647 9.526 1.00 49.75 C
|
| 225 |
+
ATOM 171 SD MET A 23 16.858 3.285 9.378 1.00 49.75 S
|
| 226 |
+
ATOM 172 CE MET A 23 15.459 4.254 10.008 1.00 49.75 C
|
| 227 |
+
ATOM 173 N SER A 24 14.926 -2.442 8.690 1.00 47.88 N
|
| 228 |
+
ATOM 174 CA SER A 24 14.481 -3.534 7.835 1.00 47.88 C
|
| 229 |
+
ATOM 175 C SER A 24 15.033 -3.379 6.423 1.00 47.88 C
|
| 230 |
+
ATOM 176 CB SER A 24 12.951 -3.574 7.774 1.00 47.88 C
|
| 231 |
+
ATOM 177 O SER A 24 14.604 -2.539 5.638 1.00 47.88 O
|
| 232 |
+
ATOM 178 OG SER A 24 12.450 -4.402 8.804 1.00 47.88 O
|
| 233 |
+
ATOM 179 N LEU A 25 15.953 -4.272 6.087 1.00 53.12 N
|
| 234 |
+
ATOM 180 CA LEU A 25 16.451 -4.507 4.745 1.00 53.12 C
|
| 235 |
+
ATOM 181 C LEU A 25 15.347 -5.189 3.918 1.00 53.12 C
|
| 236 |
+
ATOM 182 CB LEU A 25 17.734 -5.348 4.916 1.00 53.12 C
|
| 237 |
+
ATOM 183 O LEU A 25 15.424 -6.387 3.666 1.00 53.12 O
|
| 238 |
+
ATOM 184 CG LEU A 25 18.681 -5.323 3.702 1.00 53.12 C
|
| 239 |
+
ATOM 185 CD1 LEU A 25 20.064 -4.837 4.138 1.00 53.12 C
|
| 240 |
+
ATOM 186 CD2 LEU A 25 18.846 -6.707 3.072 1.00 53.12 C
|
| 241 |
+
ATOM 187 N ARG A 26 14.254 -4.487 3.585 1.00 48.38 N
|
| 242 |
+
ATOM 188 CA ARG A 26 13.098 -5.087 2.883 1.00 48.38 C
|
| 243 |
+
ATOM 189 C ARG A 26 12.308 -4.093 2.024 1.00 48.38 C
|
| 244 |
+
ATOM 190 CB ARG A 26 12.243 -5.912 3.874 1.00 48.38 C
|
| 245 |
+
ATOM 191 O ARG A 26 11.095 -3.974 2.106 1.00 48.38 O
|
| 246 |
+
ATOM 192 CG ARG A 26 12.412 -7.422 3.630 1.00 48.38 C
|
| 247 |
+
ATOM 193 CD ARG A 26 11.796 -8.230 4.771 1.00 48.38 C
|
| 248 |
+
ATOM 194 NE ARG A 26 12.295 -9.619 4.770 1.00 48.38 N
|
| 249 |
+
ATOM 195 NH1 ARG A 26 10.506 -10.633 3.754 1.00 48.38 N
|
| 250 |
+
ATOM 196 NH2 ARG A 26 12.255 -11.861 4.421 1.00 48.38 N
|
| 251 |
+
ATOM 197 CZ ARG A 26 11.682 -10.694 4.316 1.00 48.38 C
|
| 252 |
+
ATOM 198 N GLY A 27 13.023 -3.447 1.120 1.00 48.81 N
|
| 253 |
+
ATOM 199 CA GLY A 27 12.475 -2.920 -0.124 1.00 48.81 C
|
| 254 |
+
ATOM 200 C GLY A 27 13.597 -2.992 -1.142 1.00 48.81 C
|
| 255 |
+
ATOM 201 O GLY A 27 14.520 -2.187 -1.083 1.00 48.81 O
|
| 256 |
+
ATOM 202 N MET A 28 13.617 -4.029 -1.983 1.00 47.44 N
|
| 257 |
+
ATOM 203 CA MET A 28 14.601 -4.135 -3.062 1.00 47.44 C
|
| 258 |
+
ATOM 204 C MET A 28 14.508 -2.873 -3.918 1.00 47.44 C
|
| 259 |
+
ATOM 205 CB MET A 28 14.319 -5.368 -3.939 1.00 47.44 C
|
| 260 |
+
ATOM 206 O MET A 28 13.542 -2.720 -4.647 1.00 47.44 O
|
| 261 |
+
ATOM 207 CG MET A 28 15.007 -6.634 -3.434 1.00 47.44 C
|
| 262 |
+
ATOM 208 SD MET A 28 14.600 -8.101 -4.419 1.00 47.44 S
|
| 263 |
+
ATOM 209 CE MET A 28 15.629 -9.329 -3.579 1.00 47.44 C
|
| 264 |
+
ATOM 210 N GLY A 29 15.501 -1.989 -3.794 1.00 51.47 N
|
| 265 |
+
ATOM 211 CA GLY A 29 15.712 -0.849 -4.680 1.00 51.47 C
|
| 266 |
+
ATOM 212 C GLY A 29 14.469 0.002 -4.902 1.00 51.47 C
|
| 267 |
+
ATOM 213 O GLY A 29 13.985 0.054 -6.027 1.00 51.47 O
|
| 268 |
+
ATOM 214 N ALA A 30 13.984 0.685 -3.862 1.00 54.94 N
|
| 269 |
+
ATOM 215 CA ALA A 30 13.025 1.761 -4.069 1.00 54.94 C
|
| 270 |
+
ATOM 216 C ALA A 30 13.659 2.774 -5.035 1.00 54.94 C
|
| 271 |
+
ATOM 217 CB ALA A 30 12.640 2.385 -2.720 1.00 54.94 C
|
| 272 |
+
ATOM 218 O ALA A 30 14.629 3.457 -4.692 1.00 54.94 O
|
| 273 |
+
ATOM 219 N ASP A 31 13.151 2.833 -6.267 1.00 60.44 N
|
| 274 |
+
ATOM 220 CA ASP A 31 13.412 3.964 -7.145 1.00 60.44 C
|
| 275 |
+
ATOM 221 C ASP A 31 12.992 5.202 -6.347 1.00 60.44 C
|
| 276 |
+
ATOM 222 CB ASP A 31 12.632 3.794 -8.465 1.00 60.44 C
|
| 277 |
+
ATOM 223 O ASP A 31 11.853 5.277 -5.887 1.00 60.44 O
|
| 278 |
+
ATOM 224 CG ASP A 31 12.937 4.855 -9.531 1.00 60.44 C
|
| 279 |
+
ATOM 225 OD1 ASP A 31 13.835 5.700 -9.303 1.00 60.44 O
|
| 280 |
+
ATOM 226 OD2 ASP A 31 12.294 4.807 -10.605 1.00 60.44 O
|
| 281 |
+
ATOM 227 N LEU A 32 13.899 6.160 -6.131 1.00 66.75 N
|
| 282 |
+
ATOM 228 CA LEU A 32 13.679 7.337 -5.262 1.00 66.75 C
|
| 283 |
+
ATOM 229 C LEU A 32 12.496 8.219 -5.712 1.00 66.75 C
|
| 284 |
+
ATOM 230 CB LEU A 32 14.975 8.170 -5.227 1.00 66.75 C
|
| 285 |
+
ATOM 231 O LEU A 32 12.190 9.243 -5.107 1.00 66.75 O
|
| 286 |
+
ATOM 232 CG LEU A 32 16.126 7.542 -4.425 1.00 66.75 C
|
| 287 |
+
ATOM 233 CD1 LEU A 32 17.413 8.324 -4.694 1.00 66.75 C
|
| 288 |
+
ATOM 234 CD2 LEU A 32 15.859 7.581 -2.919 1.00 66.75 C
|
| 289 |
+
ATOM 235 N ARG A 33 11.876 7.847 -6.826 1.00 82.25 N
|
| 290 |
+
ATOM 236 CA ARG A 33 10.768 8.497 -7.506 1.00 82.25 C
|
| 291 |
+
ATOM 237 C ARG A 33 9.424 7.801 -7.253 1.00 82.25 C
|
| 292 |
+
ATOM 238 CB ARG A 33 11.119 8.469 -8.990 1.00 82.25 C
|
| 293 |
+
ATOM 239 O ARG A 33 8.390 8.384 -7.575 1.00 82.25 O
|
| 294 |
+
ATOM 240 CG ARG A 33 12.499 9.047 -9.323 1.00 82.25 C
|
| 295 |
+
ATOM 241 CD ARG A 33 12.672 9.117 -10.837 1.00 82.25 C
|
| 296 |
+
ATOM 242 NE ARG A 33 12.051 10.345 -11.368 1.00 82.25 N
|
| 297 |
+
ATOM 243 NH1 ARG A 33 12.368 9.891 -13.582 1.00 82.25 N
|
| 298 |
+
ATOM 244 NH2 ARG A 33 11.563 11.892 -12.955 1.00 82.25 N
|
| 299 |
+
ATOM 245 CZ ARG A 33 11.993 10.704 -12.630 1.00 82.25 C
|
| 300 |
+
ATOM 246 N CYS A 34 9.435 6.586 -6.704 1.00 89.06 N
|
| 301 |
+
ATOM 247 CA CYS A 34 8.249 5.901 -6.200 1.00 89.06 C
|
| 302 |
+
ATOM 248 C CYS A 34 7.684 6.638 -4.975 1.00 89.06 C
|
| 303 |
+
ATOM 249 CB CYS A 34 8.611 4.443 -5.886 1.00 89.06 C
|
| 304 |
+
ATOM 250 O CYS A 34 8.396 7.357 -4.270 1.00 89.06 O
|
| 305 |
+
ATOM 251 SG CYS A 34 8.993 3.400 -7.323 1.00 89.06 S
|
| 306 |
+
ATOM 252 N ARG A 35 6.383 6.482 -4.723 1.00 90.56 N
|
| 307 |
+
ATOM 253 CA ARG A 35 5.702 7.083 -3.562 1.00 90.56 C
|
| 308 |
+
ATOM 254 C ARG A 35 6.054 6.353 -2.268 1.00 90.56 C
|
| 309 |
+
ATOM 255 CB ARG A 35 4.189 7.019 -3.787 1.00 90.56 C
|
| 310 |
+
ATOM 256 O ARG A 35 6.053 6.951 -1.196 1.00 90.56 O
|
| 311 |
+
ATOM 257 CG ARG A 35 3.758 7.767 -5.052 1.00 90.56 C
|
| 312 |
+
ATOM 258 CD ARG A 35 2.270 7.537 -5.270 1.00 90.56 C
|
| 313 |
+
ATOM 259 NE ARG A 35 1.804 8.249 -6.470 1.00 90.56 N
|
| 314 |
+
ATOM 260 NH1 ARG A 35 -0.354 8.446 -5.796 1.00 90.56 N
|
| 315 |
+
ATOM 261 NH2 ARG A 35 0.229 9.224 -7.804 1.00 90.56 N
|
| 316 |
+
ATOM 262 CZ ARG A 35 0.566 8.635 -6.691 1.00 90.56 C
|
| 317 |
+
ATOM 263 N CYS A 36 6.328 5.062 -2.381 1.00 91.62 N
|
| 318 |
+
ATOM 264 CA CYS A 36 6.603 4.140 -1.303 1.00 91.62 C
|
| 319 |
+
ATOM 265 C CYS A 36 8.103 3.870 -1.202 1.00 91.62 C
|
| 320 |
+
ATOM 266 CB CYS A 36 5.810 2.859 -1.570 1.00 91.62 C
|
| 321 |
+
ATOM 267 O CYS A 36 8.714 3.319 -2.112 1.00 91.62 O
|
| 322 |
+
ATOM 268 SG CYS A 36 4.015 3.099 -1.527 1.00 91.62 S
|
| 323 |
+
ATOM 269 N ILE A 37 8.682 4.231 -0.057 1.00 87.75 N
|
| 324 |
+
ATOM 270 CA ILE A 37 10.065 3.883 0.301 1.00 87.75 C
|
| 325 |
+
ATOM 271 C ILE A 37 10.073 2.593 1.130 1.00 87.75 C
|
| 326 |
+
ATOM 272 CB ILE A 37 10.730 5.061 1.050 1.00 87.75 C
|
| 327 |
+
ATOM 273 O ILE A 37 10.888 1.701 0.911 1.00 87.75 O
|
| 328 |
+
ATOM 274 CG1 ILE A 37 10.699 6.347 0.187 1.00 87.75 C
|
| 329 |
+
ATOM 275 CG2 ILE A 37 12.176 4.700 1.439 1.00 87.75 C
|
| 330 |
+
ATOM 276 CD1 ILE A 37 11.200 7.602 0.911 1.00 87.75 C
|
| 331 |
+
ATOM 277 N GLU A 38 9.118 2.478 2.052 1.00 87.19 N
|
| 332 |
+
ATOM 278 CA GLU A 38 8.924 1.320 2.918 1.00 87.19 C
|
| 333 |
+
ATOM 279 C GLU A 38 7.532 0.736 2.705 1.00 87.19 C
|
| 334 |
+
ATOM 280 CB GLU A 38 9.117 1.706 4.388 1.00 87.19 C
|
| 335 |
+
ATOM 281 O GLU A 38 6.602 1.445 2.321 1.00 87.19 O
|
| 336 |
+
ATOM 282 CG GLU A 38 10.552 2.161 4.686 1.00 87.19 C
|
| 337 |
+
ATOM 283 CD GLU A 38 10.785 2.446 6.177 1.00 87.19 C
|
| 338 |
+
ATOM 284 OE1 GLU A 38 11.971 2.565 6.555 1.00 87.19 O
|
| 339 |
+
ATOM 285 OE2 GLU A 38 9.789 2.544 6.931 1.00 87.19 O
|
| 340 |
+
ATOM 286 N THR A 39 7.379 -0.561 2.965 1.00 92.75 N
|
| 341 |
+
ATOM 287 CA THR A 39 6.100 -1.264 2.821 1.00 92.75 C
|
| 342 |
+
ATOM 288 C THR A 39 5.745 -2.027 4.090 1.00 92.75 C
|
| 343 |
+
ATOM 289 CB THR A 39 6.078 -2.195 1.600 1.00 92.75 C
|
| 344 |
+
ATOM 290 O THR A 39 6.610 -2.513 4.815 1.00 92.75 O
|
| 345 |
+
ATOM 291 CG2 THR A 39 6.299 -1.462 0.277 1.00 92.75 C
|
| 346 |
+
ATOM 292 OG1 THR A 39 7.051 -3.206 1.692 1.00 92.75 O
|
| 347 |
+
ATOM 293 N GLU A 40 4.448 -2.135 4.367 1.00 93.50 N
|
| 348 |
+
ATOM 294 CA GLU A 40 3.905 -2.833 5.524 1.00 93.50 C
|
| 349 |
+
ATOM 295 C GLU A 40 3.290 -4.168 5.090 1.00 93.50 C
|
| 350 |
+
ATOM 296 CB GLU A 40 2.913 -1.905 6.249 1.00 93.50 C
|
| 351 |
+
ATOM 297 O GLU A 40 2.297 -4.224 4.356 1.00 93.50 O
|
| 352 |
+
ATOM 298 CG GLU A 40 2.320 -2.487 7.538 1.00 93.50 C
|
| 353 |
+
ATOM 299 CD GLU A 40 3.378 -2.925 8.561 1.00 93.50 C
|
| 354 |
+
ATOM 300 OE1 GLU A 40 3.666 -4.141 8.611 1.00 93.50 O
|
| 355 |
+
ATOM 301 OE2 GLU A 40 3.816 -2.125 9.415 1.00 93.50 O
|
| 356 |
+
ATOM 302 N SER A 41 3.878 -5.266 5.566 1.00 94.00 N
|
| 357 |
+
ATOM 303 CA SER A 41 3.403 -6.625 5.285 1.00 94.00 C
|
| 358 |
+
ATOM 304 C SER A 41 2.460 -7.155 6.377 1.00 94.00 C
|
| 359 |
+
ATOM 305 CB SER A 41 4.579 -7.594 5.081 1.00 94.00 C
|
| 360 |
+
ATOM 306 O SER A 41 1.770 -8.160 6.153 1.00 94.00 O
|
| 361 |
+
ATOM 307 OG SER A 41 5.627 -7.039 4.315 1.00 94.00 O
|
| 362 |
+
ATOM 308 N ARG A 42 2.396 -6.522 7.565 1.00 94.19 N
|
| 363 |
+
ATOM 309 CA ARG A 42 1.543 -6.979 8.678 1.00 94.19 C
|
| 364 |
+
ATOM 310 C ARG A 42 0.072 -6.978 8.279 1.00 94.19 C
|
| 365 |
+
ATOM 311 CB ARG A 42 1.767 -6.148 9.958 1.00 94.19 C
|
| 366 |
+
ATOM 312 O ARG A 42 -0.418 -6.134 7.535 1.00 94.19 O
|
| 367 |
+
ATOM 313 CG ARG A 42 3.131 -6.454 10.604 1.00 94.19 C
|
| 368 |
+
ATOM 314 CD ARG A 42 3.411 -5.619 11.862 1.00 94.19 C
|
| 369 |
+
ATOM 315 NE ARG A 42 3.949 -4.289 11.541 1.00 94.19 N
|
| 370 |
+
ATOM 316 NH1 ARG A 42 4.864 -3.774 13.595 1.00 94.19 N
|
| 371 |
+
ATOM 317 NH2 ARG A 42 5.078 -2.368 11.868 1.00 94.19 N
|
| 372 |
+
ATOM 318 CZ ARG A 42 4.626 -3.487 12.342 1.00 94.19 C
|
| 373 |
+
ATOM 319 N ARG A 43 -0.681 -7.948 8.803 1.00 91.69 N
|
| 374 |
+
ATOM 320 CA ARG A 43 -2.107 -8.098 8.492 1.00 91.69 C
|
| 375 |
+
ATOM 321 C ARG A 43 -2.933 -7.052 9.247 1.00 91.69 C
|
| 376 |
+
ATOM 322 CB ARG A 43 -2.551 -9.544 8.755 1.00 91.69 C
|
| 377 |
+
ATOM 323 O ARG A 43 -3.414 -7.305 10.346 1.00 91.69 O
|
| 378 |
+
ATOM 324 CG ARG A 43 -3.996 -9.767 8.282 1.00 91.69 C
|
| 379 |
+
ATOM 325 CD ARG A 43 -4.488 -11.184 8.595 1.00 91.69 C
|
| 380 |
+
ATOM 326 NE ARG A 43 -4.007 -12.171 7.608 1.00 91.69 N
|
| 381 |
+
ATOM 327 NH1 ARG A 43 -3.409 -13.864 9.056 1.00 91.69 N
|
| 382 |
+
ATOM 328 NH2 ARG A 43 -3.283 -14.197 6.861 1.00 91.69 N
|
| 383 |
+
ATOM 329 CZ ARG A 43 -3.573 -13.398 7.850 1.00 91.69 C
|
| 384 |
+
ATOM 330 N ILE A 44 -3.154 -5.910 8.607 1.00 91.75 N
|
| 385 |
+
ATOM 331 CA ILE A 44 -3.869 -4.753 9.171 1.00 91.75 C
|
| 386 |
+
ATOM 332 C ILE A 44 -5.179 -4.426 8.448 1.00 91.75 C
|
| 387 |
+
ATOM 333 CB ILE A 44 -2.937 -3.531 9.242 1.00 91.75 C
|
| 388 |
+
ATOM 334 O ILE A 44 -5.766 -3.382 8.694 1.00 91.75 O
|
| 389 |
+
ATOM 335 CG1 ILE A 44 -2.408 -3.221 7.831 1.00 91.75 C
|
| 390 |
+
ATOM 336 CG2 ILE A 44 -1.822 -3.786 10.272 1.00 91.75 C
|
| 391 |
+
ATOM 337 CD1 ILE A 44 -1.515 -2.004 7.806 1.00 91.75 C
|
| 392 |
+
ATOM 338 N GLY A 45 -5.693 -5.324 7.600 1.00 88.00 N
|
| 393 |
+
ATOM 339 CA GLY A 45 -6.889 -5.076 6.780 1.00 88.00 C
|
| 394 |
+
ATOM 340 C GLY A 45 -8.131 -4.573 7.536 1.00 88.00 C
|
| 395 |
+
ATOM 341 O GLY A 45 -8.905 -3.807 6.981 1.00 88.00 O
|
| 396 |
+
ATOM 342 N LYS A 46 -8.300 -4.925 8.821 1.00 90.56 N
|
| 397 |
+
ATOM 343 CA LYS A 46 -9.396 -4.410 9.674 1.00 90.56 C
|
| 398 |
+
ATOM 344 C LYS A 46 -9.270 -2.917 10.009 1.00 90.56 C
|
| 399 |
+
ATOM 345 CB LYS A 46 -9.460 -5.197 10.993 1.00 90.56 C
|
| 400 |
+
ATOM 346 O LYS A 46 -10.246 -2.291 10.405 1.00 90.56 O
|
| 401 |
+
ATOM 347 CG LYS A 46 -9.837 -6.675 10.816 1.00 90.56 C
|
| 402 |
+
ATOM 348 CD LYS A 46 -9.974 -7.347 12.191 1.00 90.56 C
|
| 403 |
+
ATOM 349 CE LYS A 46 -10.366 -8.822 12.048 1.00 90.56 C
|
| 404 |
+
ATOM 350 NZ LYS A 46 -10.537 -9.476 13.372 1.00 90.56 N
|
| 405 |
+
ATOM 351 N LEU A 47 -8.061 -2.373 9.914 1.00 94.00 N
|
| 406 |
+
ATOM 352 CA LEU A 47 -7.728 -0.984 10.213 1.00 94.00 C
|
| 407 |
+
ATOM 353 C LEU A 47 -7.743 -0.110 8.955 1.00 94.00 C
|
| 408 |
+
ATOM 354 CB LEU A 47 -6.351 -0.921 10.904 1.00 94.00 C
|
| 409 |
+
ATOM 355 O LEU A 47 -7.498 1.084 9.062 1.00 94.00 O
|
| 410 |
+
ATOM 356 CG LEU A 47 -6.195 -1.801 12.157 1.00 94.00 C
|
| 411 |
+
ATOM 357 CD1 LEU A 47 -4.772 -1.684 12.698 1.00 94.00 C
|
| 412 |
+
ATOM 358 CD2 LEU A 47 -7.171 -1.398 13.267 1.00 94.00 C
|
| 413 |
+
ATOM 359 N ILE A 48 -8.015 -0.675 7.778 1.00 94.44 N
|
| 414 |
+
ATOM 360 CA ILE A 48 -7.971 0.042 6.504 1.00 94.44 C
|
| 415 |
+
ATOM 361 C ILE A 48 -9.355 0.604 6.173 1.00 94.44 C
|
| 416 |
+
ATOM 362 CB ILE A 48 -7.419 -0.877 5.397 1.00 94.44 C
|
| 417 |
+
ATOM 363 O ILE A 48 -10.353 -0.110 6.215 1.00 94.44 O
|
| 418 |
+
ATOM 364 CG1 ILE A 48 -5.959 -1.279 5.718 1.00 94.44 C
|
| 419 |
+
ATOM 365 CG2 ILE A 48 -7.511 -0.164 4.044 1.00 94.44 C
|
| 420 |
+
ATOM 366 CD1 ILE A 48 -5.306 -2.209 4.689 1.00 94.44 C
|
| 421 |
+
ATOM 367 N LYS A 49 -9.404 1.891 5.822 1.00 95.44 N
|
| 422 |
+
ATOM 368 CA LYS A 49 -10.609 2.597 5.360 1.00 95.44 C
|
| 423 |
+
ATOM 369 C LYS A 49 -10.701 2.661 3.840 1.00 95.44 C
|
| 424 |
+
ATOM 370 CB LYS A 49 -10.597 4.006 5.964 1.00 95.44 C
|
| 425 |
+
ATOM 371 O LYS A 49 -11.785 2.518 3.287 1.00 95.44 O
|
| 426 |
+
ATOM 372 CG LYS A 49 -11.818 4.857 5.591 1.00 95.44 C
|
| 427 |
+
ATOM 373 CD LYS A 49 -11.738 6.224 6.282 1.00 95.44 C
|
| 428 |
+
ATOM 374 CE LYS A 49 -12.942 7.090 5.898 1.00 95.44 C
|
| 429 |
+
ATOM 375 NZ LYS A 49 -12.849 8.441 6.508 1.00 95.44 N
|
| 430 |
+
ATOM 376 N LYS A 50 -9.573 2.914 3.180 1.00 94.50 N
|
| 431 |
+
ATOM 377 CA LYS A 50 -9.469 3.113 1.731 1.00 94.50 C
|
| 432 |
+
ATOM 378 C LYS A 50 -8.198 2.437 1.234 1.00 94.50 C
|
| 433 |
+
ATOM 379 CB LYS A 50 -9.469 4.624 1.434 1.00 94.50 C
|
| 434 |
+
ATOM 380 O LYS A 50 -7.213 2.399 1.965 1.00 94.50 O
|
| 435 |
+
ATOM 381 CG LYS A 50 -9.598 4.959 -0.061 1.00 94.50 C
|
| 436 |
+
ATOM 382 CD LYS A 50 -9.401 6.463 -0.301 1.00 94.50 C
|
| 437 |
+
ATOM 383 CE LYS A 50 -9.478 6.789 -1.798 1.00 94.50 C
|
| 438 |
+
ATOM 384 NZ LYS A 50 -8.737 8.031 -2.126 1.00 94.50 N
|
| 439 |
+
ATOM 385 N VAL A 51 -8.241 1.903 0.020 1.00 94.44 N
|
| 440 |
+
ATOM 386 CA VAL A 51 -7.080 1.341 -0.677 1.00 94.44 C
|
| 441 |
+
ATOM 387 C VAL A 51 -7.049 1.922 -2.080 1.00 94.44 C
|
| 442 |
+
ATOM 388 CB VAL A 51 -7.135 -0.195 -0.736 1.00 94.44 C
|
| 443 |
+
ATOM 389 O VAL A 51 -8.077 1.949 -2.755 1.00 94.44 O
|
| 444 |
+
ATOM 390 CG1 VAL A 51 -5.949 -0.788 -1.504 1.00 94.44 C
|
| 445 |
+
ATOM 391 CG2 VAL A 51 -7.132 -0.818 0.658 1.00 94.44 C
|
| 446 |
+
ATOM 392 N GLU A 52 -5.873 2.360 -2.503 1.00 94.81 N
|
| 447 |
+
ATOM 393 CA GLU A 52 -5.597 2.887 -3.833 1.00 94.81 C
|
| 448 |
+
ATOM 394 C GLU A 52 -4.434 2.114 -4.447 1.00 94.81 C
|
| 449 |
+
ATOM 395 CB GLU A 52 -5.312 4.395 -3.762 1.00 94.81 C
|
| 450 |
+
ATOM 396 O GLU A 52 -3.457 1.792 -3.771 1.00 94.81 O
|
| 451 |
+
ATOM 397 CG GLU A 52 -6.597 5.124 -3.361 1.00 94.81 C
|
| 452 |
+
ATOM 398 CD GLU A 52 -6.434 6.634 -3.224 1.00 94.81 C
|
| 453 |
+
ATOM 399 OE1 GLU A 52 -6.954 7.354 -4.106 1.00 94.81 O
|
| 454 |
+
ATOM 400 OE2 GLU A 52 -6.175 7.101 -2.097 1.00 94.81 O
|
| 455 |
+
ATOM 401 N MET A 53 -4.570 1.791 -5.730 1.00 92.56 N
|
| 456 |
+
ATOM 402 CA MET A 53 -3.558 1.084 -6.505 1.00 92.56 C
|
| 457 |
+
ATOM 403 C MET A 53 -2.939 2.055 -7.503 1.00 92.56 C
|
| 458 |
+
ATOM 404 CB MET A 53 -4.202 -0.120 -7.201 1.00 92.56 C
|
| 459 |
+
ATOM 405 O MET A 53 -3.655 2.709 -8.262 1.00 92.56 O
|
| 460 |
+
ATOM 406 CG MET A 53 -3.191 -0.949 -8.006 1.00 92.56 C
|
| 461 |
+
ATOM 407 SD MET A 53 -3.950 -2.252 -9.012 1.00 92.56 S
|
| 462 |
+
ATOM 408 CE MET A 53 -4.533 -3.377 -7.724 1.00 92.56 C
|
| 463 |
+
ATOM 409 N PHE A 54 -1.614 2.109 -7.520 1.00 92.31 N
|
| 464 |
+
ATOM 410 CA PHE A 54 -0.830 2.885 -8.467 1.00 92.31 C
|
| 465 |
+
ATOM 411 C PHE A 54 -0.034 1.906 -9.333 1.00 92.31 C
|
| 466 |
+
ATOM 412 CB PHE A 54 0.047 3.889 -7.715 1.00 92.31 C
|
| 467 |
+
ATOM 413 O PHE A 54 0.879 1.249 -8.830 1.00 92.31 O
|
| 468 |
+
ATOM 414 CG PHE A 54 -0.780 4.841 -6.876 1.00 92.31 C
|
| 469 |
+
ATOM 415 CD1 PHE A 54 -1.478 5.889 -7.503 1.00 92.31 C
|
| 470 |
+
ATOM 416 CD2 PHE A 54 -0.972 4.595 -5.504 1.00 92.31 C
|
| 471 |
+
ATOM 417 CE1 PHE A 54 -2.390 6.668 -6.770 1.00 92.31 C
|
| 472 |
+
ATOM 418 CE2 PHE A 54 -1.860 5.397 -4.767 1.00 92.31 C
|
| 473 |
+
ATOM 419 CZ PHE A 54 -2.571 6.431 -5.395 1.00 92.31 C
|
| 474 |
+
ATOM 420 N PRO A 55 -0.409 1.732 -10.612 1.00 91.31 N
|
| 475 |
+
ATOM 421 CA PRO A 55 0.312 0.840 -11.507 1.00 91.31 C
|
| 476 |
+
ATOM 422 C PRO A 55 1.700 1.408 -11.854 1.00 91.31 C
|
| 477 |
+
ATOM 423 CB PRO A 55 -0.585 0.707 -12.741 1.00 91.31 C
|
| 478 |
+
ATOM 424 O PRO A 55 1.937 2.607 -11.666 1.00 91.31 O
|
| 479 |
+
ATOM 425 CG PRO A 55 -1.302 2.053 -12.794 1.00 91.31 C
|
| 480 |
+
ATOM 426 CD PRO A 55 -1.490 2.404 -11.320 1.00 91.31 C
|
| 481 |
+
ATOM 427 N PRO A 56 2.592 0.580 -12.428 1.00 91.69 N
|
| 482 |
+
ATOM 428 CA PRO A 56 3.890 1.032 -12.907 1.00 91.69 C
|
| 483 |
+
ATOM 429 C PRO A 56 3.773 2.214 -13.877 1.00 91.69 C
|
| 484 |
+
ATOM 430 CB PRO A 56 4.525 -0.186 -13.583 1.00 91.69 C
|
| 485 |
+
ATOM 431 O PRO A 56 2.881 2.272 -14.724 1.00 91.69 O
|
| 486 |
+
ATOM 432 CG PRO A 56 3.876 -1.361 -12.855 1.00 91.69 C
|
| 487 |
+
ATOM 433 CD PRO A 56 2.452 -0.850 -12.652 1.00 91.69 C
|
| 488 |
+
ATOM 434 N SER A 57 4.715 3.145 -13.778 1.00 89.94 N
|
| 489 |
+
ATOM 435 CA SER A 57 4.821 4.356 -14.590 1.00 89.94 C
|
| 490 |
+
ATOM 436 C SER A 57 6.252 4.557 -15.103 1.00 89.94 C
|
| 491 |
+
ATOM 437 CB SER A 57 4.353 5.564 -13.767 1.00 89.94 C
|
| 492 |
+
ATOM 438 O SER A 57 7.179 3.840 -14.731 1.00 89.94 O
|
| 493 |
+
ATOM 439 OG SER A 57 5.295 5.877 -12.758 1.00 89.94 O
|
| 494 |
+
ATOM 440 N SER A 58 6.472 5.583 -15.930 1.00 90.12 N
|
| 495 |
+
ATOM 441 CA SER A 58 7.815 5.983 -16.384 1.00 90.12 C
|
| 496 |
+
ATOM 442 C SER A 58 8.764 6.377 -15.247 1.00 90.12 C
|
| 497 |
+
ATOM 443 CB SER A 58 7.691 7.179 -17.334 1.00 90.12 C
|
| 498 |
+
ATOM 444 O SER A 58 9.975 6.438 -15.454 1.00 90.12 O
|
| 499 |
+
ATOM 445 OG SER A 58 6.921 8.213 -16.739 1.00 90.12 O
|
| 500 |
+
ATOM 446 N HIS A 59 8.219 6.698 -14.073 1.00 86.50 N
|
| 501 |
+
ATOM 447 CA HIS A 59 8.964 7.186 -12.915 1.00 86.50 C
|
| 502 |
+
ATOM 448 C HIS A 59 8.986 6.200 -11.750 1.00 86.50 C
|
| 503 |
+
ATOM 449 CB HIS A 59 8.369 8.529 -12.473 1.00 86.50 C
|
| 504 |
+
ATOM 450 O HIS A 59 9.669 6.473 -10.783 1.00 86.50 O
|
| 505 |
+
ATOM 451 CG HIS A 59 8.345 9.555 -13.574 1.00 86.50 C
|
| 506 |
+
ATOM 452 CD2 HIS A 59 7.266 10.278 -13.999 1.00 86.50 C
|
| 507 |
+
ATOM 453 ND1 HIS A 59 9.400 9.876 -14.392 1.00 86.50 N
|
| 508 |
+
ATOM 454 CE1 HIS A 59 8.983 10.795 -15.275 1.00 86.50 C
|
| 509 |
+
ATOM 455 NE2 HIS A 59 7.685 11.059 -15.083 1.00 86.50 N
|
| 510 |
+
ATOM 456 N CYS A 60 8.239 5.101 -11.809 1.00 88.44 N
|
| 511 |
+
ATOM 457 CA CYS A 60 8.262 4.064 -10.785 1.00 88.44 C
|
| 512 |
+
ATOM 458 C CYS A 60 7.859 2.751 -11.448 1.00 88.44 C
|
| 513 |
+
ATOM 459 CB CYS A 60 7.298 4.430 -9.650 1.00 88.44 C
|
| 514 |
+
ATOM 460 O CYS A 60 6.761 2.652 -11.992 1.00 88.44 O
|
| 515 |
+
ATOM 461 SG CYS A 60 7.228 3.196 -8.327 1.00 88.44 S
|
| 516 |
+
ATOM 462 N ARG A 61 8.754 1.760 -11.462 1.00 88.88 N
|
| 517 |
+
ATOM 463 CA ARG A 61 8.501 0.474 -12.141 1.00 88.88 C
|
| 518 |
+
ATOM 464 C ARG A 61 7.645 -0.480 -11.317 1.00 88.88 C
|
| 519 |
+
ATOM 465 CB ARG A 61 9.825 -0.198 -12.511 1.00 88.88 C
|
| 520 |
+
ATOM 466 O ARG A 61 7.125 -1.450 -11.866 1.00 88.88 O
|
| 521 |
+
ATOM 467 CG ARG A 61 10.599 0.625 -13.544 1.00 88.88 C
|
| 522 |
+
ATOM 468 CD ARG A 61 11.854 -0.143 -13.951 1.00 88.88 C
|
| 523 |
+
ATOM 469 NE ARG A 61 12.657 0.628 -14.913 1.00 88.88 N
|
| 524 |
+
ATOM 470 NH1 ARG A 61 14.451 -0.798 -14.963 1.00 88.88 N
|
| 525 |
+
ATOM 471 NH2 ARG A 61 14.495 1.080 -16.174 1.00 88.88 N
|
| 526 |
+
ATOM 472 CZ ARG A 61 13.860 0.300 -15.346 1.00 88.88 C
|
| 527 |
+
ATOM 473 N ASP A 62 7.503 -0.197 -10.032 1.00 88.50 N
|
| 528 |
+
ATOM 474 CA ASP A 62 6.771 -1.040 -9.107 1.00 88.50 C
|
| 529 |
+
ATOM 475 C ASP A 62 5.285 -0.685 -9.102 1.00 88.50 C
|
| 530 |
+
ATOM 476 CB ASP A 62 7.421 -0.969 -7.720 1.00 88.50 C
|
| 531 |
+
ATOM 477 O ASP A 62 4.882 0.452 -9.347 1.00 88.50 O
|
| 532 |
+
ATOM 478 CG ASP A 62 8.873 -1.461 -7.765 1.00 88.50 C
|
| 533 |
+
ATOM 479 OD1 ASP A 62 9.132 -2.433 -8.514 1.00 88.50 O
|
| 534 |
+
ATOM 480 OD2 ASP A 62 9.712 -0.843 -7.082 1.00 88.50 O
|
| 535 |
+
ATOM 481 N THR A 63 4.451 -1.690 -8.837 1.00 90.38 N
|
| 536 |
+
ATOM 482 CA THR A 63 3.050 -1.444 -8.492 1.00 90.38 C
|
| 537 |
+
ATOM 483 C THR A 63 2.989 -1.077 -7.021 1.00 90.38 C
|
| 538 |
+
ATOM 484 CB THR A 63 2.175 -2.673 -8.746 1.00 90.38 C
|
| 539 |
+
ATOM 485 O THR A 63 3.393 -1.870 -6.172 1.00 90.38 O
|
| 540 |
+
ATOM 486 CG2 THR A 63 0.696 -2.420 -8.452 1.00 90.38 C
|
| 541 |
+
ATOM 487 OG1 THR A 63 2.286 -3.045 -10.097 1.00 90.38 O
|
| 542 |
+
ATOM 488 N GLU A 64 2.441 0.089 -6.714 1.00 92.69 N
|
| 543 |
+
ATOM 489 CA GLU A 64 2.320 0.571 -5.345 1.00 92.69 C
|
| 544 |
+
ATOM 490 C GLU A 64 0.873 0.456 -4.881 1.00 92.69 C
|
| 545 |
+
ATOM 491 CB GLU A 64 2.847 2.003 -5.201 1.00 92.69 C
|
| 546 |
+
ATOM 492 O GLU A 64 -0.072 0.728 -5.626 1.00 92.69 O
|
| 547 |
+
ATOM 493 CG GLU A 64 4.236 2.198 -5.818 1.00 92.69 C
|
| 548 |
+
ATOM 494 CD GLU A 64 4.712 3.630 -5.591 1.00 92.69 C
|
| 549 |
+
ATOM 495 OE1 GLU A 64 5.535 3.829 -4.679 1.00 92.69 O
|
| 550 |
+
ATOM 496 OE2 GLU A 64 4.228 4.569 -6.265 1.00 92.69 O
|
| 551 |
+
ATOM 497 N ILE A 65 0.683 0.058 -3.626 1.00 94.31 N
|
| 552 |
+
ATOM 498 CA ILE A 65 -0.639 0.018 -3.008 1.00 94.31 C
|
| 553 |
+
ATOM 499 C ILE A 65 -0.585 0.834 -1.740 1.00 94.31 C
|
| 554 |
+
ATOM 500 CB ILE A 65 -1.122 -1.421 -2.773 1.00 94.31 C
|
| 555 |
+
ATOM 501 O ILE A 65 0.132 0.485 -0.807 1.00 94.31 O
|
| 556 |
+
ATOM 502 CG1 ILE A 65 -1.189 -2.112 -4.145 1.00 94.31 C
|
| 557 |
+
ATOM 503 CG2 ILE A 65 -2.499 -1.414 -2.083 1.00 94.31 C
|
| 558 |
+
ATOM 504 CD1 ILE A 65 -1.827 -3.487 -4.125 1.00 94.31 C
|
| 559 |
+
ATOM 505 N ILE A 66 -1.370 1.904 -1.707 1.00 95.75 N
|
| 560 |
+
ATOM 506 CA ILE A 66 -1.430 2.814 -0.571 1.00 95.75 C
|
| 561 |
+
ATOM 507 C ILE A 66 -2.787 2.641 0.096 1.00 95.75 C
|
| 562 |
+
ATOM 508 CB ILE A 66 -1.113 4.267 -0.979 1.00 95.75 C
|
| 563 |
+
ATOM 509 O ILE A 66 -3.837 2.689 -0.547 1.00 95.75 O
|
| 564 |
+
ATOM 510 CG1 ILE A 66 0.241 4.325 -1.731 1.00 95.75 C
|
| 565 |
+
ATOM 511 CG2 ILE A 66 -1.093 5.164 0.271 1.00 95.75 C
|
| 566 |
+
ATOM 512 CD1 ILE A 66 0.692 5.724 -2.165 1.00 95.75 C
|
| 567 |
+
ATOM 513 N ALA A 67 -2.763 2.395 1.398 1.00 96.06 N
|
| 568 |
+
ATOM 514 CA ALA A 67 -3.947 2.253 2.218 1.00 96.06 C
|
| 569 |
+
ATOM 515 C ALA A 67 -4.047 3.401 3.219 1.00 96.06 C
|
| 570 |
+
ATOM 516 CB ALA A 67 -3.927 0.879 2.888 1.00 96.06 C
|
| 571 |
+
ATOM 517 O ALA A 67 -3.064 3.781 3.847 1.00 96.06 O
|
| 572 |
+
ATOM 518 N THR A 68 -5.258 3.911 3.416 1.00 96.75 N
|
| 573 |
+
ATOM 519 CA THR A 68 -5.557 4.908 4.446 1.00 96.75 C
|
| 574 |
+
ATOM 520 C THR A 68 -6.100 4.206 5.686 1.00 96.75 C
|
| 575 |
+
ATOM 521 CB THR A 68 -6.576 5.941 3.952 1.00 96.75 C
|
| 576 |
+
ATOM 522 O THR A 68 -7.106 3.490 5.612 1.00 96.75 O
|
| 577 |
+
ATOM 523 CG2 THR A 68 -6.631 7.167 4.854 1.00 96.75 C
|
| 578 |
+
ATOM 524 OG1 THR A 68 -6.315 6.379 2.640 1.00 96.75 O
|
| 579 |
+
ATOM 525 N LEU A 69 -5.476 4.426 6.842 1.00 96.12 N
|
| 580 |
+
ATOM 526 CA LEU A 69 -5.920 3.881 8.121 1.00 96.12 C
|
| 581 |
+
ATOM 527 C LEU A 69 -7.203 4.565 8.606 1.00 96.12 C
|
| 582 |
+
ATOM 528 CB LEU A 69 -4.792 3.990 9.162 1.00 96.12 C
|
| 583 |
+
ATOM 529 O LEU A 69 -7.342 5.784 8.572 1.00 96.12 O
|
| 584 |
+
ATOM 530 CG LEU A 69 -3.563 3.099 8.889 1.00 96.12 C
|
| 585 |
+
ATOM 531 CD1 LEU A 69 -2.563 3.241 10.037 1.00 96.12 C
|
| 586 |
+
ATOM 532 CD2 LEU A 69 -3.942 1.616 8.789 1.00 96.12 C
|
| 587 |
+
ATOM 533 N SER A 70 -8.154 3.782 9.108 1.00 96.06 N
|
| 588 |
+
ATOM 534 CA SER A 70 -9.478 4.258 9.521 1.00 96.06 C
|
| 589 |
+
ATOM 535 C SER A 70 -9.461 5.129 10.769 1.00 96.06 C
|
| 590 |
+
ATOM 536 CB SER A 70 -10.413 3.060 9.726 1.00 96.06 C
|
| 591 |
+
ATOM 537 O SER A 70 -10.268 6.050 10.868 1.00 96.06 O
|
| 592 |
+
ATOM 538 OG SER A 70 -9.902 2.164 10.699 1.00 96.06 O
|
| 593 |
+
ATOM 539 N LYS A 71 -8.551 4.849 11.707 1.00 94.31 N
|
| 594 |
+
ATOM 540 CA LYS A 71 -8.454 5.574 12.981 1.00 94.31 C
|
| 595 |
+
ATOM 541 C LYS A 71 -7.637 6.857 12.874 1.00 94.31 C
|
| 596 |
+
ATOM 542 CB LYS A 71 -7.880 4.667 14.076 1.00 94.31 C
|
| 597 |
+
ATOM 543 O LYS A 71 -8.067 7.884 13.377 1.00 94.31 O
|
| 598 |
+
ATOM 544 CG LYS A 71 -8.834 3.528 14.456 1.00 94.31 C
|
| 599 |
+
ATOM 545 CD LYS A 71 -8.279 2.777 15.672 1.00 94.31 C
|
| 600 |
+
ATOM 546 CE LYS A 71 -9.255 1.690 16.131 1.00 94.31 C
|
| 601 |
+
ATOM 547 NZ LYS A 71 -8.788 1.054 17.388 1.00 94.31 N
|
| 602 |
+
ATOM 548 N SER A 72 -6.459 6.779 12.258 1.00 94.62 N
|
| 603 |
+
ATOM 549 CA SER A 72 -5.518 7.902 12.177 1.00 94.62 C
|
| 604 |
+
ATOM 550 C SER A 72 -5.639 8.703 10.883 1.00 94.62 C
|
| 605 |
+
ATOM 551 CB SER A 72 -4.082 7.391 12.340 1.00 94.62 C
|
| 606 |
+
ATOM 552 O SER A 72 -5.136 9.817 10.827 1.00 94.62 O
|
| 607 |
+
ATOM 553 OG SER A 72 -3.813 6.369 11.396 1.00 94.62 O
|
| 608 |
+
ATOM 554 N GLY A 73 -6.253 8.152 9.831 1.00 94.44 N
|
| 609 |
+
ATOM 555 CA GLY A 73 -6.209 8.747 8.492 1.00 94.44 C
|
| 610 |
+
ATOM 556 C GLY A 73 -4.836 8.652 7.821 1.00 94.44 C
|
| 611 |
+
ATOM 557 O GLY A 73 -4.680 9.140 6.710 1.00 94.44 O
|
| 612 |
+
ATOM 558 N GLN A 74 -3.853 8.028 8.475 1.00 94.75 N
|
| 613 |
+
ATOM 559 CA GLN A 74 -2.498 7.903 7.955 1.00 94.75 C
|
| 614 |
+
ATOM 560 C GLN A 74 -2.472 7.012 6.715 1.00 94.75 C
|
| 615 |
+
ATOM 561 CB GLN A 74 -1.589 7.355 9.059 1.00 94.75 C
|
| 616 |
+
ATOM 562 O GLN A 74 -3.121 5.963 6.681 1.00 94.75 O
|
| 617 |
+
ATOM 563 CG GLN A 74 -0.119 7.244 8.630 1.00 94.75 C
|
| 618 |
+
ATOM 564 CD GLN A 74 0.765 6.780 9.779 1.00 94.75 C
|
| 619 |
+
ATOM 565 NE2 GLN A 74 1.945 7.338 9.932 1.00 94.75 N
|
| 620 |
+
ATOM 566 OE1 GLN A 74 0.394 5.928 10.574 1.00 94.75 O
|
| 621 |
+
ATOM 567 N GLU A 75 -1.687 7.423 5.727 1.00 95.44 N
|
| 622 |
+
ATOM 568 CA GLU A 75 -1.398 6.635 4.538 1.00 95.44 C
|
| 623 |
+
ATOM 569 C GLU A 75 -0.195 5.732 4.778 1.00 95.44 C
|
| 624 |
+
ATOM 570 CB GLU A 75 -1.178 7.548 3.332 1.00 95.44 C
|
| 625 |
+
ATOM 571 O GLU A 75 0.813 6.144 5.352 1.00 95.44 O
|
| 626 |
+
ATOM 572 CG GLU A 75 -2.459 8.328 3.016 1.00 95.44 C
|
| 627 |
+
ATOM 573 CD GLU A 75 -2.320 9.141 1.728 1.00 95.44 C
|
| 628 |
+
ATOM 574 OE1 GLU A 75 -3.237 9.013 0.888 1.00 95.44 O
|
| 629 |
+
ATOM 575 OE2 GLU A 75 -1.327 9.890 1.613 1.00 95.44 O
|
| 630 |
+
ATOM 576 N ILE A 76 -0.324 4.483 4.353 1.00 95.00 N
|
| 631 |
+
ATOM 577 CA ILE A 76 0.707 3.463 4.485 1.00 95.00 C
|
| 632 |
+
ATOM 578 C ILE A 76 0.817 2.677 3.185 1.00 95.00 C
|
| 633 |
+
ATOM 579 CB ILE A 76 0.421 2.536 5.681 1.00 95.00 C
|
| 634 |
+
ATOM 580 O ILE A 76 -0.185 2.368 2.539 1.00 95.00 O
|
| 635 |
+
ATOM 581 CG1 ILE A 76 -0.973 1.888 5.567 1.00 95.00 C
|
| 636 |
+
ATOM 582 CG2 ILE A 76 0.545 3.292 7.017 1.00 95.00 C
|
| 637 |
+
ATOM 583 CD1 ILE A 76 -1.111 0.702 6.488 1.00 95.00 C
|
| 638 |
+
ATOM 584 N CYS A 77 2.036 2.322 2.813 1.00 95.12 N
|
| 639 |
+
ATOM 585 CA CYS A 77 2.286 1.472 1.662 1.00 95.12 C
|
| 640 |
+
ATOM 586 C CYS A 77 2.173 0.002 2.063 1.00 95.12 C
|
| 641 |
+
ATOM 587 CB CYS A 77 3.658 1.825 1.118 1.00 95.12 C
|
| 642 |
+
ATOM 588 O CYS A 77 2.676 -0.400 3.109 1.00 95.12 O
|
| 643 |
+
ATOM 589 SG CYS A 77 3.719 3.493 0.434 1.00 95.12 S
|
| 644 |
+
ATOM 590 N LEU A 78 1.510 -0.808 1.246 1.00 95.25 N
|
| 645 |
+
ATOM 591 CA LEU A 78 1.320 -2.235 1.479 1.00 95.25 C
|
| 646 |
+
ATOM 592 C LEU A 78 2.285 -3.056 0.626 1.00 95.25 C
|
| 647 |
+
ATOM 593 CB LEU A 78 -0.136 -2.628 1.190 1.00 95.25 C
|
| 648 |
+
ATOM 594 O LEU A 78 2.472 -2.781 -0.557 1.00 95.25 O
|
| 649 |
+
ATOM 595 CG LEU A 78 -1.199 -1.920 2.045 1.00 95.25 C
|
| 650 |
+
ATOM 596 CD1 LEU A 78 -2.569 -2.507 1.687 1.00 95.25 C
|
| 651 |
+
ATOM 597 CD2 LEU A 78 -0.958 -2.105 3.546 1.00 95.25 C
|
| 652 |
+
ATOM 598 N ASP A 79 2.846 -4.108 1.215 1.00 94.19 N
|
| 653 |
+
ATOM 599 CA ASP A 79 3.723 -5.037 0.503 1.00 94.19 C
|
| 654 |
+
ATOM 600 C ASP A 79 2.915 -5.936 -0.448 1.00 94.19 C
|
| 655 |
+
ATOM 601 CB ASP A 79 4.516 -5.848 1.533 1.00 94.19 C
|
| 656 |
+
ATOM 602 O ASP A 79 2.196 -6.845 -0.021 1.00 94.19 O
|
| 657 |
+
ATOM 603 CG ASP A 79 5.396 -6.947 0.929 1.00 94.19 C
|
| 658 |
+
ATOM 604 OD1 ASP A 79 5.554 -7.014 -0.314 1.00 94.19 O
|
| 659 |
+
ATOM 605 OD2 ASP A 79 5.800 -7.821 1.734 1.00 94.19 O
|
| 660 |
+
ATOM 606 N VAL A 80 3.065 -5.714 -1.757 1.00 91.50 N
|
| 661 |
+
ATOM 607 CA VAL A 80 2.408 -6.496 -2.821 1.00 91.50 C
|
| 662 |
+
ATOM 608 C VAL A 80 2.782 -7.984 -2.808 1.00 91.50 C
|
| 663 |
+
ATOM 609 CB VAL A 80 2.695 -5.891 -4.210 1.00 91.50 C
|
| 664 |
+
ATOM 610 O VAL A 80 2.044 -8.822 -3.337 1.00 91.50 O
|
| 665 |
+
ATOM 611 CG1 VAL A 80 2.111 -4.478 -4.317 1.00 91.50 C
|
| 666 |
+
ATOM 612 CG2 VAL A 80 4.191 -5.848 -4.554 1.00 91.50 C
|
| 667 |
+
ATOM 613 N SER A 81 3.893 -8.352 -2.166 1.00 91.12 N
|
| 668 |
+
ATOM 614 CA SER A 81 4.310 -9.746 -2.000 1.00 91.12 C
|
| 669 |
+
ATOM 615 C SER A 81 3.503 -10.470 -0.920 1.00 91.12 C
|
| 670 |
+
ATOM 616 CB SER A 81 5.803 -9.832 -1.674 1.00 91.12 C
|
| 671 |
+
ATOM 617 O SER A 81 3.385 -11.701 -0.967 1.00 91.12 O
|
| 672 |
+
ATOM 618 OG SER A 81 6.549 -9.151 -2.657 1.00 91.12 O
|
| 673 |
+
ATOM 619 N ALA A 82 2.898 -9.740 0.024 1.00 93.81 N
|
| 674 |
+
ATOM 620 CA ALA A 82 2.153 -10.321 1.130 1.00 93.81 C
|
| 675 |
+
ATOM 621 C ALA A 82 0.856 -11.014 0.645 1.00 93.81 C
|
| 676 |
+
ATOM 622 CB ALA A 82 1.880 -9.243 2.183 1.00 93.81 C
|
| 677 |
+
ATOM 623 O ALA A 82 0.040 -10.405 -0.055 1.00 93.81 O
|
| 678 |
+
ATOM 624 N PRO A 83 0.570 -12.267 1.064 1.00 93.94 N
|
| 679 |
+
ATOM 625 CA PRO A 83 -0.577 -13.026 0.549 1.00 93.94 C
|
| 680 |
+
ATOM 626 C PRO A 83 -1.942 -12.361 0.755 1.00 93.94 C
|
| 681 |
+
ATOM 627 CB PRO A 83 -0.534 -14.369 1.287 1.00 93.94 C
|
| 682 |
+
ATOM 628 O PRO A 83 -2.867 -12.577 -0.023 1.00 93.94 O
|
| 683 |
+
ATOM 629 CG PRO A 83 0.947 -14.557 1.598 1.00 93.94 C
|
| 684 |
+
ATOM 630 CD PRO A 83 1.435 -13.135 1.856 1.00 93.94 C
|
| 685 |
+
ATOM 631 N TRP A 84 -2.106 -11.573 1.820 1.00 92.81 N
|
| 686 |
+
ATOM 632 CA TRP A 84 -3.368 -10.880 2.078 1.00 92.81 C
|
| 687 |
+
ATOM 633 C TRP A 84 -3.553 -9.655 1.173 1.00 92.81 C
|
| 688 |
+
ATOM 634 CB TRP A 84 -3.467 -10.522 3.564 1.00 92.81 C
|
| 689 |
+
ATOM 635 O TRP A 84 -4.688 -9.368 0.805 1.00 92.81 O
|
| 690 |
+
ATOM 636 CG TRP A 84 -2.603 -9.382 4.003 1.00 92.81 C
|
| 691 |
+
ATOM 637 CD1 TRP A 84 -1.344 -9.461 4.496 1.00 92.81 C
|
| 692 |
+
ATOM 638 CD2 TRP A 84 -2.921 -7.957 3.942 1.00 92.81 C
|
| 693 |
+
ATOM 639 CE2 TRP A 84 -1.805 -7.228 4.450 1.00 92.81 C
|
| 694 |
+
ATOM 640 CE3 TRP A 84 -4.036 -7.212 3.491 1.00 92.81 C
|
| 695 |
+
ATOM 641 NE1 TRP A 84 -0.874 -8.192 4.768 1.00 92.81 N
|
| 696 |
+
ATOM 642 CH2 TRP A 84 -2.928 -5.122 4.089 1.00 92.81 C
|
| 697 |
+
ATOM 643 CZ2 TRP A 84 -1.802 -5.833 4.532 1.00 92.81 C
|
| 698 |
+
ATOM 644 CZ3 TRP A 84 -4.036 -5.806 3.559 1.00 92.81 C
|
| 699 |
+
ATOM 645 N VAL A 85 -2.463 -8.985 0.784 1.00 93.19 N
|
| 700 |
+
ATOM 646 CA VAL A 85 -2.478 -7.849 -0.150 1.00 93.19 C
|
| 701 |
+
ATOM 647 C VAL A 85 -2.813 -8.344 -1.552 1.00 93.19 C
|
| 702 |
+
ATOM 648 CB VAL A 85 -1.136 -7.087 -0.133 1.00 93.19 C
|
| 703 |
+
ATOM 649 O VAL A 85 -3.688 -7.774 -2.194 1.00 93.19 O
|
| 704 |
+
ATOM 650 CG1 VAL A 85 -1.152 -5.890 -1.087 1.00 93.19 C
|
| 705 |
+
ATOM 651 CG2 VAL A 85 -0.846 -6.555 1.273 1.00 93.19 C
|
| 706 |
+
ATOM 652 N LYS A 86 -2.254 -9.486 -1.979 1.00 93.88 N
|
| 707 |
+
ATOM 653 CA LYS A 86 -2.635 -10.148 -3.243 1.00 93.88 C
|
| 708 |
+
ATOM 654 C LYS A 86 -4.140 -10.403 -3.348 1.00 93.88 C
|
| 709 |
+
ATOM 655 CB LYS A 86 -1.854 -11.456 -3.426 1.00 93.88 C
|
| 710 |
+
ATOM 656 O LYS A 86 -4.754 -10.056 -4.348 1.00 93.88 O
|
| 711 |
+
ATOM 657 CG LYS A 86 -0.363 -11.176 -3.638 1.00 93.88 C
|
| 712 |
+
ATOM 658 CD LYS A 86 0.421 -12.465 -3.900 1.00 93.88 C
|
| 713 |
+
ATOM 659 CE LYS A 86 1.890 -12.083 -4.100 1.00 93.88 C
|
| 714 |
+
ATOM 660 NZ LYS A 86 2.753 -13.265 -4.332 1.00 93.88 N
|
| 715 |
+
ATOM 661 N LYS A 87 -4.769 -10.884 -2.271 1.00 92.69 N
|
| 716 |
+
ATOM 662 CA LYS A 87 -6.232 -11.063 -2.224 1.00 92.69 C
|
| 717 |
+
ATOM 663 C LYS A 87 -7.010 -9.749 -2.330 1.00 92.69 C
|
| 718 |
+
ATOM 664 CB LYS A 87 -6.639 -11.789 -0.939 1.00 92.69 C
|
| 719 |
+
ATOM 665 O LYS A 87 -8.146 -9.752 -2.794 1.00 92.69 O
|
| 720 |
+
ATOM 666 CG LYS A 87 -6.168 -13.243 -0.941 1.00 92.69 C
|
| 721 |
+
ATOM 667 CD LYS A 87 -6.621 -13.955 0.336 1.00 92.69 C
|
| 722 |
+
ATOM 668 CE LYS A 87 -6.088 -15.387 0.283 1.00 92.69 C
|
| 723 |
+
ATOM 669 NZ LYS A 87 -6.649 -16.238 1.360 1.00 92.69 N
|
| 724 |
+
ATOM 670 N VAL A 88 -6.453 -8.636 -1.849 1.00 90.31 N
|
| 725 |
+
ATOM 671 CA VAL A 88 -7.061 -7.307 -2.027 1.00 90.31 C
|
| 726 |
+
ATOM 672 C VAL A 88 -6.948 -6.874 -3.488 1.00 90.31 C
|
| 727 |
+
ATOM 673 CB VAL A 88 -6.456 -6.261 -1.067 1.00 90.31 C
|
| 728 |
+
ATOM 674 O VAL A 88 -7.947 -6.445 -4.052 1.00 90.31 O
|
| 729 |
+
ATOM 675 CG1 VAL A 88 -6.986 -4.848 -1.337 1.00 90.31 C
|
| 730 |
+
ATOM 676 CG2 VAL A 88 -6.799 -6.600 0.391 1.00 90.31 C
|
| 731 |
+
ATOM 677 N ILE A 89 -5.782 -7.058 -4.114 1.00 91.25 N
|
| 732 |
+
ATOM 678 CA ILE A 89 -5.546 -6.784 -5.543 1.00 91.25 C
|
| 733 |
+
ATOM 679 C ILE A 89 -6.538 -7.552 -6.415 1.00 91.25 C
|
| 734 |
+
ATOM 680 CB ILE A 89 -4.093 -7.150 -5.930 1.00 91.25 C
|
| 735 |
+
ATOM 681 O ILE A 89 -7.228 -6.950 -7.229 1.00 91.25 O
|
| 736 |
+
ATOM 682 CG1 ILE A 89 -3.103 -6.241 -5.188 1.00 91.25 C
|
| 737 |
+
ATOM 683 CG2 ILE A 89 -3.855 -7.069 -7.450 1.00 91.25 C
|
| 738 |
+
ATOM 684 CD1 ILE A 89 -1.638 -6.688 -5.309 1.00 91.25 C
|
| 739 |
+
ATOM 685 N GLU A 90 -6.662 -8.863 -6.204 1.00 92.81 N
|
| 740 |
+
ATOM 686 CA GLU A 90 -7.597 -9.721 -6.943 1.00 92.81 C
|
| 741 |
+
ATOM 687 C GLU A 90 -9.034 -9.195 -6.861 1.00 92.81 C
|
| 742 |
+
ATOM 688 CB GLU A 90 -7.545 -11.140 -6.358 1.00 92.81 C
|
| 743 |
+
ATOM 689 O GLU A 90 -9.733 -9.136 -7.867 1.00 92.81 O
|
| 744 |
+
ATOM 690 CG GLU A 90 -6.260 -11.902 -6.722 1.00 92.81 C
|
| 745 |
+
ATOM 691 CD GLU A 90 -6.059 -13.180 -5.885 1.00 92.81 C
|
| 746 |
+
ATOM 692 OE1 GLU A 90 -5.011 -13.836 -6.076 1.00 92.81 O
|
| 747 |
+
ATOM 693 OE2 GLU A 90 -6.898 -13.472 -4.994 1.00 92.81 O
|
| 748 |
+
ATOM 694 N LYS A 91 -9.469 -8.743 -5.678 1.00 90.19 N
|
| 749 |
+
ATOM 695 CA LYS A 91 -10.805 -8.158 -5.490 1.00 90.19 C
|
| 750 |
+
ATOM 696 C LYS A 91 -10.982 -6.805 -6.171 1.00 90.19 C
|
| 751 |
+
ATOM 697 CB LYS A 91 -11.103 -8.007 -3.999 1.00 90.19 C
|
| 752 |
+
ATOM 698 O LYS A 91 -12.096 -6.496 -6.577 1.00 90.19 O
|
| 753 |
+
ATOM 699 CG LYS A 91 -11.395 -9.358 -3.349 1.00 90.19 C
|
| 754 |
+
ATOM 700 CD LYS A 91 -11.660 -9.137 -1.862 1.00 90.19 C
|
| 755 |
+
ATOM 701 CE LYS A 91 -11.990 -10.477 -1.214 1.00 90.19 C
|
| 756 |
+
ATOM 702 NZ LYS A 91 -12.480 -10.279 0.169 1.00 90.19 N
|
| 757 |
+
ATOM 703 N MET A 92 -9.925 -5.999 -6.253 1.00 86.75 N
|
| 758 |
+
ATOM 704 CA MET A 92 -9.955 -4.722 -6.969 1.00 86.75 C
|
| 759 |
+
ATOM 705 C MET A 92 -10.053 -4.934 -8.481 1.00 86.75 C
|
| 760 |
+
ATOM 706 CB MET A 92 -8.702 -3.893 -6.651 1.00 86.75 C
|
| 761 |
+
ATOM 707 O MET A 92 -10.775 -4.197 -9.136 1.00 86.75 O
|
| 762 |
+
ATOM 708 CG MET A 92 -8.644 -3.382 -5.211 1.00 86.75 C
|
| 763 |
+
ATOM 709 SD MET A 92 -9.886 -2.128 -4.801 1.00 86.75 S
|
| 764 |
+
ATOM 710 CE MET A 92 -8.913 -1.182 -3.613 1.00 86.75 C
|
| 765 |
+
ATOM 711 N LEU A 93 -9.350 -5.939 -9.016 1.00 87.94 N
|
| 766 |
+
ATOM 712 CA LEU A 93 -9.338 -6.271 -10.447 1.00 87.94 C
|
| 767 |
+
ATOM 713 C LEU A 93 -10.576 -7.054 -10.902 1.00 87.94 C
|
| 768 |
+
ATOM 714 CB LEU A 93 -8.074 -7.091 -10.758 1.00 87.94 C
|
| 769 |
+
ATOM 715 O LEU A 93 -10.911 -7.038 -12.080 1.00 87.94 O
|
| 770 |
+
ATOM 716 CG LEU A 93 -6.741 -6.348 -10.571 1.00 87.94 C
|
| 771 |
+
ATOM 717 CD1 LEU A 93 -5.589 -7.325 -10.808 1.00 87.94 C
|
| 772 |
+
ATOM 718 CD2 LEU A 93 -6.584 -5.173 -11.537 1.00 87.94 C
|
| 773 |
+
ATOM 719 N ALA A 94 -11.243 -7.761 -9.989 1.00 89.12 N
|
| 774 |
+
ATOM 720 CA ALA A 94 -12.479 -8.492 -10.271 1.00 89.12 C
|
| 775 |
+
ATOM 721 C ALA A 94 -13.730 -7.592 -10.345 1.00 89.12 C
|
| 776 |
+
ATOM 722 CB ALA A 94 -12.630 -9.597 -9.218 1.00 89.12 C
|
| 777 |
+
ATOM 723 O ALA A 94 -14.842 -8.111 -10.460 1.00 89.12 O
|
| 778 |
+
ATOM 724 N LYS A 95 -13.563 -6.273 -10.223 1.00 59.94 N
|
| 779 |
+
ATOM 725 CA LYS A 95 -14.625 -5.274 -10.314 1.00 59.94 C
|
| 780 |
+
ATOM 726 C LYS A 95 -14.507 -4.498 -11.617 1.00 59.94 C
|
| 781 |
+
ATOM 727 CB LYS A 95 -14.542 -4.356 -9.091 1.00 59.94 C
|
| 782 |
+
ATOM 728 O LYS A 95 -15.580 -4.210 -12.189 1.00 59.94 O
|
| 783 |
+
ATOM 729 CG LYS A 95 -15.704 -3.360 -9.115 1.00 59.94 C
|
| 784 |
+
ATOM 730 CD LYS A 95 -15.757 -2.553 -7.824 1.00 59.94 C
|
| 785 |
+
ATOM 731 CE LYS A 95 -16.988 -1.652 -7.905 1.00 59.94 C
|
| 786 |
+
ATOM 732 NZ LYS A 95 -17.127 -0.826 -6.686 1.00 59.94 N
|
| 787 |
+
ATOM 733 OXT LYS A 95 -13.359 -4.138 -11.935 1.00 59.94 O
|
| 788 |
+
TER 734 LYS A 95
|
| 789 |
+
ENDMDL
|
| 790 |
+
END
|
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|
| 1 |
+
HEADER 01-JUN-22
|
| 2 |
+
TITLE ALPHAFOLD MONOMER V2.0 PREDICTION FOR COPINE 3 (A0A087WUS8)
|
| 3 |
+
COMPND MOL_ID: 1;
|
| 4 |
+
COMPND 2 MOLECULE: COPINE 3;
|
| 5 |
+
COMPND 3 CHAIN: A
|
| 6 |
+
SOURCE MOL_ID: 1;
|
| 7 |
+
SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
|
| 8 |
+
SOURCE 3 ORGANISM_TAXID: 9606
|
| 9 |
+
REMARK 1
|
| 10 |
+
REMARK 1 REFERENCE 1
|
| 11 |
+
REMARK 1 AUTH JOHN JUMPER, RICHARD EVANS, ALEXANDER PRITZEL, TIM GREEN,
|
| 12 |
+
REMARK 1 AUTH 2 MICHAEL FIGURNOV, OLAF RONNEBERGER, KATHRYN TUNYASUVUNAKOOL,
|
| 13 |
+
REMARK 1 AUTH 3 RUSS BATES, AUGUSTIN ZIDEK, ANNA POTAPENKO, ALEX BRIDGLAND,
|
| 14 |
+
REMARK 1 AUTH 4 CLEMENS MEYER, SIMON A A KOHL, ANDREW J BALLARD,
|
| 15 |
+
REMARK 1 AUTH 5 ANDREW COWIE, BERNARDINO ROMERA-PAREDES, STANISLAV NIKOLOV,
|
| 16 |
+
REMARK 1 AUTH 6 RISHUB JAIN, JONAS ADLER, TREVOR BACK, STIG PETERSEN,
|
| 17 |
+
REMARK 1 AUTH 7 DAVID REIMAN, ELLEN CLANCY, MICHAL ZIELINSKI,
|
| 18 |
+
REMARK 1 AUTH 8 MARTIN STEINEGGER, MICHALINA PACHOLSKA, TAMAS BERGHAMMER,
|
| 19 |
+
REMARK 1 AUTH 9 DAVID SILVER, ORIOL VINYALS, ANDREW W SENIOR,
|
| 20 |
+
REMARK 1 AUTH10 KORAY KAVUKCUOGLU, PUSHMEET KOHLI, DEMIS HASSABIS
|
| 21 |
+
REMARK 1 TITL HIGHLY ACCURATE PROTEIN STRUCTURE PREDICTION WITH ALPHAFOLD
|
| 22 |
+
REMARK 1 REF NATURE V. 596 583 2021
|
| 23 |
+
REMARK 1 REFN ISSN 0028-0836
|
| 24 |
+
REMARK 1 PMID 34265844
|
| 25 |
+
REMARK 1 DOI 10.1038/s41586-021-03819-2
|
| 26 |
+
REMARK 1
|
| 27 |
+
REMARK 1 DISCLAIMERS
|
| 28 |
+
REMARK 1 ALPHAFOLD DATA, COPYRIGHT (2021) DEEPMIND TECHNOLOGIES LIMITED. THE
|
| 29 |
+
REMARK 1 INFORMATION PROVIDED IS THEORETICAL MODELLING ONLY AND CAUTION SHOULD
|
| 30 |
+
REMARK 1 BE EXERCISED IN ITS USE. IT IS PROVIDED "AS-IS" WITHOUT ANY WARRANTY
|
| 31 |
+
REMARK 1 OF ANY KIND, WHETHER EXPRESSED OR IMPLIED. NO WARRANTY IS GIVEN THAT
|
| 32 |
+
REMARK 1 USE OF THE INFORMATION SHALL NOT INFRINGE THE RIGHTS OF ANY THIRD
|
| 33 |
+
REMARK 1 PARTY. THE INFORMATION IS NOT INTENDED TO BE A SUBSTITUTE FOR
|
| 34 |
+
REMARK 1 PROFESSIONAL MEDICAL ADVICE, DIAGNOSIS, OR TREATMENT, AND DOES NOT
|
| 35 |
+
REMARK 1 CONSTITUTE MEDICAL OR OTHER PROFESSIONAL ADVICE. IT IS AVAILABLE FOR
|
| 36 |
+
REMARK 1 ACADEMIC AND COMMERCIAL PURPOSES, UNDER CC-BY 4.0 LICENCE.
|
| 37 |
+
DBREF XXXX A 1 135 UNP A0A087WUS8 A0A087WUS8_HUMAN 1 135
|
| 38 |
+
SEQRES 1 A 135 MET ALA ALA GLN CYS VAL THR LYS VAL ALA LEU ASN VAL
|
| 39 |
+
SEQRES 2 A 135 SER CYS ALA ASN LEU LEU ASP LYS ASP ILE GLY SER LYS
|
| 40 |
+
SEQRES 3 A 135 SER ASP PRO LEU CYS VAL LEU PHE LEU ASN THR SER GLY
|
| 41 |
+
SEQRES 4 A 135 GLN GLN TRP TYR GLU VAL GLU ARG THR GLU ARG ILE LYS
|
| 42 |
+
SEQRES 5 A 135 ASN CYS LEU ASN PRO GLN PHE SER LYS THR PHE ILE ILE
|
| 43 |
+
SEQRES 6 A 135 ASP TYR TYR PHE GLU VAL VAL GLN LYS LEU LYS PHE GLY
|
| 44 |
+
SEQRES 7 A 135 VAL TYR ASP ILE ASP ASN LYS THR ILE GLU LEU SER ASP
|
| 45 |
+
SEQRES 8 A 135 ASP ASP PHE LEU GLY GLU CYS GLU CYS THR LEU GLY GLN
|
| 46 |
+
SEQRES 9 A 135 ILE VAL SER SER LYS LYS LEU THR ARG PRO LEU VAL MET
|
| 47 |
+
SEQRES 10 A 135 LYS THR GLY ARG PRO ALA GLY LYS GLY SER ILE THR ILE
|
| 48 |
+
SEQRES 11 A 135 SER ALA GLU GLU ILE
|
| 49 |
+
CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1
|
| 50 |
+
ORIGX1 1.000000 0.000000 0.000000 0.00000
|
| 51 |
+
ORIGX2 0.000000 1.000000 0.000000 0.00000
|
| 52 |
+
ORIGX3 0.000000 0.000000 1.000000 0.00000
|
| 53 |
+
SCALE1 1.000000 0.000000 0.000000 0.00000
|
| 54 |
+
SCALE2 0.000000 1.000000 0.000000 0.00000
|
| 55 |
+
SCALE3 0.000000 0.000000 1.000000 0.00000
|
| 56 |
+
MODEL 1
|
| 57 |
+
ATOM 1 N MET A 1 -20.155 9.159 28.377 1.00 42.03 N
|
| 58 |
+
ATOM 2 CA MET A 1 -18.951 9.201 27.523 1.00 42.03 C
|
| 59 |
+
ATOM 3 C MET A 1 -18.858 7.848 26.853 1.00 42.03 C
|
| 60 |
+
ATOM 4 CB MET A 1 -17.698 9.506 28.363 1.00 42.03 C
|
| 61 |
+
ATOM 5 O MET A 1 -18.635 6.872 27.555 1.00 42.03 O
|
| 62 |
+
ATOM 6 CG MET A 1 -17.584 11.011 28.636 1.00 42.03 C
|
| 63 |
+
ATOM 7 SD MET A 1 -16.754 11.431 30.187 1.00 42.03 S
|
| 64 |
+
ATOM 8 CE MET A 1 -16.864 13.241 30.114 1.00 42.03 C
|
| 65 |
+
ATOM 9 N ALA A 2 -19.185 7.760 25.564 1.00 46.16 N
|
| 66 |
+
ATOM 10 CA ALA A 2 -19.028 6.508 24.832 1.00 46.16 C
|
| 67 |
+
ATOM 11 C ALA A 2 -17.529 6.197 24.772 1.00 46.16 C
|
| 68 |
+
ATOM 12 CB ALA A 2 -19.662 6.647 23.442 1.00 46.16 C
|
| 69 |
+
ATOM 13 O ALA A 2 -16.742 7.065 24.391 1.00 46.16 O
|
| 70 |
+
ATOM 14 N ALA A 3 -17.133 5.012 25.232 1.00 50.34 N
|
| 71 |
+
ATOM 15 CA ALA A 3 -15.782 4.527 25.026 1.00 50.34 C
|
| 72 |
+
ATOM 16 C ALA A 3 -15.610 4.357 23.515 1.00 50.34 C
|
| 73 |
+
ATOM 17 CB ALA A 3 -15.604 3.215 25.805 1.00 50.34 C
|
| 74 |
+
ATOM 18 O ALA A 3 -16.161 3.425 22.938 1.00 50.34 O
|
| 75 |
+
ATOM 19 N GLN A 4 -14.917 5.291 22.864 1.00 59.78 N
|
| 76 |
+
ATOM 20 CA GLN A 4 -14.480 5.076 21.493 1.00 59.78 C
|
| 77 |
+
ATOM 21 C GLN A 4 -13.516 3.892 21.538 1.00 59.78 C
|
| 78 |
+
ATOM 22 CB GLN A 4 -13.818 6.339 20.915 1.00 59.78 C
|
| 79 |
+
ATOM 23 O GLN A 4 -12.401 4.018 22.044 1.00 59.78 O
|
| 80 |
+
ATOM 24 CG GLN A 4 -14.858 7.371 20.451 1.00 59.78 C
|
| 81 |
+
ATOM 25 CD GLN A 4 -14.236 8.633 19.855 1.00 59.78 C
|
| 82 |
+
ATOM 26 NE2 GLN A 4 -15.032 9.502 19.273 1.00 59.78 N
|
| 83 |
+
ATOM 27 OE1 GLN A 4 -13.043 8.881 19.903 1.00 59.78 O
|
| 84 |
+
ATOM 28 N CYS A 5 -13.969 2.728 21.074 1.00 62.91 N
|
| 85 |
+
ATOM 29 CA CYS A 5 -13.097 1.596 20.793 1.00 62.91 C
|
| 86 |
+
ATOM 30 C CYS A 5 -12.204 1.997 19.620 1.00 62.91 C
|
| 87 |
+
ATOM 31 CB CYS A 5 -13.929 0.340 20.498 1.00 62.91 C
|
| 88 |
+
ATOM 32 O CYS A 5 -12.563 1.803 18.458 1.00 62.91 O
|
| 89 |
+
ATOM 33 SG CYS A 5 -14.727 -0.261 22.014 1.00 62.91 S
|
| 90 |
+
ATOM 34 N VAL A 6 -11.090 2.644 19.957 1.00 82.19 N
|
| 91 |
+
ATOM 35 CA VAL A 6 -10.040 3.023 19.026 1.00 82.19 C
|
| 92 |
+
ATOM 36 C VAL A 6 -8.936 1.979 19.113 1.00 82.19 C
|
| 93 |
+
ATOM 37 CB VAL A 6 -9.575 4.473 19.254 1.00 82.19 C
|
| 94 |
+
ATOM 38 O VAL A 6 -8.351 1.768 20.175 1.00 82.19 O
|
| 95 |
+
ATOM 39 CG1 VAL A 6 -8.842 4.731 20.577 1.00 82.19 C
|
| 96 |
+
ATOM 40 CG2 VAL A 6 -8.695 4.932 18.093 1.00 82.19 C
|
| 97 |
+
ATOM 41 N THR A 7 -8.680 1.302 18.001 1.00 88.19 N
|
| 98 |
+
ATOM 42 CA THR A 7 -7.559 0.365 17.872 1.00 88.19 C
|
| 99 |
+
ATOM 43 C THR A 7 -6.545 0.985 16.935 1.00 88.19 C
|
| 100 |
+
ATOM 44 CB THR A 7 -8.004 -1.005 17.345 1.00 88.19 C
|
| 101 |
+
ATOM 45 O THR A 7 -6.924 1.521 15.898 1.00 88.19 O
|
| 102 |
+
ATOM 46 CG2 THR A 7 -6.863 -2.019 17.344 1.00 88.19 C
|
| 103 |
+
ATOM 47 OG1 THR A 7 -9.010 -1.552 18.163 1.00 88.19 O
|
| 104 |
+
ATOM 48 N LYS A 8 -5.256 0.921 17.253 1.00 91.06 N
|
| 105 |
+
ATOM 49 CA LYS A 8 -4.236 1.365 16.306 1.00 91.06 C
|
| 106 |
+
ATOM 50 C LYS A 8 -3.902 0.235 15.355 1.00 91.06 C
|
| 107 |
+
ATOM 51 CB LYS A 8 -3.012 1.891 17.042 1.00 91.06 C
|
| 108 |
+
ATOM 52 O LYS A 8 -3.700 -0.902 15.768 1.00 91.06 O
|
| 109 |
+
ATOM 53 CG LYS A 8 -3.336 3.270 17.604 1.00 91.06 C
|
| 110 |
+
ATOM 54 CD LYS A 8 -2.100 3.902 18.229 1.00 91.06 C
|
| 111 |
+
ATOM 55 CE LYS A 8 -2.517 5.292 18.701 1.00 91.06 C
|
| 112 |
+
ATOM 56 NZ LYS A 8 -1.340 6.103 19.072 1.00 91.06 N
|
| 113 |
+
ATOM 57 N VAL A 9 -3.863 0.563 14.071 1.00 92.31 N
|
| 114 |
+
ATOM 58 CA VAL A 9 -3.578 -0.405 13.020 1.00 92.31 C
|
| 115 |
+
ATOM 59 C VAL A 9 -2.409 0.097 12.192 1.00 92.31 C
|
| 116 |
+
ATOM 60 CB VAL A 9 -4.821 -0.696 12.166 1.00 92.31 C
|
| 117 |
+
ATOM 61 O VAL A 9 -2.410 1.219 11.685 1.00 92.31 O
|
| 118 |
+
ATOM 62 CG1 VAL A 9 -4.547 -1.847 11.194 1.00 92.31 C
|
| 119 |
+
ATOM 63 CG2 VAL A 9 -6.028 -1.093 13.030 1.00 92.31 C
|
| 120 |
+
ATOM 64 N ALA A 10 -1.413 -0.762 12.065 1.00 93.69 N
|
| 121 |
+
ATOM 65 CA ALA A 10 -0.283 -0.658 11.171 1.00 93.69 C
|
| 122 |
+
ATOM 66 C ALA A 10 -0.666 -1.238 9.801 1.00 93.69 C
|
| 123 |
+
ATOM 67 CB ALA A 10 0.866 -1.425 11.839 1.00 93.69 C
|
| 124 |
+
ATOM 68 O ALA A 10 -1.014 -2.412 9.692 1.00 93.69 O
|
| 125 |
+
ATOM 69 N LEU A 11 -0.618 -0.422 8.748 1.00 93.31 N
|
| 126 |
+
ATOM 70 CA LEU A 11 -0.874 -0.843 7.374 1.00 93.31 C
|
| 127 |
+
ATOM 71 C LEU A 11 0.428 -0.925 6.581 1.00 93.31 C
|
| 128 |
+
ATOM 72 CB LEU A 11 -1.875 0.080 6.666 1.00 93.31 C
|
| 129 |
+
ATOM 73 O LEU A 11 1.093 0.088 6.361 1.00 93.31 O
|
| 130 |
+
ATOM 74 CG LEU A 11 -3.204 0.327 7.392 1.00 93.31 C
|
| 131 |
+
ATOM 75 CD1 LEU A 11 -4.050 1.268 6.537 1.00 93.31 C
|
| 132 |
+
ATOM 76 CD2 LEU A 11 -3.994 -0.965 7.579 1.00 93.31 C
|
| 133 |
+
ATOM 77 N ASN A 12 0.749 -2.111 6.082 1.00 94.44 N
|
| 134 |
+
ATOM 78 CA ASN A 12 1.860 -2.336 5.163 1.00 94.44 C
|
| 135 |
+
ATOM 79 C ASN A 12 1.341 -2.433 3.737 1.00 94.44 C
|
| 136 |
+
ATOM 80 CB ASN A 12 2.636 -3.591 5.570 1.00 94.44 C
|
| 137 |
+
ATOM 81 O ASN A 12 0.339 -3.098 3.475 1.00 94.44 O
|
| 138 |
+
ATOM 82 CG ASN A 12 3.432 -3.335 6.825 1.00 94.44 C
|
| 139 |
+
ATOM 83 ND2 ASN A 12 4.686 -2.981 6.683 1.00 94.44 N
|
| 140 |
+
ATOM 84 OD1 ASN A 12 2.915 -3.390 7.923 1.00 94.44 O
|
| 141 |
+
ATOM 85 N VAL A 13 2.048 -1.797 2.807 1.00 94.75 N
|
| 142 |
+
ATOM 86 CA VAL A 13 1.659 -1.752 1.399 1.00 94.75 C
|
| 143 |
+
ATOM 87 C VAL A 13 2.748 -2.375 0.540 1.00 94.75 C
|
| 144 |
+
ATOM 88 CB VAL A 13 1.308 -0.319 0.963 1.00 94.75 C
|
| 145 |
+
ATOM 89 O VAL A 13 3.941 -2.164 0.736 1.00 94.75 O
|
| 146 |
+
ATOM 90 CG1 VAL A 13 0.849 -0.282 -0.497 1.00 94.75 C
|
| 147 |
+
ATOM 91 CG2 VAL A 13 0.153 0.230 1.810 1.00 94.75 C
|
| 148 |
+
ATOM 92 N SER A 14 2.333 -3.147 -0.453 1.00 94.25 N
|
| 149 |
+
ATOM 93 CA SER A 14 3.206 -3.672 -1.499 1.00 94.25 C
|
| 150 |
+
ATOM 94 C SER A 14 2.466 -3.662 -2.825 1.00 94.25 C
|
| 151 |
+
ATOM 95 CB SER A 14 3.692 -5.079 -1.142 1.00 94.25 C
|
| 152 |
+
ATOM 96 O SER A 14 1.246 -3.813 -2.854 1.00 94.25 O
|
| 153 |
+
ATOM 97 OG SER A 14 2.600 -5.930 -0.842 1.00 94.25 O
|
| 154 |
+
ATOM 98 N CYS A 15 3.186 -3.486 -3.926 1.00 93.00 N
|
| 155 |
+
ATOM 99 CA CYS A 15 2.608 -3.594 -5.259 1.00 93.00 C
|
| 156 |
+
ATOM 100 C CYS A 15 3.290 -4.704 -6.053 1.00 93.00 C
|
| 157 |
+
ATOM 101 CB CYS A 15 2.626 -2.252 -6.000 1.00 93.00 C
|
| 158 |
+
ATOM 102 O CYS A 15 4.419 -5.097 -5.766 1.00 93.00 O
|
| 159 |
+
ATOM 103 SG CYS A 15 1.874 -0.934 -5.008 1.00 93.00 S
|
| 160 |
+
ATOM 104 N ALA A 16 2.590 -5.205 -7.063 1.00 91.88 N
|
| 161 |
+
ATOM 105 CA ALA A 16 3.104 -6.206 -7.979 1.00 91.88 C
|
| 162 |
+
ATOM 106 C ALA A 16 2.645 -5.922 -9.407 1.00 91.88 C
|
| 163 |
+
ATOM 107 CB ALA A 16 2.666 -7.596 -7.504 1.00 91.88 C
|
| 164 |
+
ATOM 108 O ALA A 16 1.505 -5.502 -9.623 1.00 91.88 O
|
| 165 |
+
ATOM 109 N ASN A 17 3.518 -6.223 -10.369 1.00 88.69 N
|
| 166 |
+
ATOM 110 CA ASN A 17 3.295 -6.076 -11.807 1.00 88.69 C
|
| 167 |
+
ATOM 111 C ASN A 17 2.850 -4.664 -12.213 1.00 88.69 C
|
| 168 |
+
ATOM 112 CB ASN A 17 2.331 -7.168 -12.298 1.00 88.69 C
|
| 169 |
+
ATOM 113 O ASN A 17 1.934 -4.520 -13.027 1.00 88.69 O
|
| 170 |
+
ATOM 114 CG ASN A 17 2.787 -8.565 -11.957 1.00 88.69 C
|
| 171 |
+
ATOM 115 ND2 ASN A 17 1.963 -9.329 -11.279 1.00 88.69 N
|
| 172 |
+
ATOM 116 OD1 ASN A 17 3.869 -9.000 -12.309 1.00 88.69 O
|
| 173 |
+
ATOM 117 N LEU A 18 3.462 -3.635 -11.618 1.00 85.81 N
|
| 174 |
+
ATOM 118 CA LEU A 18 3.180 -2.247 -11.973 1.00 85.81 C
|
| 175 |
+
ATOM 119 C LEU A 18 3.388 -2.002 -13.471 1.00 85.81 C
|
| 176 |
+
ATOM 120 CB LEU A 18 4.036 -1.296 -11.125 1.00 85.81 C
|
| 177 |
+
ATOM 121 O LEU A 18 4.176 -2.686 -14.127 1.00 85.81 O
|
| 178 |
+
ATOM 122 CG LEU A 18 3.666 -1.293 -9.633 1.00 85.81 C
|
| 179 |
+
ATOM 123 CD1 LEU A 18 4.567 -0.315 -8.902 1.00 85.81 C
|
| 180 |
+
ATOM 124 CD2 LEU A 18 2.221 -0.852 -9.399 1.00 85.81 C
|
| 181 |
+
ATOM 125 N LEU A 19 2.622 -1.051 -14.006 1.00 79.38 N
|
| 182 |
+
ATOM 126 CA LEU A 19 2.724 -0.658 -15.402 1.00 79.38 C
|
| 183 |
+
ATOM 127 C LEU A 19 4.097 -0.025 -15.632 1.00 79.38 C
|
| 184 |
+
ATOM 128 CB LEU A 19 1.585 0.324 -15.731 1.00 79.38 C
|
| 185 |
+
ATOM 129 O LEU A 19 4.397 0.994 -15.027 1.00 79.38 O
|
| 186 |
+
ATOM 130 CG LEU A 19 1.530 0.707 -17.222 1.00 79.38 C
|
| 187 |
+
ATOM 131 CD1 LEU A 19 0.926 -0.427 -18.058 1.00 79.38 C
|
| 188 |
+
ATOM 132 CD2 LEU A 19 0.652 1.943 -17.411 1.00 79.38 C
|
| 189 |
+
ATOM 133 N ASP A 20 4.889 -0.622 -16.511 1.00 72.56 N
|
| 190 |
+
ATOM 134 CA ASP A 20 6.148 -0.034 -16.949 1.00 72.56 C
|
| 191 |
+
ATOM 135 C ASP A 20 5.838 0.987 -18.045 1.00 72.56 C
|
| 192 |
+
ATOM 136 CB ASP A 20 7.084 -1.159 -17.419 1.00 72.56 C
|
| 193 |
+
ATOM 137 O ASP A 20 5.385 0.615 -19.136 1.00 72.56 O
|
| 194 |
+
ATOM 138 CG ASP A 20 8.560 -0.759 -17.423 1.00 72.56 C
|
| 195 |
+
ATOM 139 OD1 ASP A 20 8.844 0.407 -17.082 1.00 72.56 O
|
| 196 |
+
ATOM 140 OD2 ASP A 20 9.374 -1.690 -17.640 1.00 72.56 O
|
| 197 |
+
ATOM 141 N LYS A 21 5.959 2.275 -17.722 1.00 65.38 N
|
| 198 |
+
ATOM 142 CA LYS A 21 5.772 3.359 -18.695 1.00 65.38 C
|
| 199 |
+
ATOM 143 C LYS A 21 7.079 3.791 -19.355 1.00 65.38 C
|
| 200 |
+
ATOM 144 CB LYS A 21 5.066 4.547 -18.041 1.00 65.38 C
|
| 201 |
+
ATOM 145 O LYS A 21 7.033 4.437 -20.403 1.00 65.38 O
|
| 202 |
+
ATOM 146 CG LYS A 21 3.553 4.313 -17.905 1.00 65.38 C
|
| 203 |
+
ATOM 147 CD LYS A 21 2.936 5.668 -17.574 1.00 65.38 C
|
| 204 |
+
ATOM 148 CE LYS A 21 1.421 5.680 -17.430 1.00 65.38 C
|
| 205 |
+
ATOM 149 NZ LYS A 21 1.005 7.091 -17.288 1.00 65.38 N
|
| 206 |
+
ATOM 150 N ASP A 22 8.214 3.366 -18.813 1.00 61.00 N
|
| 207 |
+
ATOM 151 CA ASP A 22 9.528 3.750 -19.296 1.00 61.00 C
|
| 208 |
+
ATOM 152 C ASP A 22 9.997 2.860 -20.453 1.00 61.00 C
|
| 209 |
+
ATOM 153 CB ASP A 22 10.525 3.705 -18.137 1.00 61.00 C
|
| 210 |
+
ATOM 154 O ASP A 22 10.035 1.631 -20.387 1.00 61.00 O
|
| 211 |
+
ATOM 155 CG ASP A 22 10.513 4.928 -17.224 1.00 61.00 C
|
| 212 |
+
ATOM 156 OD1 ASP A 22 9.905 5.948 -17.611 1.00 61.00 O
|
| 213 |
+
ATOM 157 OD2 ASP A 22 11.259 4.840 -16.220 1.00 61.00 O
|
| 214 |
+
ATOM 158 N ILE A 23 10.437 3.489 -21.544 1.00 52.09 N
|
| 215 |
+
ATOM 159 CA ILE A 23 11.088 2.795 -22.661 1.00 52.09 C
|
| 216 |
+
ATOM 160 C ILE A 23 12.595 2.748 -22.365 1.00 52.09 C
|
| 217 |
+
ATOM 161 CB ILE A 23 10.710 3.425 -24.026 1.00 52.09 C
|
| 218 |
+
ATOM 162 O ILE A 23 13.372 3.526 -22.913 1.00 52.09 O
|
| 219 |
+
ATOM 163 CG1 ILE A 23 9.172 3.458 -24.217 1.00 52.09 C
|
| 220 |
+
ATOM 164 CG2 ILE A 23 11.354 2.630 -25.185 1.00 52.09 C
|
| 221 |
+
ATOM 165 CD1 ILE A 23 8.705 4.246 -25.448 1.00 52.09 C
|
| 222 |
+
ATOM 166 N GLY A 24 13.014 1.843 -21.473 1.00 55.34 N
|
| 223 |
+
ATOM 167 CA GLY A 24 14.435 1.537 -21.228 1.00 55.34 C
|
| 224 |
+
ATOM 168 C GLY A 24 14.912 1.587 -19.770 1.00 55.34 C
|
| 225 |
+
ATOM 169 O GLY A 24 16.020 1.122 -19.495 1.00 55.34 O
|
| 226 |
+
ATOM 170 N SER A 25 14.092 2.083 -18.845 1.00 66.25 N
|
| 227 |
+
ATOM 171 CA SER A 25 14.254 1.966 -17.385 1.00 66.25 C
|
| 228 |
+
ATOM 172 C SER A 25 13.032 1.279 -16.778 1.00 66.25 C
|
| 229 |
+
ATOM 173 CB SER A 25 14.530 3.329 -16.726 1.00 66.25 C
|
| 230 |
+
ATOM 174 O SER A 25 12.090 0.979 -17.496 1.00 66.25 O
|
| 231 |
+
ATOM 175 OG SER A 25 13.738 4.376 -17.243 1.00 66.25 O
|
| 232 |
+
ATOM 176 N LYS A 26 13.085 0.937 -15.488 1.00 73.38 N
|
| 233 |
+
ATOM 177 CA LYS A 26 11.906 0.474 -14.747 1.00 73.38 C
|
| 234 |
+
ATOM 178 C LYS A 26 11.367 1.639 -13.931 1.00 73.38 C
|
| 235 |
+
ATOM 179 CB LYS A 26 12.290 -0.660 -13.795 1.00 73.38 C
|
| 236 |
+
ATOM 180 O LYS A 26 12.167 2.402 -13.399 1.00 73.38 O
|
| 237 |
+
ATOM 181 CG LYS A 26 12.619 -1.989 -14.470 1.00 73.38 C
|
| 238 |
+
ATOM 182 CD LYS A 26 13.102 -2.942 -13.375 1.00 73.38 C
|
| 239 |
+
ATOM 183 CE LYS A 26 13.474 -4.304 -13.944 1.00 73.38 C
|
| 240 |
+
ATOM 184 NZ LYS A 26 13.982 -5.174 -12.858 1.00 73.38 N
|
| 241 |
+
ATOM 185 N SER A 27 10.062 1.636 -13.694 1.00 78.62 N
|
| 242 |
+
ATOM 186 CA SER A 27 9.411 2.573 -12.781 1.00 78.62 C
|
| 243 |
+
ATOM 187 C SER A 27 10.041 2.628 -11.383 1.00 78.62 C
|
| 244 |
+
ATOM 188 CB SER A 27 7.932 2.215 -12.653 1.00 78.62 C
|
| 245 |
+
ATOM 189 O SER A 27 10.489 1.614 -10.821 1.00 78.62 O
|
| 246 |
+
ATOM 190 OG SER A 27 7.306 2.331 -13.910 1.00 78.62 O
|
| 247 |
+
ATOM 191 N ASP A 28 9.977 3.821 -10.805 1.00 84.88 N
|
| 248 |
+
ATOM 192 CA ASP A 28 10.363 4.194 -9.456 1.00 84.88 C
|
| 249 |
+
ATOM 193 C ASP A 28 9.112 4.493 -8.597 1.00 84.88 C
|
| 250 |
+
ATOM 194 CB ASP A 28 11.290 5.410 -9.521 1.00 84.88 C
|
| 251 |
+
ATOM 195 O ASP A 28 8.834 5.648 -8.249 1.00 84.88 O
|
| 252 |
+
ATOM 196 CG ASP A 28 12.734 5.144 -9.941 1.00 84.88 C
|
| 253 |
+
ATOM 197 OD1 ASP A 28 13.117 4.021 -10.303 1.00 84.88 O
|
| 254 |
+
ATOM 198 OD2 ASP A 28 13.572 6.027 -9.660 1.00 84.88 O
|
| 255 |
+
ATOM 199 N PRO A 29 8.323 3.470 -8.233 1.00 88.50 N
|
| 256 |
+
ATOM 200 CA PRO A 29 7.037 3.668 -7.585 1.00 88.50 C
|
| 257 |
+
ATOM 201 C PRO A 29 7.136 4.233 -6.167 1.00 88.50 C
|
| 258 |
+
ATOM 202 CB PRO A 29 6.366 2.301 -7.583 1.00 88.50 C
|
| 259 |
+
ATOM 203 O PRO A 29 7.967 3.825 -5.347 1.00 88.50 O
|
| 260 |
+
ATOM 204 CG PRO A 29 7.568 1.365 -7.556 1.00 88.50 C
|
| 261 |
+
ATOM 205 CD PRO A 29 8.515 2.060 -8.511 1.00 88.50 C
|
| 262 |
+
ATOM 206 N LEU A 30 6.175 5.099 -5.861 1.00 90.75 N
|
| 263 |
+
ATOM 207 CA LEU A 30 5.871 5.641 -4.544 1.00 90.75 C
|
| 264 |
+
ATOM 208 C LEU A 30 4.366 5.515 -4.283 1.00 90.75 C
|
| 265 |
+
ATOM 209 CB LEU A 30 6.387 7.089 -4.507 1.00 90.75 C
|
| 266 |
+
ATOM 210 O LEU A 30 3.547 5.784 -5.161 1.00 90.75 O
|
| 267 |
+
ATOM 211 CG LEU A 30 6.110 7.829 -3.186 1.00 90.75 C
|
| 268 |
+
ATOM 212 CD1 LEU A 30 7.233 8.823 -2.893 1.00 90.75 C
|
| 269 |
+
ATOM 213 CD2 LEU A 30 4.803 8.623 -3.248 1.00 90.75 C
|
| 270 |
+
ATOM 214 N CYS A 31 3.988 5.113 -3.070 1.00 92.44 N
|
| 271 |
+
ATOM 215 CA CYS A 31 2.595 5.016 -2.655 1.00 92.44 C
|
| 272 |
+
ATOM 216 C CYS A 31 2.223 6.168 -1.715 1.00 92.44 C
|
| 273 |
+
ATOM 217 CB CYS A 31 2.351 3.632 -2.045 1.00 92.44 C
|
| 274 |
+
ATOM 218 O CYS A 31 2.909 6.452 -0.736 1.00 92.44 O
|
| 275 |
+
ATOM 219 SG CYS A 31 0.608 3.455 -1.559 1.00 92.44 S
|
| 276 |
+
ATOM 220 N VAL A 32 1.088 6.801 -1.984 1.00 92.81 N
|
| 277 |
+
ATOM 221 CA VAL A 32 0.487 7.851 -1.163 1.00 92.81 C
|
| 278 |
+
ATOM 222 C VAL A 32 -0.805 7.322 -0.566 1.00 92.81 C
|
| 279 |
+
ATOM 223 CB VAL A 32 0.224 9.125 -1.982 1.00 92.81 C
|
| 280 |
+
ATOM 224 O VAL A 32 -1.658 6.798 -1.286 1.00 92.81 O
|
| 281 |
+
ATOM 225 CG1 VAL A 32 -0.293 10.238 -1.067 1.00 92.81 C
|
| 282 |
+
ATOM 226 CG2 VAL A 32 1.488 9.612 -2.700 1.00 92.81 C
|
| 283 |
+
ATOM 227 N LEU A 33 -0.955 7.462 0.747 1.00 94.19 N
|
| 284 |
+
ATOM 228 CA LEU A 33 -2.179 7.121 1.448 1.00 94.19 C
|
| 285 |
+
ATOM 229 C LEU A 33 -3.040 8.371 1.644 1.00 94.19 C
|
| 286 |
+
ATOM 230 CB LEU A 33 -1.825 6.442 2.779 1.00 94.19 C
|
| 287 |
+
ATOM 231 O LEU A 33 -2.610 9.355 2.242 1.00 94.19 O
|
| 288 |
+
ATOM 232 CG LEU A 33 -3.054 6.234 3.674 1.00 94.19 C
|
| 289 |
+
ATOM 233 CD1 LEU A 33 -4.050 5.226 3.095 1.00 94.19 C
|
| 290 |
+
ATOM 234 CD2 LEU A 33 -2.620 5.791 5.061 1.00 94.19 C
|
| 291 |
+
ATOM 235 N PHE A 34 -4.297 8.275 1.233 1.00 93.75 N
|
| 292 |
+
ATOM 236 CA PHE A 34 -5.343 9.246 1.504 1.00 93.75 C
|
| 293 |
+
ATOM 237 C PHE A 34 -6.419 8.632 2.395 1.00 93.75 C
|
| 294 |
+
ATOM 238 CB PHE A 34 -5.950 9.752 0.194 1.00 93.75 C
|
| 295 |
+
ATOM 239 O PHE A 34 -6.786 7.467 2.231 1.00 93.75 O
|
| 296 |
+
ATOM 240 CG PHE A 34 -4.959 10.372 -0.765 1.00 93.75 C
|
| 297 |
+
ATOM 241 CD1 PHE A 34 -4.671 11.745 -0.680 1.00 93.75 C
|
| 298 |
+
ATOM 242 CD2 PHE A 34 -4.316 9.579 -1.735 1.00 93.75 C
|
| 299 |
+
ATOM 243 CE1 PHE A 34 -3.733 12.322 -1.552 1.00 93.75 C
|
| 300 |
+
ATOM 244 CE2 PHE A 34 -3.391 10.160 -2.619 1.00 93.75 C
|
| 301 |
+
ATOM 245 CZ PHE A 34 -3.096 11.531 -2.523 1.00 93.75 C
|
| 302 |
+
ATOM 246 N LEU A 35 -6.969 9.430 3.301 1.00 92.44 N
|
| 303 |
+
ATOM 247 CA LEU A 35 -8.054 9.037 4.193 1.00 92.44 C
|
| 304 |
+
ATOM 248 C LEU A 35 -9.243 9.974 3.997 1.00 92.44 C
|
| 305 |
+
ATOM 249 CB LEU A 35 -7.503 8.970 5.626 1.00 92.44 C
|
| 306 |
+
ATOM 250 O LEU A 35 -9.099 11.171 3.749 1.00 92.44 O
|
| 307 |
+
ATOM 251 CG LEU A 35 -8.476 8.713 6.792 1.00 92.44 C
|
| 308 |
+
ATOM 252 CD1 LEU A 35 -9.349 7.466 6.675 1.00 92.44 C
|
| 309 |
+
ATOM 253 CD2 LEU A 35 -7.653 8.519 8.069 1.00 92.44 C
|
| 310 |
+
ATOM 254 N ASN A 36 -10.437 9.401 4.070 1.00 91.62 N
|
| 311 |
+
ATOM 255 CA ASN A 36 -11.697 10.115 4.059 1.00 91.62 C
|
| 312 |
+
ATOM 256 C ASN A 36 -12.643 9.491 5.092 1.00 91.62 C
|
| 313 |
+
ATOM 257 CB ASN A 36 -12.246 10.117 2.629 1.00 91.62 C
|
| 314 |
+
ATOM 258 O ASN A 36 -13.186 8.402 4.898 1.00 91.62 O
|
| 315 |
+
ATOM 259 CG ASN A 36 -13.518 10.923 2.485 1.00 91.62 C
|
| 316 |
+
ATOM 260 ND2 ASN A 36 -13.949 11.144 1.264 1.00 91.62 N
|
| 317 |
+
ATOM 261 OD1 ASN A 36 -14.137 11.361 3.442 1.00 91.62 O
|
| 318 |
+
ATOM 262 N THR A 37 -12.820 10.204 6.200 1.00 82.50 N
|
| 319 |
+
ATOM 263 CA THR A 37 -13.623 9.768 7.352 1.00 82.50 C
|
| 320 |
+
ATOM 264 C THR A 37 -15.036 10.364 7.335 1.00 82.50 C
|
| 321 |
+
ATOM 265 CB THR A 37 -12.874 10.149 8.641 1.00 82.50 C
|
| 322 |
+
ATOM 266 O THR A 37 -15.971 9.745 7.830 1.00 82.50 O
|
| 323 |
+
ATOM 267 CG2 THR A 37 -13.479 9.549 9.899 1.00 82.50 C
|
| 324 |
+
ATOM 268 OG1 THR A 37 -11.547 9.673 8.575 1.00 82.50 O
|
| 325 |
+
ATOM 269 N SER A 38 -15.215 11.544 6.728 1.00 77.12 N
|
| 326 |
+
ATOM 270 CA SER A 38 -16.463 12.331 6.805 1.00 77.12 C
|
| 327 |
+
ATOM 271 C SER A 38 -17.169 12.514 5.455 1.00 77.12 C
|
| 328 |
+
ATOM 272 CB SER A 38 -16.203 13.691 7.465 1.00 77.12 C
|
| 329 |
+
ATOM 273 O SER A 38 -18.119 13.283 5.347 1.00 77.12 O
|
| 330 |
+
ATOM 274 OG SER A 38 -15.508 13.527 8.687 1.00 77.12 O
|
| 331 |
+
ATOM 275 N GLY A 39 -16.685 11.866 4.395 1.00 68.81 N
|
| 332 |
+
ATOM 276 CA GLY A 39 -17.244 11.911 3.041 1.00 68.81 C
|
| 333 |
+
ATOM 277 C GLY A 39 -16.985 13.202 2.255 1.00 68.81 C
|
| 334 |
+
ATOM 278 O GLY A 39 -17.169 13.198 1.043 1.00 68.81 O
|
| 335 |
+
ATOM 279 N GLN A 40 -16.538 14.283 2.899 1.00 73.88 N
|
| 336 |
+
ATOM 280 CA GLN A 40 -16.426 15.604 2.265 1.00 73.88 C
|
| 337 |
+
ATOM 281 C GLN A 40 -15.122 15.827 1.491 1.00 73.88 C
|
| 338 |
+
ATOM 282 CB GLN A 40 -16.616 16.698 3.325 1.00 73.88 C
|
| 339 |
+
ATOM 283 O GLN A 40 -15.137 16.519 0.478 1.00 73.88 O
|
| 340 |
+
ATOM 284 CG GLN A 40 -18.069 16.764 3.823 1.00 73.88 C
|
| 341 |
+
ATOM 285 CD GLN A 40 -18.317 17.936 4.767 1.00 73.88 C
|
| 342 |
+
ATOM 286 NE2 GLN A 40 -19.558 18.302 4.998 1.00 73.88 N
|
| 343 |
+
ATOM 287 OE1 GLN A 40 -17.417 18.540 5.323 1.00 73.88 O
|
| 344 |
+
ATOM 288 N GLN A 41 -14.001 15.255 1.939 1.00 84.75 N
|
| 345 |
+
ATOM 289 CA GLN A 41 -12.700 15.454 1.296 1.00 84.75 C
|
| 346 |
+
ATOM 290 C GLN A 41 -11.735 14.303 1.580 1.00 84.75 C
|
| 347 |
+
ATOM 291 CB GLN A 41 -12.093 16.808 1.709 1.00 84.75 C
|
| 348 |
+
ATOM 292 O GLN A 41 -11.763 13.702 2.655 1.00 84.75 O
|
| 349 |
+
ATOM 293 CG GLN A 41 -11.840 16.969 3.218 1.00 84.75 C
|
| 350 |
+
ATOM 294 CD GLN A 41 -11.354 18.369 3.587 1.00 84.75 C
|
| 351 |
+
ATOM 295 NE2 GLN A 41 -11.358 18.719 4.853 1.00 84.75 N
|
| 352 |
+
ATOM 296 OE1 GLN A 41 -10.966 19.176 2.763 1.00 84.75 O
|
| 353 |
+
ATOM 297 N TRP A 42 -10.873 14.022 0.606 1.00 89.25 N
|
| 354 |
+
ATOM 298 CA TRP A 42 -9.699 13.175 0.787 1.00 89.25 C
|
| 355 |
+
ATOM 299 C TRP A 42 -8.557 14.042 1.293 1.00 89.25 C
|
| 356 |
+
ATOM 300 CB TRP A 42 -9.322 12.518 -0.544 1.00 89.25 C
|
| 357 |
+
ATOM 301 O TRP A 42 -8.252 15.062 0.678 1.00 89.25 O
|
| 358 |
+
ATOM 302 CG TRP A 42 -10.333 11.547 -1.062 1.00 89.25 C
|
| 359 |
+
ATOM 303 CD1 TRP A 42 -11.288 11.803 -1.984 1.00 89.25 C
|
| 360 |
+
ATOM 304 CD2 TRP A 42 -10.506 10.153 -0.678 1.00 89.25 C
|
| 361 |
+
ATOM 305 CE2 TRP A 42 -11.593 9.612 -1.427 1.00 89.25 C
|
| 362 |
+
ATOM 306 CE3 TRP A 42 -9.857 9.296 0.237 1.00 89.25 C
|
| 363 |
+
ATOM 307 NE1 TRP A 42 -12.033 10.661 -2.206 1.00 89.25 N
|
| 364 |
+
ATOM 308 CH2 TRP A 42 -11.337 7.454 -0.376 1.00 89.25 C
|
| 365 |
+
ATOM 309 CZ2 TRP A 42 -12.003 8.279 -1.296 1.00 89.25 C
|
| 366 |
+
ATOM 310 CZ3 TRP A 42 -10.279 7.964 0.396 1.00 89.25 C
|
| 367 |
+
ATOM 311 N TYR A 43 -7.921 13.635 2.383 1.00 89.38 N
|
| 368 |
+
ATOM 312 CA TYR A 43 -6.687 14.259 2.842 1.00 89.38 C
|
| 369 |
+
ATOM 313 C TYR A 43 -5.551 13.252 2.773 1.00 89.38 C
|
| 370 |
+
ATOM 314 CB TYR A 43 -6.864 14.864 4.234 1.00 89.38 C
|
| 371 |
+
ATOM 315 O TYR A 43 -5.742 12.059 3.017 1.00 89.38 O
|
| 372 |
+
ATOM 316 CG TYR A 43 -7.201 13.870 5.325 1.00 89.38 C
|
| 373 |
+
ATOM 317 CD1 TYR A 43 -8.546 13.533 5.572 1.00 89.38 C
|
| 374 |
+
ATOM 318 CD2 TYR A 43 -6.175 13.311 6.111 1.00 89.38 C
|
| 375 |
+
ATOM 319 CE1 TYR A 43 -8.871 12.670 6.633 1.00 89.38 C
|
| 376 |
+
ATOM 320 CE2 TYR A 43 -6.497 12.460 7.184 1.00 89.38 C
|
| 377 |
+
ATOM 321 OH TYR A 43 -8.186 11.429 8.548 1.00 89.38 O
|
| 378 |
+
ATOM 322 CZ TYR A 43 -7.849 12.163 7.459 1.00 89.38 C
|
| 379 |
+
ATOM 323 N GLU A 44 -4.376 13.738 2.398 1.00 92.00 N
|
| 380 |
+
ATOM 324 CA GLU A 44 -3.161 12.940 2.411 1.00 92.00 C
|
| 381 |
+
ATOM 325 C GLU A 44 -2.760 12.667 3.860 1.00 92.00 C
|
| 382 |
+
ATOM 326 CB GLU A 44 -2.070 13.685 1.645 1.00 92.00 C
|
| 383 |
+
ATOM 327 O GLU A 44 -2.634 13.592 4.661 1.00 92.00 O
|
| 384 |
+
ATOM 328 CG GLU A 44 -0.844 12.798 1.463 1.00 92.00 C
|
| 385 |
+
ATOM 329 CD GLU A 44 0.234 13.546 0.689 1.00 92.00 C
|
| 386 |
+
ATOM 330 OE1 GLU A 44 1.327 13.769 1.247 1.00 92.00 O
|
| 387 |
+
ATOM 331 OE2 GLU A 44 0.027 13.891 -0.495 1.00 92.00 O
|
| 388 |
+
ATOM 332 N VAL A 45 -2.605 11.390 4.195 1.00 90.94 N
|
| 389 |
+
ATOM 333 CA VAL A 45 -2.141 10.958 5.514 1.00 90.94 C
|
| 390 |
+
ATOM 334 C VAL A 45 -0.623 10.951 5.520 1.00 90.94 C
|
| 391 |
+
ATOM 335 CB VAL A 45 -2.689 9.565 5.874 1.00 90.94 C
|
| 392 |
+
ATOM 336 O VAL A 45 0.003 11.623 6.333 1.00 90.94 O
|
| 393 |
+
ATOM 337 CG1 VAL A 45 -2.245 9.121 7.272 1.00 90.94 C
|
| 394 |
+
ATOM 338 CG2 VAL A 45 -4.217 9.540 5.843 1.00 90.94 C
|
| 395 |
+
ATOM 339 N GLU A 46 -0.036 10.173 4.613 1.00 91.88 N
|
| 396 |
+
ATOM 340 CA GLU A 46 1.405 9.983 4.535 1.00 91.88 C
|
| 397 |
+
ATOM 341 C GLU A 46 1.789 9.366 3.179 1.00 91.88 C
|
| 398 |
+
ATOM 342 CB GLU A 46 1.852 9.099 5.721 1.00 91.88 C
|
| 399 |
+
ATOM 343 O GLU A 46 0.945 8.870 2.424 1.00 91.88 O
|
| 400 |
+
ATOM 344 CG GLU A 46 3.338 9.238 6.071 1.00 91.88 C
|
| 401 |
+
ATOM 345 CD GLU A 46 3.733 8.499 7.358 1.00 91.88 C
|
| 402 |
+
ATOM 346 OE1 GLU A 46 3.180 7.413 7.634 1.00 91.88 O
|
| 403 |
+
ATOM 347 OE2 GLU A 46 4.721 8.933 8.004 1.00 91.88 O
|
| 404 |
+
ATOM 348 N ARG A 47 3.089 9.371 2.882 1.00 92.25 N
|
| 405 |
+
ATOM 349 CA ARG A 47 3.695 8.783 1.684 1.00 92.25 C
|
| 406 |
+
ATOM 350 C ARG A 47 4.728 7.732 2.079 1.00 92.25 C
|
| 407 |
+
ATOM 351 CB ARG A 47 4.340 9.884 0.826 1.00 92.25 C
|
| 408 |
+
ATOM 352 O ARG A 47 5.394 7.875 3.105 1.00 92.25 O
|
| 409 |
+
ATOM 353 CG ARG A 47 3.377 11.032 0.492 1.00 92.25 C
|
| 410 |
+
ATOM 354 CD ARG A 47 4.000 12.022 -0.496 1.00 92.25 C
|
| 411 |
+
ATOM 355 NE ARG A 47 3.104 13.164 -0.691 1.00 92.25 N
|
| 412 |
+
ATOM 356 NH1 ARG A 47 4.245 14.346 -2.282 1.00 92.25 N
|
| 413 |
+
ATOM 357 NH2 ARG A 47 2.264 15.075 -1.523 1.00 92.25 N
|
| 414 |
+
ATOM 358 CZ ARG A 47 3.215 14.192 -1.497 1.00 92.25 C
|
| 415 |
+
ATOM 359 N THR A 48 4.882 6.695 1.266 1.00 92.19 N
|
| 416 |
+
ATOM 360 CA THR A 48 5.979 5.729 1.399 1.00 92.19 C
|
| 417 |
+
ATOM 361 C THR A 48 7.276 6.286 0.824 1.00 92.19 C
|
| 418 |
+
ATOM 362 CB THR A 48 5.664 4.386 0.724 1.00 92.19 C
|
| 419 |
+
ATOM 363 O THR A 48 7.314 7.340 0.188 1.00 92.19 O
|
| 420 |
+
ATOM 364 CG2 THR A 48 4.363 3.773 1.227 1.00 92.19 C
|
| 421 |
+
ATOM 365 OG1 THR A 48 5.577 4.542 -0.675 1.00 92.19 O
|
| 422 |
+
ATOM 366 N GLU A 49 8.357 5.536 1.000 1.00 90.12 N
|
| 423 |
+
ATOM 367 CA GLU A 49 9.572 5.727 0.227 1.00 90.12 C
|
| 424 |
+
ATOM 368 C GLU A 49 9.350 5.448 -1.271 1.00 90.12 C
|
| 425 |
+
ATOM 369 CB GLU A 49 10.720 4.886 0.817 1.00 90.12 C
|
| 426 |
+
ATOM 370 O GLU A 49 8.469 4.675 -1.661 1.00 90.12 O
|
| 427 |
+
ATOM 371 CG GLU A 49 10.625 3.359 0.630 1.00 90.12 C
|
| 428 |
+
ATOM 372 CD GLU A 49 9.798 2.607 1.686 1.00 90.12 C
|
| 429 |
+
ATOM 373 OE1 GLU A 49 10.111 1.421 1.913 1.00 90.12 O
|
| 430 |
+
ATOM 374 OE2 GLU A 49 8.841 3.165 2.266 1.00 90.12 O
|
| 431 |
+
ATOM 375 N ARG A 50 10.190 6.069 -2.106 1.00 87.50 N
|
| 432 |
+
ATOM 376 CA ARG A 50 10.343 5.745 -3.531 1.00 87.50 C
|
| 433 |
+
ATOM 377 C ARG A 50 11.271 4.544 -3.662 1.00 87.50 C
|
| 434 |
+
ATOM 378 CB ARG A 50 10.888 6.977 -4.277 1.00 87.50 C
|
| 435 |
+
ATOM 379 O ARG A 50 12.413 4.600 -3.199 1.00 87.50 O
|
| 436 |
+
ATOM 380 CG ARG A 50 11.268 6.743 -5.757 1.00 87.50 C
|
| 437 |
+
ATOM 381 CD ARG A 50 11.887 8.034 -6.326 1.00 87.50 C
|
| 438 |
+
ATOM 382 NE ARG A 50 12.518 7.884 -7.660 1.00 87.50 N
|
| 439 |
+
ATOM 383 NH1 ARG A 50 12.735 10.115 -8.173 1.00 87.50 N
|
| 440 |
+
ATOM 384 NH2 ARG A 50 13.426 8.642 -9.634 1.00 87.50 N
|
| 441 |
+
ATOM 385 CZ ARG A 50 12.880 8.862 -8.480 1.00 87.50 C
|
| 442 |
+
ATOM 386 N ILE A 51 10.819 3.492 -4.336 1.00 88.12 N
|
| 443 |
+
ATOM 387 CA ILE A 51 11.653 2.318 -4.620 1.00 88.12 C
|
| 444 |
+
ATOM 388 C ILE A 51 12.130 2.400 -6.057 1.00 88.12 C
|
| 445 |
+
ATOM 389 CB ILE A 51 10.903 1.005 -4.334 1.00 88.12 C
|
| 446 |
+
ATOM 390 O ILE A 51 11.316 2.347 -6.964 1.00 88.12 O
|
| 447 |
+
ATOM 391 CG1 ILE A 51 10.420 1.030 -2.868 1.00 88.12 C
|
| 448 |
+
ATOM 392 CG2 ILE A 51 11.830 -0.195 -4.613 1.00 88.12 C
|
| 449 |
+
ATOM 393 CD1 ILE A 51 9.932 -0.305 -2.314 1.00 88.12 C
|
| 450 |
+
ATOM 394 N LYS A 52 13.443 2.509 -6.270 1.00 83.81 N
|
| 451 |
+
ATOM 395 CA LYS A 52 13.989 2.702 -7.615 1.00 83.81 C
|
| 452 |
+
ATOM 396 C LYS A 52 14.063 1.407 -8.425 1.00 83.81 C
|
| 453 |
+
ATOM 397 CB LYS A 52 15.334 3.434 -7.592 1.00 83.81 C
|
| 454 |
+
ATOM 398 O LYS A 52 14.467 0.372 -7.894 1.00 83.81 O
|
| 455 |
+
ATOM 399 CG LYS A 52 15.233 4.802 -6.907 1.00 83.81 C
|
| 456 |
+
ATOM 400 CD LYS A 52 16.521 5.598 -7.119 1.00 83.81 C
|
| 457 |
+
ATOM 401 CE LYS A 52 16.353 6.975 -6.479 1.00 83.81 C
|
| 458 |
+
ATOM 402 NZ LYS A 52 17.558 7.808 -6.683 1.00 83.81 N
|
| 459 |
+
ATOM 403 N ASN A 53 13.762 1.492 -9.716 1.00 81.50 N
|
| 460 |
+
ATOM 404 CA ASN A 53 13.813 0.444 -10.722 1.00 81.50 C
|
| 461 |
+
ATOM 405 C ASN A 53 13.109 -0.854 -10.290 1.00 81.50 C
|
| 462 |
+
ATOM 406 CB ASN A 53 15.262 0.248 -11.210 1.00 81.50 C
|
| 463 |
+
ATOM 407 O ASN A 53 13.658 -1.958 -10.423 1.00 81.50 O
|
| 464 |
+
ATOM 408 CG ASN A 53 15.709 1.347 -12.151 1.00 81.50 C
|
| 465 |
+
ATOM 409 ND2 ASN A 53 16.612 2.201 -11.744 1.00 81.50 N
|
| 466 |
+
ATOM 410 OD1 ASN A 53 15.304 1.412 -13.295 1.00 81.50 O
|
| 467 |
+
ATOM 411 N CYS A 54 11.891 -0.743 -9.756 1.00 83.75 N
|
| 468 |
+
ATOM 412 CA CYS A 54 11.175 -1.877 -9.183 1.00 83.75 C
|
| 469 |
+
ATOM 413 C CYS A 54 9.691 -1.898 -9.564 1.00 83.75 C
|
| 470 |
+
ATOM 414 CB CYS A 54 11.369 -1.866 -7.665 1.00 83.75 C
|
| 471 |
+
ATOM 415 O CYS A 54 8.895 -1.119 -9.065 1.00 83.75 O
|
| 472 |
+
ATOM 416 SG CYS A 54 10.848 -3.475 -7.000 1.00 83.75 S
|
| 473 |
+
ATOM 417 N LEU A 55 9.290 -2.888 -10.367 1.00 83.50 N
|
| 474 |
+
ATOM 418 CA LEU A 55 7.885 -3.110 -10.748 1.00 83.50 C
|
| 475 |
+
ATOM 419 C LEU A 55 7.069 -3.866 -9.681 1.00 83.50 C
|
| 476 |
+
ATOM 420 CB LEU A 55 7.843 -3.856 -12.094 1.00 83.50 C
|
| 477 |
+
ATOM 421 O LEU A 55 5.854 -4.019 -9.815 1.00 83.50 O
|
| 478 |
+
ATOM 422 CG LEU A 55 8.526 -3.125 -13.266 1.00 83.50 C
|
| 479 |
+
ATOM 423 CD1 LEU A 55 8.482 -4.019 -14.504 1.00 83.50 C
|
| 480 |
+
ATOM 424 CD2 LEU A 55 7.858 -1.791 -13.588 1.00 83.50 C
|
| 481 |
+
ATOM 425 N ASN A 56 7.735 -4.366 -8.636 1.00 89.88 N
|
| 482 |
+
ATOM 426 CA ASN A 56 7.121 -5.080 -7.514 1.00 89.88 C
|
| 483 |
+
ATOM 427 C ASN A 56 7.588 -4.476 -6.177 1.00 89.88 C
|
| 484 |
+
ATOM 428 CB ASN A 56 7.420 -6.588 -7.608 1.00 89.88 C
|
| 485 |
+
ATOM 429 O ASN A 56 8.277 -5.152 -5.406 1.00 89.88 O
|
| 486 |
+
ATOM 430 CG ASN A 56 7.031 -7.197 -8.937 1.00 89.88 C
|
| 487 |
+
ATOM 431 ND2 ASN A 56 7.991 -7.551 -9.759 1.00 89.88 N
|
| 488 |
+
ATOM 432 OD1 ASN A 56 5.872 -7.370 -9.265 1.00 89.88 O
|
| 489 |
+
ATOM 433 N PRO A 57 7.313 -3.185 -5.924 1.00 88.31 N
|
| 490 |
+
ATOM 434 CA PRO A 57 7.811 -2.510 -4.738 1.00 88.31 C
|
| 491 |
+
ATOM 435 C PRO A 57 7.201 -3.111 -3.471 1.00 88.31 C
|
| 492 |
+
ATOM 436 CB PRO A 57 7.429 -1.042 -4.915 1.00 88.31 C
|
| 493 |
+
ATOM 437 O PRO A 57 5.983 -3.273 -3.352 1.00 88.31 O
|
| 494 |
+
ATOM 438 CG PRO A 57 6.145 -1.139 -5.724 1.00 88.31 C
|
| 495 |
+
ATOM 439 CD PRO A 57 6.454 -2.287 -6.683 1.00 88.31 C
|
| 496 |
+
ATOM 440 N GLN A 58 8.057 -3.402 -2.498 1.00 91.88 N
|
| 497 |
+
ATOM 441 CA GLN A 58 7.651 -3.696 -1.129 1.00 91.88 C
|
| 498 |
+
ATOM 442 C GLN A 58 8.049 -2.512 -0.265 1.00 91.88 C
|
| 499 |
+
ATOM 443 CB GLN A 58 8.295 -4.998 -0.644 1.00 91.88 C
|
| 500 |
+
ATOM 444 O GLN A 58 9.236 -2.303 -0.018 1.00 91.88 O
|
| 501 |
+
ATOM 445 CG GLN A 58 7.722 -6.212 -1.382 1.00 91.88 C
|
| 502 |
+
ATOM 446 CD GLN A 58 8.238 -7.523 -0.801 1.00 91.88 C
|
| 503 |
+
ATOM 447 NE2 GLN A 58 7.409 -8.539 -0.706 1.00 91.88 N
|
| 504 |
+
ATOM 448 OE1 GLN A 58 9.385 -7.679 -0.425 1.00 91.88 O
|
| 505 |
+
ATOM 449 N PHE A 59 7.061 -1.724 0.150 1.00 92.56 N
|
| 506 |
+
ATOM 450 CA PHE A 59 7.309 -0.563 0.987 1.00 92.56 C
|
| 507 |
+
ATOM 451 C PHE A 59 7.544 -1.025 2.424 1.00 92.56 C
|
| 508 |
+
ATOM 452 CB PHE A 59 6.167 0.448 0.850 1.00 92.56 C
|
| 509 |
+
ATOM 453 O PHE A 59 6.748 -1.766 3.005 1.00 92.56 O
|
| 510 |
+
ATOM 454 CG PHE A 59 5.887 0.865 -0.586 1.00 92.56 C
|
| 511 |
+
ATOM 455 CD1 PHE A 59 6.775 1.723 -1.258 1.00 92.56 C
|
| 512 |
+
ATOM 456 CD2 PHE A 59 4.740 0.399 -1.257 1.00 92.56 C
|
| 513 |
+
ATOM 457 CE1 PHE A 59 6.508 2.125 -2.580 1.00 92.56 C
|
| 514 |
+
ATOM 458 CE2 PHE A 59 4.477 0.790 -2.581 1.00 92.56 C
|
| 515 |
+
ATOM 459 CZ PHE A 59 5.359 1.662 -3.242 1.00 92.56 C
|
| 516 |
+
ATOM 460 N SER A 60 8.666 -0.593 2.983 1.00 90.19 N
|
| 517 |
+
ATOM 461 CA SER A 60 9.043 -0.809 4.377 1.00 90.19 C
|
| 518 |
+
ATOM 462 C SER A 60 8.304 0.155 5.298 1.00 90.19 C
|
| 519 |
+
ATOM 463 CB SER A 60 10.551 -0.608 4.545 1.00 90.19 C
|
| 520 |
+
ATOM 464 O SER A 60 8.128 -0.133 6.480 1.00 90.19 O
|
| 521 |
+
ATOM 465 OG SER A 60 11.268 -1.453 3.668 1.00 90.19 O
|
| 522 |
+
ATOM 466 N LYS A 61 7.858 1.303 4.771 1.00 90.38 N
|
| 523 |
+
ATOM 467 CA LYS A 61 7.021 2.241 5.510 1.00 90.38 C
|
| 524 |
+
ATOM 468 C LYS A 61 5.654 1.625 5.820 1.00 90.38 C
|
| 525 |
+
ATOM 469 CB LYS A 61 6.905 3.542 4.707 1.00 90.38 C
|
| 526 |
+
ATOM 470 O LYS A 61 4.915 1.213 4.927 1.00 90.38 O
|
| 527 |
+
ATOM 471 CG LYS A 61 6.167 4.661 5.445 1.00 90.38 C
|
| 528 |
+
ATOM 472 CD LYS A 61 6.977 5.249 6.608 1.00 90.38 C
|
| 529 |
+
ATOM 473 CE LYS A 61 6.144 6.422 7.116 1.00 90.38 C
|
| 530 |
+
ATOM 474 NZ LYS A 61 6.781 7.214 8.187 1.00 90.38 N
|
| 531 |
+
ATOM 475 N THR A 62 5.313 1.640 7.103 1.00 92.19 N
|
| 532 |
+
ATOM 476 CA THR A 62 4.010 1.234 7.626 1.00 92.19 C
|
| 533 |
+
ATOM 477 C THR A 62 3.200 2.472 7.994 1.00 92.19 C
|
| 534 |
+
ATOM 478 CB THR A 62 4.195 0.347 8.860 1.00 92.19 C
|
| 535 |
+
ATOM 479 O THR A 62 3.703 3.346 8.701 1.00 92.19 O
|
| 536 |
+
ATOM 480 CG2 THR A 62 2.898 -0.280 9.330 1.00 92.19 C
|
| 537 |
+
ATOM 481 OG1 THR A 62 5.069 -0.727 8.605 1.00 92.19 O
|
| 538 |
+
ATOM 482 N PHE A 63 1.948 2.541 7.551 1.00 92.38 N
|
| 539 |
+
ATOM 483 CA PHE A 63 1.033 3.624 7.908 1.00 92.38 C
|
| 540 |
+
ATOM 484 C PHE A 63 0.320 3.300 9.216 1.00 92.38 C
|
| 541 |
+
ATOM 485 CB PHE A 63 0.005 3.833 6.797 1.00 92.38 C
|
| 542 |
+
ATOM 486 O PHE A 63 -0.330 2.264 9.313 1.00 92.38 O
|
| 543 |
+
ATOM 487 CG PHE A 63 0.604 4.110 5.441 1.00 92.38 C
|
| 544 |
+
ATOM 488 CD1 PHE A 63 1.125 5.385 5.193 1.00 92.38 C
|
| 545 |
+
ATOM 489 CD2 PHE A 63 0.646 3.122 4.439 1.00 92.38 C
|
| 546 |
+
ATOM 490 CE1 PHE A 63 1.618 5.710 3.921 1.00 92.38 C
|
| 547 |
+
ATOM 491 CE2 PHE A 63 1.153 3.446 3.168 1.00 92.38 C
|
| 548 |
+
ATOM 492 CZ PHE A 63 1.597 4.752 2.901 1.00 92.38 C
|
| 549 |
+
ATOM 493 N ILE A 64 0.405 4.178 10.211 1.00 92.44 N
|
| 550 |
+
ATOM 494 CA ILE A 64 -0.283 3.983 11.492 1.00 92.44 C
|
| 551 |
+
ATOM 495 C ILE A 64 -1.561 4.816 11.486 1.00 92.44 C
|
| 552 |
+
ATOM 496 CB ILE A 64 0.643 4.305 12.682 1.00 92.44 C
|
| 553 |
+
ATOM 497 O ILE A 64 -1.501 6.038 11.356 1.00 92.44 O
|
| 554 |
+
ATOM 498 CG1 ILE A 64 1.898 3.400 12.640 1.00 92.44 C
|
| 555 |
+
ATOM 499 CG2 ILE A 64 -0.130 4.116 14.002 1.00 92.44 C
|
| 556 |
+
ATOM 500 CD1 ILE A 64 2.960 3.756 13.686 1.00 92.44 C
|
| 557 |
+
ATOM 501 N ILE A 65 -2.711 4.159 11.625 1.00 90.44 N
|
| 558 |
+
ATOM 502 CA ILE A 65 -4.023 4.812 11.617 1.00 90.44 C
|
| 559 |
+
ATOM 503 C ILE A 65 -4.841 4.330 12.811 1.00 90.44 C
|
| 560 |
+
ATOM 504 CB ILE A 65 -4.777 4.569 10.289 1.00 90.44 C
|
| 561 |
+
ATOM 505 O ILE A 65 -4.873 3.139 13.124 1.00 90.44 O
|
| 562 |
+
ATOM 506 CG1 ILE A 65 -3.888 4.871 9.062 1.00 90.44 C
|
| 563 |
+
ATOM 507 CG2 ILE A 65 -6.068 5.413 10.233 1.00 90.44 C
|
| 564 |
+
ATOM 508 CD1 ILE A 65 -4.601 4.591 7.740 1.00 90.44 C
|
| 565 |
+
ATOM 509 N ASP A 66 -5.535 5.264 13.450 1.00 90.44 N
|
| 566 |
+
ATOM 510 CA ASP A 66 -6.542 4.970 14.462 1.00 90.44 C
|
| 567 |
+
ATOM 511 C ASP A 66 -7.804 4.408 13.788 1.00 90.44 C
|
| 568 |
+
ATOM 512 CB ASP A 66 -6.832 6.258 15.245 1.00 90.44 C
|
| 569 |
+
ATOM 513 O ASP A 66 -8.449 5.087 12.986 1.00 90.44 O
|
| 570 |
+
ATOM 514 CG ASP A 66 -5.621 6.751 16.047 1.00 90.44 C
|
| 571 |
+
ATOM 515 OD1 ASP A 66 -5.073 5.973 16.863 1.00 90.44 O
|
| 572 |
+
ATOM 516 OD2 ASP A 66 -5.224 7.918 15.840 1.00 90.44 O
|
| 573 |
+
ATOM 517 N TYR A 67 -8.148 3.157 14.082 1.00 88.88 N
|
| 574 |
+
ATOM 518 CA TYR A 67 -9.359 2.487 13.624 1.00 88.88 C
|
| 575 |
+
ATOM 519 C TYR A 67 -10.511 2.741 14.593 1.00 88.88 C
|
| 576 |
+
ATOM 520 CB TYR A 67 -9.113 0.981 13.454 1.00 88.88 C
|
| 577 |
+
ATOM 521 O TYR A 67 -10.465 2.333 15.753 1.00 88.88 O
|
| 578 |
+
ATOM 522 CG TYR A 67 -10.354 0.179 13.099 1.00 88.88 C
|
| 579 |
+
ATOM 523 CD1 TYR A 67 -10.770 -0.882 13.927 1.00 88.88 C
|
| 580 |
+
ATOM 524 CD2 TYR A 67 -11.108 0.507 11.956 1.00 88.88 C
|
| 581 |
+
ATOM 525 CE1 TYR A 67 -11.914 -1.632 13.597 1.00 88.88 C
|
| 582 |
+
ATOM 526 CE2 TYR A 67 -12.249 -0.242 11.617 1.00 88.88 C
|
| 583 |
+
ATOM 527 OH TYR A 67 -13.741 -2.051 12.096 1.00 88.88 O
|
| 584 |
+
ATOM 528 CZ TYR A 67 -12.648 -1.319 12.433 1.00 88.88 C
|
| 585 |
+
ATOM 529 N TYR A 68 -11.566 3.370 14.085 1.00 88.56 N
|
| 586 |
+
ATOM 530 CA TYR A 68 -12.805 3.637 14.799 1.00 88.56 C
|
| 587 |
+
ATOM 531 C TYR A 68 -13.897 2.708 14.269 1.00 88.56 C
|
| 588 |
+
ATOM 532 CB TYR A 68 -13.189 5.109 14.608 1.00 88.56 C
|
| 589 |
+
ATOM 533 O TYR A 68 -14.416 2.916 13.175 1.00 88.56 O
|
| 590 |
+
ATOM 534 CG TYR A 68 -12.174 6.105 15.128 1.00 88.56 C
|
| 591 |
+
ATOM 535 CD1 TYR A 68 -12.217 6.527 16.470 1.00 88.56 C
|
| 592 |
+
ATOM 536 CD2 TYR A 68 -11.181 6.605 14.265 1.00 88.56 C
|
| 593 |
+
ATOM 537 CE1 TYR A 68 -11.271 7.455 16.947 1.00 88.56 C
|
| 594 |
+
ATOM 538 CE2 TYR A 68 -10.236 7.532 14.735 1.00 88.56 C
|
| 595 |
+
ATOM 539 OH TYR A 68 -9.366 8.856 16.524 1.00 88.56 O
|
| 596 |
+
ATOM 540 CZ TYR A 68 -10.279 7.958 16.076 1.00 88.56 C
|
| 597 |
+
ATOM 541 N PHE A 69 -14.289 1.705 15.058 1.00 81.69 N
|
| 598 |
+
ATOM 542 CA PHE A 69 -15.313 0.723 14.666 1.00 81.69 C
|
| 599 |
+
ATOM 543 C PHE A 69 -16.641 1.364 14.210 1.00 81.69 C
|
| 600 |
+
ATOM 544 CB PHE A 69 -15.537 -0.237 15.849 1.00 81.69 C
|
| 601 |
+
ATOM 545 O PHE A 69 -17.276 0.883 13.274 1.00 81.69 O
|
| 602 |
+
ATOM 546 CG PHE A 69 -16.926 -0.849 15.910 1.00 81.69 C
|
| 603 |
+
ATOM 547 CD1 PHE A 69 -17.868 -0.349 16.829 1.00 81.69 C
|
| 604 |
+
ATOM 548 CD2 PHE A 69 -17.305 -1.857 15.004 1.00 81.69 C
|
| 605 |
+
ATOM 549 CE1 PHE A 69 -19.184 -0.839 16.833 1.00 81.69 C
|
| 606 |
+
ATOM 550 CE2 PHE A 69 -18.619 -2.358 15.017 1.00 81.69 C
|
| 607 |
+
ATOM 551 CZ PHE A 69 -19.560 -1.846 15.929 1.00 81.69 C
|
| 608 |
+
ATOM 552 N GLU A 70 -17.052 2.461 14.848 1.00 84.88 N
|
| 609 |
+
ATOM 553 CA GLU A 70 -18.323 3.138 14.557 1.00 84.88 C
|
| 610 |
+
ATOM 554 C GLU A 70 -18.260 4.040 13.312 1.00 84.88 C
|
| 611 |
+
ATOM 555 CB GLU A 70 -18.768 3.947 15.788 1.00 84.88 C
|
| 612 |
+
ATOM 556 O GLU A 70 -19.284 4.574 12.884 1.00 84.88 O
|
| 613 |
+
ATOM 557 CG GLU A 70 -18.944 3.072 17.037 1.00 84.88 C
|
| 614 |
+
ATOM 558 CD GLU A 70 -19.470 3.887 18.223 1.00 84.88 C
|
| 615 |
+
ATOM 559 OE1 GLU A 70 -20.665 3.726 18.561 1.00 84.88 O
|
| 616 |
+
ATOM 560 OE2 GLU A 70 -18.666 4.665 18.789 1.00 84.88 O
|
| 617 |
+
ATOM 561 N VAL A 71 -17.072 4.234 12.726 1.00 85.75 N
|
| 618 |
+
ATOM 562 CA VAL A 71 -16.848 5.197 11.646 1.00 85.75 C
|
| 619 |
+
ATOM 563 C VAL A 71 -16.332 4.502 10.394 1.00 85.75 C
|
| 620 |
+
ATOM 564 CB VAL A 71 -15.906 6.334 12.077 1.00 85.75 C
|
| 621 |
+
ATOM 565 O VAL A 71 -15.324 3.799 10.391 1.00 85.75 O
|
| 622 |
+
ATOM 566 CG1 VAL A 71 -15.876 7.426 11.006 1.00 85.75 C
|
| 623 |
+
ATOM 567 CG2 VAL A 71 -16.349 7.000 13.389 1.00 85.75 C
|
| 624 |
+
ATOM 568 N VAL A 72 -16.997 4.756 9.268 1.00 88.31 N
|
| 625 |
+
ATOM 569 CA VAL A 72 -16.555 4.248 7.967 1.00 88.31 C
|
| 626 |
+
ATOM 570 C VAL A 72 -15.375 5.079 7.464 1.00 88.31 C
|
| 627 |
+
ATOM 571 CB VAL A 72 -17.708 4.188 6.950 1.00 88.31 C
|
| 628 |
+
ATOM 572 O VAL A 72 -15.540 6.070 6.757 1.00 88.31 O
|
| 629 |
+
ATOM 573 CG1 VAL A 72 -17.239 3.568 5.624 1.00 88.31 C
|
| 630 |
+
ATOM 574 CG2 VAL A 72 -18.861 3.322 7.478 1.00 88.31 C
|
| 631 |
+
ATOM 575 N GLN A 73 -14.167 4.650 7.812 1.00 90.69 N
|
| 632 |
+
ATOM 576 CA GLN A 73 -12.923 5.245 7.327 1.00 90.69 C
|
| 633 |
+
ATOM 577 C GLN A 73 -12.570 4.693 5.945 1.00 90.69 C
|
| 634 |
+
ATOM 578 CB GLN A 73 -11.816 4.961 8.341 1.00 90.69 C
|
| 635 |
+
ATOM 579 O GLN A 73 -12.180 3.528 5.806 1.00 90.69 O
|
| 636 |
+
ATOM 580 CG GLN A 73 -12.038 5.749 9.634 1.00 90.69 C
|
| 637 |
+
ATOM 581 CD GLN A 73 -11.064 5.280 10.691 1.00 90.69 C
|
| 638 |
+
ATOM 582 NE2 GLN A 73 -9.888 5.855 10.757 1.00 90.69 N
|
| 639 |
+
ATOM 583 OE1 GLN A 73 -11.339 4.360 11.439 1.00 90.69 O
|
| 640 |
+
ATOM 584 N LYS A 74 -12.710 5.522 4.909 1.00 93.56 N
|
| 641 |
+
ATOM 585 CA LYS A 74 -12.290 5.176 3.548 1.00 93.56 C
|
| 642 |
+
ATOM 586 C LYS A 74 -10.820 5.515 3.353 1.00 93.56 C
|
| 643 |
+
ATOM 587 CB LYS A 74 -13.141 5.898 2.507 1.00 93.56 C
|
| 644 |
+
ATOM 588 O LYS A 74 -10.384 6.612 3.680 1.00 93.56 O
|
| 645 |
+
ATOM 589 CG LYS A 74 -14.628 5.541 2.589 1.00 93.56 C
|
| 646 |
+
ATOM 590 CD LYS A 74 -15.334 6.199 1.406 1.00 93.56 C
|
| 647 |
+
ATOM 591 CE LYS A 74 -16.800 5.783 1.334 1.00 93.56 C
|
| 648 |
+
ATOM 592 NZ LYS A 74 -17.353 6.195 0.024 1.00 93.56 N
|
| 649 |
+
ATOM 593 N LEU A 75 -10.078 4.583 2.782 1.00 94.06 N
|
| 650 |
+
ATOM 594 CA LEU A 75 -8.669 4.703 2.450 1.00 94.06 C
|
| 651 |
+
ATOM 595 C LEU A 75 -8.507 4.631 0.940 1.00 94.06 C
|
| 652 |
+
ATOM 596 CB LEU A 75 -7.868 3.585 3.127 1.00 94.06 C
|
| 653 |
+
ATOM 597 O LEU A 75 -9.128 3.809 0.262 1.00 94.06 O
|
| 654 |
+
ATOM 598 CG LEU A 75 -7.939 3.601 4.661 1.00 94.06 C
|
| 655 |
+
ATOM 599 CD1 LEU A 75 -7.334 2.305 5.177 1.00 94.06 C
|
| 656 |
+
ATOM 600 CD2 LEU A 75 -7.163 4.749 5.297 1.00 94.06 C
|
| 657 |
+
ATOM 601 N LYS A 76 -7.635 5.476 0.416 1.00 93.75 N
|
| 658 |
+
ATOM 602 CA LYS A 76 -7.275 5.482 -0.990 1.00 93.75 C
|
| 659 |
+
ATOM 603 C LYS A 76 -5.763 5.467 -1.105 1.00 93.75 C
|
| 660 |
+
ATOM 604 CB LYS A 76 -7.983 6.652 -1.674 1.00 93.75 C
|
| 661 |
+
ATOM 605 O LYS A 76 -5.087 6.334 -0.572 1.00 93.75 O
|
| 662 |
+
ATOM 606 CG LYS A 76 -7.551 6.826 -3.124 1.00 93.75 C
|
| 663 |
+
ATOM 607 CD LYS A 76 -8.387 7.922 -3.789 1.00 93.75 C
|
| 664 |
+
ATOM 608 CE LYS A 76 -7.895 7.988 -5.226 1.00 93.75 C
|
| 665 |
+
ATOM 609 NZ LYS A 76 -8.782 8.738 -6.136 1.00 93.75 N
|
| 666 |
+
ATOM 610 N PHE A 77 -5.249 4.467 -1.797 1.00 94.25 N
|
| 667 |
+
ATOM 611 CA PHE A 77 -3.829 4.291 -2.053 1.00 94.25 C
|
| 668 |
+
ATOM 612 C PHE A 77 -3.566 4.706 -3.493 1.00 94.25 C
|
| 669 |
+
ATOM 613 CB PHE A 77 -3.452 2.830 -1.798 1.00 94.25 C
|
| 670 |
+
ATOM 614 O PHE A 77 -4.095 4.072 -4.404 1.00 94.25 O
|
| 671 |
+
ATOM 615 CG PHE A 77 -3.657 2.386 -0.364 1.00 94.25 C
|
| 672 |
+
ATOM 616 CD1 PHE A 77 -2.603 2.500 0.561 1.00 94.25 C
|
| 673 |
+
ATOM 617 CD2 PHE A 77 -4.906 1.891 0.058 1.00 94.25 C
|
| 674 |
+
ATOM 618 CE1 PHE A 77 -2.792 2.109 1.897 1.00 94.25 C
|
| 675 |
+
ATOM 619 CE2 PHE A 77 -5.098 1.521 1.401 1.00 94.25 C
|
| 676 |
+
ATOM 620 CZ PHE A 77 -4.041 1.625 2.318 1.00 94.25 C
|
| 677 |
+
ATOM 621 N GLY A 78 -2.812 5.780 -3.700 1.00 92.69 N
|
| 678 |
+
ATOM 622 CA GLY A 78 -2.372 6.225 -5.020 1.00 92.69 C
|
| 679 |
+
ATOM 623 C GLY A 78 -0.916 5.840 -5.243 1.00 92.69 C
|
| 680 |
+
ATOM 624 O GLY A 78 -0.072 6.165 -4.417 1.00 92.69 O
|
| 681 |
+
ATOM 625 N VAL A 79 -0.623 5.154 -6.339 1.00 91.19 N
|
| 682 |
+
ATOM 626 CA VAL A 79 0.729 4.775 -6.748 1.00 91.19 C
|
| 683 |
+
ATOM 627 C VAL A 79 1.156 5.675 -7.900 1.00 91.19 C
|
| 684 |
+
ATOM 628 CB VAL A 79 0.834 3.286 -7.124 1.00 91.19 C
|
| 685 |
+
ATOM 629 O VAL A 79 0.458 5.786 -8.913 1.00 91.19 O
|
| 686 |
+
ATOM 630 CG1 VAL A 79 2.300 2.881 -7.325 1.00 91.19 C
|
| 687 |
+
ATOM 631 CG2 VAL A 79 0.252 2.378 -6.030 1.00 91.19 C
|
| 688 |
+
ATOM 632 N TYR A 80 2.308 6.304 -7.731 1.00 88.00 N
|
| 689 |
+
ATOM 633 CA TYR A 80 2.896 7.251 -8.668 1.00 88.00 C
|
| 690 |
+
ATOM 634 C TYR A 80 4.287 6.760 -9.043 1.00 88.00 C
|
| 691 |
+
ATOM 635 CB TYR A 80 2.937 8.647 -8.031 1.00 88.00 C
|
| 692 |
+
ATOM 636 O TYR A 80 5.015 6.269 -8.179 1.00 88.00 O
|
| 693 |
+
ATOM 637 CG TYR A 80 1.569 9.186 -7.648 1.00 88.00 C
|
| 694 |
+
ATOM 638 CD1 TYR A 80 0.904 10.084 -8.502 1.00 88.00 C
|
| 695 |
+
ATOM 639 CD2 TYR A 80 0.965 8.791 -6.437 1.00 88.00 C
|
| 696 |
+
ATOM 640 CE1 TYR A 80 -0.361 10.591 -8.145 1.00 88.00 C
|
| 697 |
+
ATOM 641 CE2 TYR A 80 -0.313 9.266 -6.092 1.00 88.00 C
|
| 698 |
+
ATOM 642 OH TYR A 80 -2.207 10.638 -6.610 1.00 88.00 O
|
| 699 |
+
ATOM 643 CZ TYR A 80 -0.979 10.164 -6.948 1.00 88.00 C
|
| 700 |
+
ATOM 644 N ASP A 81 4.623 6.854 -10.321 1.00 84.50 N
|
| 701 |
+
ATOM 645 CA ASP A 81 5.983 6.704 -10.809 1.00 84.50 C
|
| 702 |
+
ATOM 646 C ASP A 81 6.675 8.046 -10.645 1.00 84.50 C
|
| 703 |
+
ATOM 647 CB ASP A 81 5.984 6.296 -12.291 1.00 84.50 C
|
| 704 |
+
ATOM 648 O ASP A 81 6.198 9.047 -11.173 1.00 84.50 O
|
| 705 |
+
ATOM 649 CG ASP A 81 7.277 5.606 -12.703 1.00 84.50 C
|
| 706 |
+
ATOM 650 OD1 ASP A 81 8.204 5.547 -11.864 1.00 84.50 O
|
| 707 |
+
ATOM 651 OD2 ASP A 81 7.261 4.948 -13.765 1.00 84.50 O
|
| 708 |
+
ATOM 652 N ILE A 82 7.747 8.085 -9.863 1.00 78.94 N
|
| 709 |
+
ATOM 653 CA ILE A 82 8.540 9.302 -9.736 1.00 78.94 C
|
| 710 |
+
ATOM 654 C ILE A 82 9.710 9.145 -10.697 1.00 78.94 C
|
| 711 |
+
ATOM 655 CB ILE A 82 8.960 9.563 -8.278 1.00 78.94 C
|
| 712 |
+
ATOM 656 O ILE A 82 10.790 8.709 -10.313 1.00 78.94 O
|
| 713 |
+
ATOM 657 CG1 ILE A 82 7.819 9.419 -7.244 1.00 78.94 C
|
| 714 |
+
ATOM 658 CG2 ILE A 82 9.598 10.963 -8.177 1.00 78.94 C
|
| 715 |
+
ATOM 659 CD1 ILE A 82 6.641 10.385 -7.417 1.00 78.94 C
|
| 716 |
+
ATOM 660 N ASP A 83 9.502 9.470 -11.958 1.00 66.75 N
|
| 717 |
+
ATOM 661 CA ASP A 83 10.490 9.381 -13.030 1.00 66.75 C
|
| 718 |
+
ATOM 662 C ASP A 83 11.531 10.510 -12.925 1.00 66.75 C
|
| 719 |
+
ATOM 663 CB ASP A 83 9.740 9.355 -14.376 1.00 66.75 C
|
| 720 |
+
ATOM 664 O ASP A 83 12.732 10.310 -13.150 1.00 66.75 O
|
| 721 |
+
ATOM 665 CG ASP A 83 8.745 10.511 -14.565 1.00 66.75 C
|
| 722 |
+
ATOM 666 OD1 ASP A 83 7.860 10.675 -13.694 1.00 66.75 O
|
| 723 |
+
ATOM 667 OD2 ASP A 83 8.945 11.277 -15.531 1.00 66.75 O
|
| 724 |
+
ATOM 668 N ASN A 84 11.120 11.686 -12.446 1.00 55.84 N
|
| 725 |
+
ATOM 669 CA ASN A 84 11.975 12.865 -12.438 1.00 55.84 C
|
| 726 |
+
ATOM 670 C ASN A 84 12.785 13.048 -11.128 1.00 55.84 C
|
| 727 |
+
ATOM 671 CB ASN A 84 11.125 14.067 -12.887 1.00 55.84 C
|
| 728 |
+
ATOM 672 O ASN A 84 12.545 12.433 -10.081 1.00 55.84 O
|
| 729 |
+
ATOM 673 CG ASN A 84 11.900 15.074 -13.721 1.00 55.84 C
|
| 730 |
+
ATOM 674 ND2 ASN A 84 11.208 15.874 -14.496 1.00 55.84 N
|
| 731 |
+
ATOM 675 OD1 ASN A 84 13.127 15.150 -13.682 1.00 55.84 O
|
| 732 |
+
ATOM 676 N LYS A 85 13.820 13.901 -11.184 1.00 53.22 N
|
| 733 |
+
ATOM 677 CA LYS A 85 14.576 14.380 -10.003 1.00 53.22 C
|
| 734 |
+
ATOM 678 C LYS A 85 13.834 15.484 -9.237 1.00 53.22 C
|
| 735 |
+
ATOM 679 CB LYS A 85 15.966 14.887 -10.426 1.00 53.22 C
|
| 736 |
+
ATOM 680 O LYS A 85 14.311 15.916 -8.187 1.00 53.22 O
|
| 737 |
+
ATOM 681 CG LYS A 85 16.965 13.758 -10.703 1.00 53.22 C
|
| 738 |
+
ATOM 682 CD LYS A 85 18.324 14.366 -11.072 1.00 53.22 C
|
| 739 |
+
ATOM 683 CE LYS A 85 19.349 13.263 -11.344 1.00 53.22 C
|
| 740 |
+
ATOM 684 NZ LYS A 85 20.650 13.839 -11.764 1.00 53.22 N
|
| 741 |
+
ATOM 685 N THR A 86 12.728 15.978 -9.781 1.00 46.16 N
|
| 742 |
+
ATOM 686 CA THR A 86 11.884 17.026 -9.204 1.00 46.16 C
|
| 743 |
+
ATOM 687 C THR A 86 10.837 16.437 -8.257 1.00 46.16 C
|
| 744 |
+
ATOM 688 CB THR A 86 11.257 17.880 -10.321 1.00 46.16 C
|
| 745 |
+
ATOM 689 O THR A 86 10.521 15.257 -8.311 1.00 46.16 O
|
| 746 |
+
ATOM 690 CG2 THR A 86 12.304 18.838 -10.894 1.00 46.16 C
|
| 747 |
+
ATOM 691 OG1 THR A 86 10.842 17.070 -11.392 1.00 46.16 O
|
| 748 |
+
ATOM 692 N ILE A 87 10.354 17.259 -7.323 1.00 50.56 N
|
| 749 |
+
ATOM 693 CA ILE A 87 9.471 16.867 -6.204 1.00 50.56 C
|
| 750 |
+
ATOM 694 C ILE A 87 7.978 17.070 -6.572 1.00 50.56 C
|
| 751 |
+
ATOM 695 CB ILE A 87 9.932 17.646 -4.932 1.00 50.56 C
|
| 752 |
+
ATOM 696 O ILE A 87 7.085 16.866 -5.750 1.00 50.56 O
|
| 753 |
+
ATOM 697 CG1 ILE A 87 11.405 17.314 -4.565 1.00 50.56 C
|
| 754 |
+
ATOM 698 CG2 ILE A 87 9.059 17.392 -3.686 1.00 50.56 C
|
| 755 |
+
ATOM 699 CD1 ILE A 87 12.077 18.366 -3.668 1.00 50.56 C
|
| 756 |
+
ATOM 700 N GLU A 88 7.688 17.524 -7.795 1.00 46.72 N
|
| 757 |
+
ATOM 701 CA GLU A 88 6.355 17.969 -8.207 1.00 46.72 C
|
| 758 |
+
ATOM 702 C GLU A 88 5.525 16.846 -8.852 1.00 46.72 C
|
| 759 |
+
ATOM 703 CB GLU A 88 6.450 19.202 -9.126 1.00 46.72 C
|
| 760 |
+
ATOM 704 O GLU A 88 5.766 16.461 -9.990 1.00 46.72 O
|
| 761 |
+
ATOM 705 CG GLU A 88 7.054 20.416 -8.403 1.00 46.72 C
|
| 762 |
+
ATOM 706 CD GLU A 88 6.833 21.717 -9.187 1.00 46.72 C
|
| 763 |
+
ATOM 707 OE1 GLU A 88 5.789 22.364 -8.938 1.00 46.72 O
|
| 764 |
+
ATOM 708 OE2 GLU A 88 7.730 22.074 -9.981 1.00 46.72 O
|
| 765 |
+
ATOM 709 N LEU A 89 4.451 16.450 -8.157 1.00 53.91 N
|
| 766 |
+
ATOM 710 CA LEU A 89 3.420 15.463 -8.546 1.00 53.91 C
|
| 767 |
+
ATOM 711 C LEU A 89 2.656 15.751 -9.857 1.00 53.91 C
|
| 768 |
+
ATOM 712 CB LEU A 89 2.418 15.367 -7.379 1.00 53.91 C
|
| 769 |
+
ATOM 713 O LEU A 89 1.719 15.024 -10.191 1.00 53.91 O
|
| 770 |
+
ATOM 714 CG LEU A 89 2.948 14.657 -6.123 1.00 53.91 C
|
| 771 |
+
ATOM 715 CD1 LEU A 89 2.074 15.078 -4.939 1.00 53.91 C
|
| 772 |
+
ATOM 716 CD2 LEU A 89 2.872 13.134 -6.245 1.00 53.91 C
|
| 773 |
+
ATOM 717 N SER A 90 2.976 16.844 -10.549 1.00 50.50 N
|
| 774 |
+
ATOM 718 CA SER A 90 2.273 17.300 -11.755 1.00 50.50 C
|
| 775 |
+
ATOM 719 C SER A 90 2.831 16.683 -13.041 1.00 50.50 C
|
| 776 |
+
ATOM 720 CB SER A 90 2.333 18.826 -11.852 1.00 50.50 C
|
| 777 |
+
ATOM 721 O SER A 90 2.073 16.553 -14.000 1.00 50.50 O
|
| 778 |
+
ATOM 722 OG SER A 90 1.712 19.435 -10.728 1.00 50.50 O
|
| 779 |
+
ATOM 723 N ASP A 91 4.111 16.297 -13.042 1.00 49.09 N
|
| 780 |
+
ATOM 724 CA ASP A 91 4.766 15.550 -14.130 1.00 49.09 C
|
| 781 |
+
ATOM 725 C ASP A 91 4.890 14.048 -13.818 1.00 49.09 C
|
| 782 |
+
ATOM 726 CB ASP A 91 6.147 16.164 -14.431 1.00 49.09 C
|
| 783 |
+
ATOM 727 O ASP A 91 5.115 13.263 -14.731 1.00 49.09 O
|
| 784 |
+
ATOM 728 CG ASP A 91 6.074 17.291 -15.467 1.00 49.09 C
|
| 785 |
+
ATOM 729 OD1 ASP A 91 5.795 16.996 -16.651 1.00 49.09 O
|
| 786 |
+
ATOM 730 OD2 ASP A 91 6.326 18.457 -15.083 1.00 49.09 O
|
| 787 |
+
ATOM 731 N ASP A 92 4.693 13.648 -12.555 1.00 64.38 N
|
| 788 |
+
ATOM 732 CA ASP A 92 4.843 12.258 -12.116 1.00 64.38 C
|
| 789 |
+
ATOM 733 C ASP A 92 3.779 11.336 -12.737 1.00 64.38 C
|
| 790 |
+
ATOM 734 CB ASP A 92 4.784 12.163 -10.583 1.00 64.38 C
|
| 791 |
+
ATOM 735 O ASP A 92 2.563 11.596 -12.717 1.00 64.38 O
|
| 792 |
+
ATOM 736 CG ASP A 92 5.952 12.820 -9.828 1.00 64.38 C
|
| 793 |
+
ATOM 737 OD1 ASP A 92 7.082 12.910 -10.353 1.00 64.38 O
|
| 794 |
+
ATOM 738 OD2 ASP A 92 5.709 13.192 -8.654 1.00 64.38 O
|
| 795 |
+
ATOM 739 N ASP A 93 4.236 10.199 -13.251 1.00 72.56 N
|
| 796 |
+
ATOM 740 CA ASP A 93 3.406 9.301 -14.032 1.00 72.56 C
|
| 797 |
+
ATOM 741 C ASP A 93 2.467 8.475 -13.137 1.00 72.56 C
|
| 798 |
+
ATOM 742 CB ASP A 93 4.291 8.454 -14.969 1.00 72.56 C
|
| 799 |
+
ATOM 743 O ASP A 93 2.864 7.611 -12.355 1.00 72.56 O
|
| 800 |
+
ATOM 744 CG ASP A 93 3.965 8.666 -16.447 1.00 72.56 C
|
| 801 |
+
ATOM 745 OD1 ASP A 93 2.778 8.973 -16.744 1.00 72.56 O
|
| 802 |
+
ATOM 746 OD2 ASP A 93 4.752 8.247 -17.314 1.00 72.56 O
|
| 803 |
+
ATOM 747 N PHE A 94 1.157 8.713 -13.235 1.00 84.31 N
|
| 804 |
+
ATOM 748 CA PHE A 94 0.187 7.974 -12.422 1.00 84.31 C
|
| 805 |
+
ATOM 749 C PHE A 94 0.142 6.489 -12.819 1.00 84.31 C
|
| 806 |
+
ATOM 750 CB PHE A 94 -1.192 8.627 -12.523 1.00 84.31 C
|
| 807 |
+
ATOM 751 O PHE A 94 -0.287 6.150 -13.929 1.00 84.31 O
|
| 808 |
+
ATOM 752 CG PHE A 94 -2.209 8.030 -11.573 1.00 84.31 C
|
| 809 |
+
ATOM 753 CD1 PHE A 94 -3.211 7.159 -12.040 1.00 84.31 C
|
| 810 |
+
ATOM 754 CD2 PHE A 94 -2.139 8.349 -10.206 1.00 84.31 C
|
| 811 |
+
ATOM 755 CE1 PHE A 94 -4.178 6.672 -11.144 1.00 84.31 C
|
| 812 |
+
ATOM 756 CE2 PHE A 94 -3.105 7.866 -9.313 1.00 84.31 C
|
| 813 |
+
ATOM 757 CZ PHE A 94 -4.137 7.053 -9.797 1.00 84.31 C
|
| 814 |
+
ATOM 758 N LEU A 95 0.527 5.606 -11.890 1.00 85.25 N
|
| 815 |
+
ATOM 759 CA LEU A 95 0.554 4.155 -12.097 1.00 85.25 C
|
| 816 |
+
ATOM 760 C LEU A 95 -0.763 3.488 -11.719 1.00 85.25 C
|
| 817 |
+
ATOM 761 CB LEU A 95 1.720 3.527 -11.313 1.00 85.25 C
|
| 818 |
+
ATOM 762 O LEU A 95 -1.089 2.443 -12.272 1.00 85.25 O
|
| 819 |
+
ATOM 763 CG LEU A 95 3.110 3.938 -11.822 1.00 85.25 C
|
| 820 |
+
ATOM 764 CD1 LEU A 95 4.185 3.273 -10.961 1.00 85.25 C
|
| 821 |
+
ATOM 765 CD2 LEU A 95 3.323 3.521 -13.277 1.00 85.25 C
|
| 822 |
+
ATOM 766 N GLY A 96 -1.538 4.079 -10.811 1.00 90.38 N
|
| 823 |
+
ATOM 767 CA GLY A 96 -2.873 3.601 -10.468 1.00 90.38 C
|
| 824 |
+
ATOM 768 C GLY A 96 -3.273 3.914 -9.033 1.00 90.38 C
|
| 825 |
+
ATOM 769 O GLY A 96 -2.457 4.302 -8.209 1.00 90.38 O
|
| 826 |
+
ATOM 770 N GLU A 97 -4.543 3.710 -8.712 1.00 92.88 N
|
| 827 |
+
ATOM 771 CA GLU A 97 -5.089 3.838 -7.366 1.00 92.88 C
|
| 828 |
+
ATOM 772 C GLU A 97 -5.919 2.623 -6.961 1.00 92.88 C
|
| 829 |
+
ATOM 773 CB GLU A 97 -5.894 5.141 -7.190 1.00 92.88 C
|
| 830 |
+
ATOM 774 O GLU A 97 -6.382 1.842 -7.793 1.00 92.88 O
|
| 831 |
+
ATOM 775 CG GLU A 97 -7.031 5.332 -8.219 1.00 92.88 C
|
| 832 |
+
ATOM 776 CD GLU A 97 -7.682 6.719 -8.139 1.00 92.88 C
|
| 833 |
+
ATOM 777 OE1 GLU A 97 -8.925 6.831 -8.186 1.00 92.88 O
|
| 834 |
+
ATOM 778 OE2 GLU A 97 -6.979 7.734 -7.934 1.00 92.88 O
|
| 835 |
+
ATOM 779 N CYS A 98 -6.122 2.485 -5.656 1.00 93.12 N
|
| 836 |
+
ATOM 780 CA CYS A 98 -7.069 1.561 -5.056 1.00 93.12 C
|
| 837 |
+
ATOM 781 C CYS A 98 -7.827 2.266 -3.932 1.00 93.12 C
|
| 838 |
+
ATOM 782 CB CYS A 98 -6.294 0.345 -4.544 1.00 93.12 C
|
| 839 |
+
ATOM 783 O CYS A 98 -7.213 2.848 -3.040 1.00 93.12 O
|
| 840 |
+
ATOM 784 SG CYS A 98 -7.355 -0.750 -3.556 1.00 93.12 S
|
| 841 |
+
ATOM 785 N GLU A 99 -9.154 2.160 -3.935 1.00 92.81 N
|
| 842 |
+
ATOM 786 CA GLU A 99 -10.013 2.578 -2.825 1.00 92.81 C
|
| 843 |
+
ATOM 787 C GLU A 99 -10.481 1.347 -2.037 1.00 92.81 C
|
| 844 |
+
ATOM 788 CB GLU A 99 -11.186 3.429 -3.345 1.00 92.81 C
|
| 845 |
+
ATOM 789 O GLU A 99 -10.885 0.333 -2.610 1.00 92.81 O
|
| 846 |
+
ATOM 790 CG GLU A 99 -12.061 3.967 -2.196 1.00 92.81 C
|
| 847 |
+
ATOM 791 CD GLU A 99 -13.209 4.889 -2.650 1.00 92.81 C
|
| 848 |
+
ATOM 792 OE1 GLU A 99 -14.284 4.861 -1.993 1.00 92.81 O
|
| 849 |
+
ATOM 793 OE2 GLU A 99 -13.004 5.672 -3.603 1.00 92.81 O
|
| 850 |
+
ATOM 794 N CYS A 100 -10.426 1.426 -0.712 1.00 92.25 N
|
| 851 |
+
ATOM 795 CA CYS A 100 -10.951 0.410 0.198 1.00 92.25 C
|
| 852 |
+
ATOM 796 C CYS A 100 -11.311 1.044 1.545 1.00 92.25 C
|
| 853 |
+
ATOM 797 CB CYS A 100 -9.927 -0.726 0.334 1.00 92.25 C
|
| 854 |
+
ATOM 798 O CYS A 100 -10.993 2.201 1.792 1.00 92.25 O
|
| 855 |
+
ATOM 799 SG CYS A 100 -8.329 -0.102 0.910 1.00 92.25 S
|
| 856 |
+
ATOM 800 N THR A 101 -11.994 0.327 2.432 1.00 92.62 N
|
| 857 |
+
ATOM 801 CA THR A 101 -12.241 0.829 3.795 1.00 92.62 C
|
| 858 |
+
ATOM 802 C THR A 101 -11.269 0.210 4.787 1.00 92.62 C
|
| 859 |
+
ATOM 803 CB THR A 101 -13.693 0.639 4.239 1.00 92.62 C
|
| 860 |
+
ATOM 804 O THR A 101 -10.888 -0.952 4.644 1.00 92.62 O
|
| 861 |
+
ATOM 805 CG2 THR A 101 -14.684 1.257 3.253 1.00 92.62 C
|
| 862 |
+
ATOM 806 OG1 THR A 101 -14.020 -0.722 4.357 1.00 92.62 O
|
| 863 |
+
ATOM 807 N LEU A 102 -10.900 0.957 5.831 1.00 91.19 N
|
| 864 |
+
ATOM 808 CA LEU A 102 -10.041 0.439 6.899 1.00 91.19 C
|
| 865 |
+
ATOM 809 C LEU A 102 -10.649 -0.825 7.525 1.00 91.19 C
|
| 866 |
+
ATOM 810 CB LEU A 102 -9.801 1.553 7.932 1.00 91.19 C
|
| 867 |
+
ATOM 811 O LEU A 102 -9.954 -1.824 7.689 1.00 91.19 O
|
| 868 |
+
ATOM 812 CG LEU A 102 -8.873 1.171 9.104 1.00 91.19 C
|
| 869 |
+
ATOM 813 CD1 LEU A 102 -7.506 0.631 8.687 1.00 91.19 C
|
| 870 |
+
ATOM 814 CD2 LEU A 102 -8.619 2.418 9.948 1.00 91.19 C
|
| 871 |
+
ATOM 815 N GLY A 103 -11.969 -0.836 7.736 1.00 90.31 N
|
| 872 |
+
ATOM 816 CA GLY A 103 -12.690 -2.012 8.227 1.00 90.31 C
|
| 873 |
+
ATOM 817 C GLY A 103 -12.541 -3.254 7.335 1.00 90.31 C
|
| 874 |
+
ATOM 818 O GLY A 103 -12.413 -4.360 7.854 1.00 90.31 O
|
| 875 |
+
ATOM 819 N GLN A 104 -12.485 -3.105 6.004 1.00 91.62 N
|
| 876 |
+
ATOM 820 CA GLN A 104 -12.247 -4.241 5.099 1.00 91.62 C
|
| 877 |
+
ATOM 821 C GLN A 104 -10.842 -4.829 5.257 1.00 91.62 C
|
| 878 |
+
ATOM 822 CB GLN A 104 -12.444 -3.821 3.634 1.00 91.62 C
|
| 879 |
+
ATOM 823 O GLN A 104 -10.688 -6.054 5.234 1.00 91.62 O
|
| 880 |
+
ATOM 824 CG GLN A 104 -13.918 -3.788 3.226 1.00 91.62 C
|
| 881 |
+
ATOM 825 CD GLN A 104 -14.096 -3.309 1.788 1.00 91.62 C
|
| 882 |
+
ATOM 826 NE2 GLN A 104 -14.972 -3.936 1.033 1.00 91.62 N
|
| 883 |
+
ATOM 827 OE1 GLN A 104 -13.459 -2.389 1.297 1.00 91.62 O
|
| 884 |
+
ATOM 828 N ILE A 105 -9.829 -3.972 5.406 1.00 91.88 N
|
| 885 |
+
ATOM 829 CA ILE A 105 -8.435 -4.406 5.552 1.00 91.88 C
|
| 886 |
+
ATOM 830 C ILE A 105 -8.248 -5.085 6.909 1.00 91.88 C
|
| 887 |
+
ATOM 831 CB ILE A 105 -7.437 -3.240 5.395 1.00 91.88 C
|
| 888 |
+
ATOM 832 O ILE A 105 -7.728 -6.196 6.953 1.00 91.88 O
|
| 889 |
+
ATOM 833 CG1 ILE A 105 -7.696 -2.381 4.138 1.00 91.88 C
|
| 890 |
+
ATOM 834 CG2 ILE A 105 -6.006 -3.807 5.321 1.00 91.88 C
|
| 891 |
+
ATOM 835 CD1 ILE A 105 -6.884 -1.085 4.174 1.00 91.88 C
|
| 892 |
+
ATOM 836 N VAL A 106 -8.738 -4.468 7.989 1.00 90.19 N
|
| 893 |
+
ATOM 837 CA VAL A 106 -8.675 -5.022 9.352 1.00 90.19 C
|
| 894 |
+
ATOM 838 C VAL A 106 -9.403 -6.365 9.423 1.00 90.19 C
|
| 895 |
+
ATOM 839 CB VAL A 106 -9.252 -4.016 10.369 1.00 90.19 C
|
| 896 |
+
ATOM 840 O VAL A 106 -8.854 -7.339 9.929 1.00 90.19 O
|
| 897 |
+
ATOM 841 CG1 VAL A 106 -9.333 -4.591 11.788 1.00 90.19 C
|
| 898 |
+
ATOM 842 CG2 VAL A 106 -8.374 -2.762 10.445 1.00 90.19 C
|
| 899 |
+
ATOM 843 N SER A 107 -10.598 -6.467 8.830 1.00 89.62 N
|
| 900 |
+
ATOM 844 CA SER A 107 -11.363 -7.718 8.814 1.00 89.62 C
|
| 901 |
+
ATOM 845 C SER A 107 -10.676 -8.837 8.026 1.00 89.62 C
|
| 902 |
+
ATOM 846 CB SER A 107 -12.758 -7.462 8.240 1.00 89.62 C
|
| 903 |
+
ATOM 847 O SER A 107 -10.785 -9.999 8.413 1.00 89.62 O
|
| 904 |
+
ATOM 848 OG SER A 107 -13.520 -8.654 8.213 1.00 89.62 O
|
| 905 |
+
ATOM 849 N SER A 108 -9.985 -8.511 6.930 1.00 88.56 N
|
| 906 |
+
ATOM 850 CA SER A 108 -9.332 -9.513 6.073 1.00 88.56 C
|
| 907 |
+
ATOM 851 C SER A 108 -7.881 -9.794 6.476 1.00 88.56 C
|
| 908 |
+
ATOM 852 CB SER A 108 -9.389 -9.090 4.600 1.00 88.56 C
|
| 909 |
+
ATOM 853 O SER A 108 -7.293 -10.747 5.967 1.00 88.56 O
|
| 910 |
+
ATOM 854 OG SER A 108 -10.712 -8.763 4.215 1.00 88.56 O
|
| 911 |
+
ATOM 855 N LYS A 109 -7.279 -8.954 7.334 1.00 88.12 N
|
| 912 |
+
ATOM 856 CA LYS A 109 -5.835 -8.830 7.645 1.00 88.12 C
|
| 913 |
+
ATOM 857 C LYS A 109 -4.934 -8.526 6.447 1.00 88.12 C
|
| 914 |
+
ATOM 858 CB LYS A 109 -5.322 -10.063 8.401 1.00 88.12 C
|
| 915 |
+
ATOM 859 O LYS A 109 -3.891 -7.903 6.596 1.00 88.12 O
|
| 916 |
+
ATOM 860 CG LYS A 109 -6.092 -10.309 9.702 1.00 88.12 C
|
| 917 |
+
ATOM 861 CD LYS A 109 -5.467 -11.473 10.475 1.00 88.12 C
|
| 918 |
+
ATOM 862 CE LYS A 109 -6.226 -11.641 11.792 1.00 88.12 C
|
| 919 |
+
ATOM 863 NZ LYS A 109 -5.558 -12.612 12.690 1.00 88.12 N
|
| 920 |
+
ATOM 864 N LYS A 110 -5.317 -8.960 5.249 1.00 92.19 N
|
| 921 |
+
ATOM 865 CA LYS A 110 -4.629 -8.737 3.985 1.00 92.19 C
|
| 922 |
+
ATOM 866 C LYS A 110 -5.657 -8.565 2.873 1.00 92.19 C
|
| 923 |
+
ATOM 867 CB LYS A 110 -3.684 -9.917 3.740 1.00 92.19 C
|
| 924 |
+
ATOM 868 O LYS A 110 -6.520 -9.414 2.673 1.00 92.19 O
|
| 925 |
+
ATOM 869 CG LYS A 110 -2.783 -9.694 2.523 1.00 92.19 C
|
| 926 |
+
ATOM 870 CD LYS A 110 -1.823 -10.879 2.378 1.00 92.19 C
|
| 927 |
+
ATOM 871 CE LYS A 110 -0.892 -10.633 1.193 1.00 92.19 C
|
| 928 |
+
ATOM 872 NZ LYS A 110 0.101 -11.720 1.031 1.00 92.19 N
|
| 929 |
+
ATOM 873 N LEU A 111 -5.540 -7.474 2.133 1.00 93.31 N
|
| 930 |
+
ATOM 874 CA LEU A 111 -6.396 -7.110 1.020 1.00 93.31 C
|
| 931 |
+
ATOM 875 C LEU A 111 -5.535 -6.929 -0.231 1.00 93.31 C
|
| 932 |
+
ATOM 876 CB LEU A 111 -7.154 -5.824 1.401 1.00 93.31 C
|
| 933 |
+
ATOM 877 O LEU A 111 -4.669 -6.064 -0.260 1.00 93.31 O
|
| 934 |
+
ATOM 878 CG LEU A 111 -8.158 -5.375 0.328 1.00 93.31 C
|
| 935 |
+
ATOM 879 CD1 LEU A 111 -9.326 -6.358 0.199 1.00 93.31 C
|
| 936 |
+
ATOM 880 CD2 LEU A 111 -8.727 -4.001 0.666 1.00 93.31 C
|
| 937 |
+
ATOM 881 N THR A 112 -5.797 -7.710 -1.276 1.00 93.94 N
|
| 938 |
+
ATOM 882 CA THR A 112 -5.150 -7.544 -2.585 1.00 93.94 C
|
| 939 |
+
ATOM 883 C THR A 112 -6.187 -7.066 -3.593 1.00 93.94 C
|
| 940 |
+
ATOM 884 CB THR A 112 -4.449 -8.829 -3.050 1.00 93.94 C
|
| 941 |
+
ATOM 885 O THR A 112 -7.259 -7.660 -3.722 1.00 93.94 O
|
| 942 |
+
ATOM 886 CG2 THR A 112 -3.788 -8.678 -4.420 1.00 93.94 C
|
| 943 |
+
ATOM 887 OG1 THR A 112 -3.426 -9.195 -2.148 1.00 93.94 O
|
| 944 |
+
ATOM 888 N ARG A 113 -5.884 -5.980 -4.304 1.00 93.00 N
|
| 945 |
+
ATOM 889 CA ARG A 113 -6.768 -5.365 -5.299 1.00 93.00 C
|
| 946 |
+
ATOM 890 C ARG A 113 -5.990 -5.001 -6.563 1.00 93.00 C
|
| 947 |
+
ATOM 891 CB ARG A 113 -7.427 -4.109 -4.703 1.00 93.00 C
|
| 948 |
+
ATOM 892 O ARG A 113 -4.817 -4.641 -6.471 1.00 93.00 O
|
| 949 |
+
ATOM 893 CG ARG A 113 -8.471 -4.387 -3.609 1.00 93.00 C
|
| 950 |
+
ATOM 894 CD ARG A 113 -9.725 -5.081 -4.154 1.00 93.00 C
|
| 951 |
+
ATOM 895 NE ARG A 113 -10.777 -5.171 -3.125 1.00 93.00 N
|
| 952 |
+
ATOM 896 NH1 ARG A 113 -12.447 -6.000 -4.463 1.00 93.00 N
|
| 953 |
+
ATOM 897 NH2 ARG A 113 -12.844 -5.643 -2.295 1.00 93.00 N
|
| 954 |
+
ATOM 898 CZ ARG A 113 -12.013 -5.603 -3.298 1.00 93.00 C
|
| 955 |
+
ATOM 899 N PRO A 114 -6.614 -5.086 -7.748 1.00 92.88 N
|
| 956 |
+
ATOM 900 CA PRO A 114 -6.022 -4.530 -8.955 1.00 92.88 C
|
| 957 |
+
ATOM 901 C PRO A 114 -5.973 -3.003 -8.846 1.00 92.88 C
|
| 958 |
+
ATOM 902 CB PRO A 114 -6.915 -5.000 -10.101 1.00 92.88 C
|
| 959 |
+
ATOM 903 O PRO A 114 -6.890 -2.387 -8.301 1.00 92.88 O
|
| 960 |
+
ATOM 904 CG PRO A 114 -8.291 -5.113 -9.442 1.00 92.88 C
|
| 961 |
+
ATOM 905 CD PRO A 114 -7.971 -5.549 -8.012 1.00 92.88 C
|
| 962 |
+
ATOM 906 N LEU A 115 -4.914 -2.404 -9.379 1.00 91.00 N
|
| 963 |
+
ATOM 907 CA LEU A 115 -4.816 -0.957 -9.507 1.00 91.00 C
|
| 964 |
+
ATOM 908 C LEU A 115 -5.710 -0.483 -10.656 1.00 91.00 C
|
| 965 |
+
ATOM 909 CB LEU A 115 -3.347 -0.556 -9.711 1.00 91.00 C
|
| 966 |
+
ATOM 910 O LEU A 115 -5.801 -1.125 -11.708 1.00 91.00 O
|
| 967 |
+
ATOM 911 CG LEU A 115 -2.491 -0.668 -8.438 1.00 91.00 C
|
| 968 |
+
ATOM 912 CD1 LEU A 115 -1.018 -0.547 -8.808 1.00 91.00 C
|
| 969 |
+
ATOM 913 CD2 LEU A 115 -2.820 0.431 -7.426 1.00 91.00 C
|
| 970 |
+
ATOM 914 N VAL A 116 -6.363 0.656 -10.460 1.00 92.19 N
|
| 971 |
+
ATOM 915 CA VAL A 116 -7.187 1.307 -11.480 1.00 92.19 C
|
| 972 |
+
ATOM 916 C VAL A 116 -6.643 2.690 -11.802 1.00 92.19 C
|
| 973 |
+
ATOM 917 CB VAL A 116 -8.679 1.343 -11.098 1.00 92.19 C
|
| 974 |
+
ATOM 918 O VAL A 116 -6.115 3.389 -10.949 1.00 92.19 O
|
| 975 |
+
ATOM 919 CG1 VAL A 116 -9.252 -0.079 -11.039 1.00 92.19 C
|
| 976 |
+
ATOM 920 CG2 VAL A 116 -8.973 2.038 -9.765 1.00 92.19 C
|
| 977 |
+
ATOM 921 N MET A 117 -6.751 3.100 -13.057 1.00 87.19 N
|
| 978 |
+
ATOM 922 CA MET A 117 -6.426 4.455 -13.488 1.00 87.19 C
|
| 979 |
+
ATOM 923 C MET A 117 -7.522 5.432 -13.033 1.00 87.19 C
|
| 980 |
+
ATOM 924 CB MET A 117 -6.247 4.459 -15.014 1.00 87.19 C
|
| 981 |
+
ATOM 925 O MET A 117 -8.657 5.021 -12.797 1.00 87.19 O
|
| 982 |
+
ATOM 926 CG MET A 117 -4.980 3.702 -15.434 1.00 87.19 C
|
| 983 |
+
ATOM 927 SD MET A 117 -3.458 4.584 -14.999 1.00 87.19 S
|
| 984 |
+
ATOM 928 CE MET A 117 -2.183 3.380 -15.459 1.00 87.19 C
|
| 985 |
+
ATOM 929 N LYS A 118 -7.243 6.745 -13.030 1.00 81.19 N
|
| 986 |
+
ATOM 930 CA LYS A 118 -8.257 7.795 -12.759 1.00 81.19 C
|
| 987 |
+
ATOM 931 C LYS A 118 -9.488 7.715 -13.679 1.00 81.19 C
|
| 988 |
+
ATOM 932 CB LYS A 118 -7.626 9.194 -12.887 1.00 81.19 C
|
| 989 |
+
ATOM 933 O LYS A 118 -10.551 8.226 -13.354 1.00 81.19 O
|
| 990 |
+
ATOM 934 CG LYS A 118 -6.556 9.483 -11.823 1.00 81.19 C
|
| 991 |
+
ATOM 935 CD LYS A 118 -6.003 10.911 -11.959 1.00 81.19 C
|
| 992 |
+
ATOM 936 CE LYS A 118 -4.923 11.167 -10.899 1.00 81.19 C
|
| 993 |
+
ATOM 937 NZ LYS A 118 -4.253 12.484 -11.081 1.00 81.19 N
|
| 994 |
+
ATOM 938 N THR A 119 -9.346 7.070 -14.837 1.00 79.06 N
|
| 995 |
+
ATOM 939 CA THR A 119 -10.414 6.828 -15.818 1.00 79.06 C
|
| 996 |
+
ATOM 940 C THR A 119 -11.276 5.598 -15.502 1.00 79.06 C
|
| 997 |
+
ATOM 941 CB THR A 119 -9.809 6.692 -17.224 1.00 79.06 C
|
| 998 |
+
ATOM 942 O THR A 119 -12.164 5.266 -16.283 1.00 79.06 O
|
| 999 |
+
ATOM 943 CG2 THR A 119 -9.081 7.962 -17.667 1.00 79.06 C
|
| 1000 |
+
ATOM 944 OG1 THR A 119 -8.854 5.651 -17.251 1.00 79.06 O
|
| 1001 |
+
ATOM 945 N GLY A 120 -11.000 4.884 -14.404 1.00 77.56 N
|
| 1002 |
+
ATOM 946 CA GLY A 120 -11.685 3.646 -14.012 1.00 77.56 C
|
| 1003 |
+
ATOM 947 C GLY A 120 -11.245 2.400 -14.788 1.00 77.56 C
|
| 1004 |
+
ATOM 948 O GLY A 120 -11.751 1.307 -14.542 1.00 77.56 O
|
| 1005 |
+
ATOM 949 N ARG A 121 -10.301 2.532 -15.727 1.00 84.31 N
|
| 1006 |
+
ATOM 950 CA ARG A 121 -9.724 1.393 -16.456 1.00 84.31 C
|
| 1007 |
+
ATOM 951 C ARG A 121 -8.673 0.680 -15.600 1.00 84.31 C
|
| 1008 |
+
ATOM 952 CB ARG A 121 -9.129 1.853 -17.792 1.00 84.31 C
|
| 1009 |
+
ATOM 953 O ARG A 121 -7.990 1.348 -14.827 1.00 84.31 O
|
| 1010 |
+
ATOM 954 CG ARG A 121 -10.219 2.364 -18.741 1.00 84.31 C
|
| 1011 |
+
ATOM 955 CD ARG A 121 -9.608 2.729 -20.095 1.00 84.31 C
|
| 1012 |
+
ATOM 956 NE ARG A 121 -10.625 3.282 -21.006 1.00 84.31 N
|
| 1013 |
+
ATOM 957 NH1 ARG A 121 -9.223 3.741 -22.767 1.00 84.31 N
|
| 1014 |
+
ATOM 958 NH2 ARG A 121 -11.393 4.242 -22.922 1.00 84.31 N
|
| 1015 |
+
ATOM 959 CZ ARG A 121 -10.410 3.749 -22.224 1.00 84.31 C
|
| 1016 |
+
ATOM 960 N PRO A 122 -8.486 -0.641 -15.748 1.00 84.44 N
|
| 1017 |
+
ATOM 961 CA PRO A 122 -7.407 -1.347 -15.064 1.00 84.44 C
|
| 1018 |
+
ATOM 962 C PRO A 122 -6.041 -0.774 -15.466 1.00 84.44 C
|
| 1019 |
+
ATOM 963 CB PRO A 122 -7.568 -2.821 -15.451 1.00 84.44 C
|
| 1020 |
+
ATOM 964 O PRO A 122 -5.775 -0.544 -16.648 1.00 84.44 O
|
| 1021 |
+
ATOM 965 CG PRO A 122 -8.333 -2.774 -16.774 1.00 84.44 C
|
| 1022 |
+
ATOM 966 CD PRO A 122 -9.213 -1.534 -16.635 1.00 84.44 C
|
| 1023 |
+
ATOM 967 N ALA A 123 -5.177 -0.551 -14.478 1.00 83.88 N
|
| 1024 |
+
ATOM 968 CA ALA A 123 -3.814 -0.062 -14.650 1.00 83.88 C
|
| 1025 |
+
ATOM 969 C ALA A 123 -2.867 -1.185 -15.120 1.00 83.88 C
|
| 1026 |
+
ATOM 970 CB ALA A 123 -3.373 0.570 -13.334 1.00 83.88 C
|
| 1027 |
+
ATOM 971 O ALA A 123 -1.940 -1.604 -14.425 1.00 83.88 O
|
| 1028 |
+
ATOM 972 N GLY A 124 -3.147 -1.740 -16.300 1.00 83.69 N
|
| 1029 |
+
ATOM 973 CA GLY A 124 -2.422 -2.894 -16.826 1.00 83.69 C
|
| 1030 |
+
ATOM 974 C GLY A 124 -2.634 -4.143 -15.966 1.00 83.69 C
|
| 1031 |
+
ATOM 975 O GLY A 124 -3.769 -4.555 -15.733 1.00 83.69 O
|
| 1032 |
+
ATOM 976 N LYS A 125 -1.534 -4.762 -15.520 1.00 86.06 N
|
| 1033 |
+
ATOM 977 CA LYS A 125 -1.537 -5.932 -14.619 1.00 86.06 C
|
| 1034 |
+
ATOM 978 C LYS A 125 -1.189 -5.562 -13.171 1.00 86.06 C
|
| 1035 |
+
ATOM 979 CB LYS A 125 -0.613 -7.030 -15.170 1.00 86.06 C
|
| 1036 |
+
ATOM 980 O LYS A 125 -1.025 -6.460 -12.345 1.00 86.06 O
|
| 1037 |
+
ATOM 981 CG LYS A 125 -1.090 -7.566 -16.528 1.00 86.06 C
|
| 1038 |
+
ATOM 982 CD LYS A 125 -0.156 -8.676 -17.021 1.00 86.06 C
|
| 1039 |
+
ATOM 983 CE LYS A 125 -0.604 -9.167 -18.402 1.00 86.06 C
|
| 1040 |
+
ATOM 984 NZ LYS A 125 0.330 -10.187 -18.939 1.00 86.06 N
|
| 1041 |
+
ATOM 985 N GLY A 126 -1.095 -4.262 -12.883 1.00 89.69 N
|
| 1042 |
+
ATOM 986 CA GLY A 126 -0.726 -3.736 -11.579 1.00 89.69 C
|
| 1043 |
+
ATOM 987 C GLY A 126 -1.719 -4.148 -10.506 1.00 89.69 C
|
| 1044 |
+
ATOM 988 O GLY A 126 -2.935 -4.053 -10.677 1.00 89.69 O
|
| 1045 |
+
ATOM 989 N SER A 127 -1.195 -4.594 -9.374 1.00 93.56 N
|
| 1046 |
+
ATOM 990 CA SER A 127 -1.981 -4.899 -8.186 1.00 93.56 C
|
| 1047 |
+
ATOM 991 C SER A 127 -1.300 -4.337 -6.954 1.00 93.56 C
|
| 1048 |
+
ATOM 992 CB SER A 127 -2.233 -6.404 -8.062 1.00 93.56 C
|
| 1049 |
+
ATOM 993 O SER A 127 -0.077 -4.232 -6.898 1.00 93.56 O
|
| 1050 |
+
ATOM 994 OG SER A 127 -1.015 -7.116 -7.985 1.00 93.56 O
|
| 1051 |
+
ATOM 995 N ILE A 128 -2.110 -3.983 -5.969 1.00 93.88 N
|
| 1052 |
+
ATOM 996 CA ILE A 128 -1.684 -3.499 -4.666 1.00 93.88 C
|
| 1053 |
+
ATOM 997 C ILE A 128 -2.195 -4.458 -3.600 1.00 93.88 C
|
| 1054 |
+
ATOM 998 CB ILE A 128 -2.122 -2.040 -4.461 1.00 93.88 C
|
| 1055 |
+
ATOM 999 O ILE A 128 -3.324 -4.945 -3.650 1.00 93.88 O
|
| 1056 |
+
ATOM 1000 CG1 ILE A 128 -1.536 -1.469 -3.153 1.00 93.88 C
|
| 1057 |
+
ATOM 1001 CG2 ILE A 128 -3.650 -1.876 -4.533 1.00 93.88 C
|
| 1058 |
+
ATOM 1002 CD1 ILE A 128 -1.797 0.032 -2.996 1.00 93.88 C
|
| 1059 |
+
ATOM 1003 N THR A 129 -1.332 -4.762 -2.648 1.00 94.94 N
|
| 1060 |
+
ATOM 1004 CA THR A 129 -1.611 -5.603 -1.496 1.00 94.94 C
|
| 1061 |
+
ATOM 1005 C THR A 129 -1.368 -4.785 -0.242 1.00 94.94 C
|
| 1062 |
+
ATOM 1006 CB THR A 129 -0.735 -6.853 -1.521 1.00 94.94 C
|
| 1063 |
+
ATOM 1007 O THR A 129 -0.262 -4.290 -0.031 1.00 94.94 O
|
| 1064 |
+
ATOM 1008 CG2 THR A 129 -0.923 -7.729 -0.289 1.00 94.94 C
|
| 1065 |
+
ATOM 1009 OG1 THR A 129 -1.075 -7.652 -2.634 1.00 94.94 O
|
| 1066 |
+
ATOM 1010 N ILE A 130 -2.400 -4.673 0.585 1.00 94.88 N
|
| 1067 |
+
ATOM 1011 CA ILE A 130 -2.380 -3.962 1.854 1.00 94.88 C
|
| 1068 |
+
ATOM 1012 C ILE A 130 -2.610 -4.974 2.968 1.00 94.88 C
|
| 1069 |
+
ATOM 1013 CB ILE A 130 -3.424 -2.825 1.896 1.00 94.88 C
|
| 1070 |
+
ATOM 1014 O ILE A 130 -3.597 -5.706 2.929 1.00 94.88 O
|
| 1071 |
+
ATOM 1015 CG1 ILE A 130 -3.355 -1.882 0.670 1.00 94.88 C
|
| 1072 |
+
ATOM 1016 CG2 ILE A 130 -3.175 -2.009 3.177 1.00 94.88 C
|
| 1073 |
+
ATOM 1017 CD1 ILE A 130 -4.266 -2.297 -0.496 1.00 94.88 C
|
| 1074 |
+
ATOM 1018 N SER A 131 -1.728 -5.035 3.956 1.00 93.56 N
|
| 1075 |
+
ATOM 1019 CA SER A 131 -1.929 -5.836 5.165 1.00 93.56 C
|
| 1076 |
+
ATOM 1020 C SER A 131 -2.078 -4.947 6.385 1.00 93.56 C
|
| 1077 |
+
ATOM 1021 CB SER A 131 -0.828 -6.880 5.354 1.00 93.56 C
|
| 1078 |
+
ATOM 1022 O SER A 131 -1.394 -3.937 6.482 1.00 93.56 O
|
| 1079 |
+
ATOM 1023 OG SER A 131 0.457 -6.309 5.267 1.00 93.56 O
|
| 1080 |
+
ATOM 1024 N ALA A 132 -2.970 -5.333 7.290 1.00 92.88 N
|
| 1081 |
+
ATOM 1025 CA ALA A 132 -3.228 -4.668 8.555 1.00 92.88 C
|
| 1082 |
+
ATOM 1026 C ALA A 132 -2.718 -5.526 9.717 1.00 92.88 C
|
| 1083 |
+
ATOM 1027 CB ALA A 132 -4.732 -4.398 8.682 1.00 92.88 C
|
| 1084 |
+
ATOM 1028 O ALA A 132 -3.012 -6.722 9.783 1.00 92.88 O
|
| 1085 |
+
ATOM 1029 N GLU A 133 -2.012 -4.890 10.641 1.00 92.25 N
|
| 1086 |
+
ATOM 1030 CA GLU A 133 -1.567 -5.452 11.912 1.00 92.25 C
|
| 1087 |
+
ATOM 1031 C GLU A 133 -2.025 -4.532 13.049 1.00 92.25 C
|
| 1088 |
+
ATOM 1032 CB GLU A 133 -0.045 -5.648 11.862 1.00 92.25 C
|
| 1089 |
+
ATOM 1033 O GLU A 133 -1.892 -3.315 12.958 1.00 92.25 O
|
| 1090 |
+
ATOM 1034 CG GLU A 133 0.488 -6.413 13.083 1.00 92.25 C
|
| 1091 |
+
ATOM 1035 CD GLU A 133 1.964 -6.832 12.951 1.00 92.25 C
|
| 1092 |
+
ATOM 1036 OE1 GLU A 133 2.492 -7.394 13.936 1.00 92.25 O
|
| 1093 |
+
ATOM 1037 OE2 GLU A 133 2.547 -6.666 11.854 1.00 92.25 O
|
| 1094 |
+
ATOM 1038 N GLU A 134 -2.629 -5.090 14.093 1.00 88.62 N
|
| 1095 |
+
ATOM 1039 CA GLU A 134 -3.052 -4.323 15.272 1.00 88.62 C
|
| 1096 |
+
ATOM 1040 C GLU A 134 -1.841 -4.078 16.184 1.00 88.62 C
|
| 1097 |
+
ATOM 1041 CB GLU A 134 -4.182 -5.068 16.007 1.00 88.62 C
|
| 1098 |
+
ATOM 1042 O GLU A 134 -1.054 -5.001 16.404 1.00 88.62 O
|
| 1099 |
+
ATOM 1043 CG GLU A 134 -5.462 -5.178 15.161 1.00 88.62 C
|
| 1100 |
+
ATOM 1044 CD GLU A 134 -6.528 -6.057 15.835 1.00 88.62 C
|
| 1101 |
+
ATOM 1045 OE1 GLU A 134 -7.449 -5.488 16.466 1.00 88.62 O
|
| 1102 |
+
ATOM 1046 OE2 GLU A 134 -6.452 -7.299 15.663 1.00 88.62 O
|
| 1103 |
+
ATOM 1047 N ILE A 135 -1.696 -2.853 16.705 1.00 81.94 N
|
| 1104 |
+
ATOM 1048 CA ILE A 135 -0.586 -2.441 17.587 1.00 81.94 C
|
| 1105 |
+
ATOM 1049 C ILE A 135 -1.065 -1.900 18.933 1.00 81.94 C
|
| 1106 |
+
ATOM 1050 CB ILE A 135 0.390 -1.463 16.896 1.00 81.94 C
|
| 1107 |
+
ATOM 1051 O ILE A 135 -2.170 -1.309 18.990 1.00 81.94 O
|
| 1108 |
+
ATOM 1052 CG1 ILE A 135 -0.274 -0.109 16.582 1.00 81.94 C
|
| 1109 |
+
ATOM 1053 CG2 ILE A 135 0.998 -2.108 15.640 1.00 81.94 C
|
| 1110 |
+
ATOM 1054 CD1 ILE A 135 0.696 0.971 16.090 1.00 81.94 C
|
| 1111 |
+
ATOM 1055 OXT ILE A 135 -0.259 -2.027 19.878 1.00 81.94 O
|
| 1112 |
+
TER 1056 ILE A 135
|
| 1113 |
+
ENDMDL
|
| 1114 |
+
END
|
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|
| 1 |
+
HEADER 01-JUN-22
|
| 2 |
+
TITLE ALPHAFOLD MONOMER V2.0 PREDICTION FOR PTS SYSTEM LACTOSE-SPECIFIC
|
| 3 |
+
TITLE 2 EIIA COMPONENT (A0A0H2UNP1)
|
| 4 |
+
COMPND MOL_ID: 1;
|
| 5 |
+
COMPND 2 MOLECULE: PTS SYSTEM LACTOSE-SPECIFIC EIIA COMPONENT;
|
| 6 |
+
COMPND 3 CHAIN: A
|
| 7 |
+
SOURCE MOL_ID: 1;
|
| 8 |
+
SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PNEUMONIAE SEROTYPE 4 (STRAIN ATCC
|
| 9 |
+
SOURCE 3 BAA-334 / TIGR4);
|
| 10 |
+
SOURCE 4 ORGANISM_TAXID: 170187
|
| 11 |
+
REMARK 1
|
| 12 |
+
REMARK 1 REFERENCE 1
|
| 13 |
+
REMARK 1 AUTH JOHN JUMPER, RICHARD EVANS, ALEXANDER PRITZEL, TIM GREEN,
|
| 14 |
+
REMARK 1 AUTH 2 MICHAEL FIGURNOV, OLAF RONNEBERGER, KATHRYN TUNYASUVUNAKOOL,
|
| 15 |
+
REMARK 1 AUTH 3 RUSS BATES, AUGUSTIN ZIDEK, ANNA POTAPENKO, ALEX BRIDGLAND,
|
| 16 |
+
REMARK 1 AUTH 4 CLEMENS MEYER, SIMON A A KOHL, ANDREW J BALLARD,
|
| 17 |
+
REMARK 1 AUTH 5 ANDREW COWIE, BERNARDINO ROMERA-PAREDES, STANISLAV NIKOLOV,
|
| 18 |
+
REMARK 1 AUTH 6 RISHUB JAIN, JONAS ADLER, TREVOR BACK, STIG PETERSEN,
|
| 19 |
+
REMARK 1 AUTH 7 DAVID REIMAN, ELLEN CLANCY, MICHAL ZIELINSKI,
|
| 20 |
+
REMARK 1 AUTH 8 MARTIN STEINEGGER, MICHALINA PACHOLSKA, TAMAS BERGHAMMER,
|
| 21 |
+
REMARK 1 AUTH 9 DAVID SILVER, ORIOL VINYALS, ANDREW W SENIOR,
|
| 22 |
+
REMARK 1 AUTH10 KORAY KAVUKCUOGLU, PUSHMEET KOHLI, DEMIS HASSABIS
|
| 23 |
+
REMARK 1 TITL HIGHLY ACCURATE PROTEIN STRUCTURE PREDICTION WITH ALPHAFOLD
|
| 24 |
+
REMARK 1 REF NATURE V. 596 583 2021
|
| 25 |
+
REMARK 1 REFN ISSN 0028-0836
|
| 26 |
+
REMARK 1 PMID 34265844
|
| 27 |
+
REMARK 1 DOI 10.1038/s41586-021-03819-2
|
| 28 |
+
REMARK 1
|
| 29 |
+
REMARK 1 DISCLAIMERS
|
| 30 |
+
REMARK 1 ALPHAFOLD DATA, COPYRIGHT (2021) DEEPMIND TECHNOLOGIES LIMITED. THE
|
| 31 |
+
REMARK 1 INFORMATION PROVIDED IS THEORETICAL MODELLING ONLY AND CAUTION SHOULD
|
| 32 |
+
REMARK 1 BE EXERCISED IN ITS USE. IT IS PROVIDED "AS-IS" WITHOUT ANY WARRANTY
|
| 33 |
+
REMARK 1 OF ANY KIND, WHETHER EXPRESSED OR IMPLIED. NO WARRANTY IS GIVEN THAT
|
| 34 |
+
REMARK 1 USE OF THE INFORMATION SHALL NOT INFRINGE THE RIGHTS OF ANY THIRD
|
| 35 |
+
REMARK 1 PARTY. THE INFORMATION IS NOT INTENDED TO BE A SUBSTITUTE FOR
|
| 36 |
+
REMARK 1 PROFESSIONAL MEDICAL ADVICE, DIAGNOSIS, OR TREATMENT, AND DOES NOT
|
| 37 |
+
REMARK 1 CONSTITUTE MEDICAL OR OTHER PROFESSIONAL ADVICE. IT IS AVAILABLE FOR
|
| 38 |
+
REMARK 1 ACADEMIC AND COMMERCIAL PURPOSES, UNDER CC-BY 4.0 LICENCE.
|
| 39 |
+
DBREF XXXX A 1 114 UNP A0A0H2UNP1 A0A0H2UNP1_STRPN 1 114
|
| 40 |
+
SEQRES 1 A 114 MET LYS SER LYS GLU GLU ILE ASN MET LEU GLY PHE THR
|
| 41 |
+
SEQRES 2 A 114 ILE VAL ALA TYR ALA GLY ASP ALA ARG SER ASP LEU MET
|
| 42 |
+
SEQRES 3 A 114 ASP ALA LEU ALA PHE ALA ARG ASP GLY TYR PHE GLU GLN
|
| 43 |
+
SEQRES 4 A 114 ALA ARG GLU LEU VAL GLU SER ALA ASN ASP SER ILE VAL
|
| 44 |
+
SEQRES 5 A 114 SER ALA HIS ARG GLU GLN THR ASN LEU LEU ALA GLU GLU
|
| 45 |
+
SEQRES 6 A 114 ALA TYR GLY ASP ASN PHE GLU VAL SER PHE ILE MET ILE
|
| 46 |
+
SEQRES 7 A 114 HIS GLY GLN ASP THR LEU MET THR THR MET LEU LEU TYR
|
| 47 |
+
SEQRES 8 A 114 ASP GLN VAL LYS PHE PHE ILE ASP GLU TYR GLU ARG ILE
|
| 48 |
+
SEQRES 9 A 114 ARG LYS ILE GLU GLU HIS ILE GLY LEU GLN
|
| 49 |
+
CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1
|
| 50 |
+
ORIGX1 1.000000 0.000000 0.000000 0.00000
|
| 51 |
+
ORIGX2 0.000000 1.000000 0.000000 0.00000
|
| 52 |
+
ORIGX3 0.000000 0.000000 1.000000 0.00000
|
| 53 |
+
SCALE1 1.000000 0.000000 0.000000 0.00000
|
| 54 |
+
SCALE2 0.000000 1.000000 0.000000 0.00000
|
| 55 |
+
SCALE3 0.000000 0.000000 1.000000 0.00000
|
| 56 |
+
MODEL 1
|
| 57 |
+
ATOM 1 N MET A 1 13.963 -0.342 -25.654 1.00 74.25 N
|
| 58 |
+
ATOM 2 CA MET A 1 15.019 -0.758 -24.705 1.00 74.25 C
|
| 59 |
+
ATOM 3 C MET A 1 15.401 0.377 -23.760 1.00 74.25 C
|
| 60 |
+
ATOM 4 CB MET A 1 16.248 -1.370 -25.405 1.00 74.25 C
|
| 61 |
+
ATOM 5 O MET A 1 16.128 1.285 -24.155 1.00 74.25 O
|
| 62 |
+
ATOM 6 CG MET A 1 16.493 -2.767 -24.828 1.00 74.25 C
|
| 63 |
+
ATOM 7 SD MET A 1 17.944 -3.618 -25.506 1.00 74.25 S
|
| 64 |
+
ATOM 8 CE MET A 1 19.178 -3.129 -24.273 1.00 74.25 C
|
| 65 |
+
ATOM 9 N LYS A 2 14.879 0.328 -22.528 1.00 82.00 N
|
| 66 |
+
ATOM 10 CA LYS A 2 15.262 1.228 -21.428 1.00 82.00 C
|
| 67 |
+
ATOM 11 C LYS A 2 16.688 0.924 -20.954 1.00 82.00 C
|
| 68 |
+
ATOM 12 CB LYS A 2 14.273 1.084 -20.254 1.00 82.00 C
|
| 69 |
+
ATOM 13 O LYS A 2 17.110 -0.231 -20.922 1.00 82.00 O
|
| 70 |
+
ATOM 14 CG LYS A 2 12.858 1.602 -20.568 1.00 82.00 C
|
| 71 |
+
ATOM 15 CD LYS A 2 11.904 1.323 -19.394 1.00 82.00 C
|
| 72 |
+
ATOM 16 CE LYS A 2 10.441 1.587 -19.772 1.00 82.00 C
|
| 73 |
+
ATOM 17 NZ LYS A 2 9.962 2.961 -19.514 1.00 82.00 N
|
| 74 |
+
ATOM 18 N SER A 3 17.423 1.956 -20.572 1.00 91.75 N
|
| 75 |
+
ATOM 19 CA SER A 3 18.722 1.865 -19.911 1.00 91.75 C
|
| 76 |
+
ATOM 20 C SER A 3 18.585 1.423 -18.450 1.00 91.75 C
|
| 77 |
+
ATOM 21 CB SER A 3 19.442 3.216 -19.991 1.00 91.75 C
|
| 78 |
+
ATOM 22 O SER A 3 17.537 1.577 -17.821 1.00 91.75 O
|
| 79 |
+
ATOM 23 OG SER A 3 18.746 4.186 -19.238 1.00 91.75 O
|
| 80 |
+
ATOM 24 N LYS A 4 19.680 0.924 -17.868 1.00 90.75 N
|
| 81 |
+
ATOM 25 CA LYS A 4 19.748 0.577 -16.439 1.00 90.75 C
|
| 82 |
+
ATOM 26 C LYS A 4 19.388 1.753 -15.525 1.00 90.75 C
|
| 83 |
+
ATOM 27 CB LYS A 4 21.164 0.072 -16.143 1.00 90.75 C
|
| 84 |
+
ATOM 28 O LYS A 4 18.785 1.556 -14.474 1.00 90.75 O
|
| 85 |
+
ATOM 29 CG LYS A 4 21.303 -0.467 -14.713 1.00 90.75 C
|
| 86 |
+
ATOM 30 CD LYS A 4 22.734 -0.955 -14.496 1.00 90.75 C
|
| 87 |
+
ATOM 31 CE LYS A 4 22.834 -1.764 -13.204 1.00 90.75 C
|
| 88 |
+
ATOM 32 NZ LYS A 4 23.974 -2.702 -13.290 1.00 90.75 N
|
| 89 |
+
ATOM 33 N GLU A 5 19.759 2.970 -15.916 1.00 93.38 N
|
| 90 |
+
ATOM 34 CA GLU A 5 19.454 4.180 -15.152 1.00 93.38 C
|
| 91 |
+
ATOM 35 C GLU A 5 17.953 4.493 -15.177 1.00 93.38 C
|
| 92 |
+
ATOM 36 CB GLU A 5 20.334 5.323 -15.671 1.00 93.38 C
|
| 93 |
+
ATOM 37 O GLU A 5 17.371 4.744 -14.126 1.00 93.38 O
|
| 94 |
+
ATOM 38 CG GLU A 5 20.312 6.551 -14.746 1.00 93.38 C
|
| 95 |
+
ATOM 39 CD GLU A 5 21.525 7.480 -14.943 1.00 93.38 C
|
| 96 |
+
ATOM 40 OE1 GLU A 5 21.677 8.402 -14.112 1.00 93.38 O
|
| 97 |
+
ATOM 41 OE2 GLU A 5 22.324 7.240 -15.879 1.00 93.38 O
|
| 98 |
+
ATOM 42 N GLU A 6 17.290 4.343 -16.328 1.00 93.06 N
|
| 99 |
+
ATOM 43 CA GLU A 6 15.827 4.463 -16.430 1.00 93.06 C
|
| 100 |
+
ATOM 44 C GLU A 6 15.097 3.396 -15.600 1.00 93.06 C
|
| 101 |
+
ATOM 45 CB GLU A 6 15.392 4.367 -17.899 1.00 93.06 C
|
| 102 |
+
ATOM 46 O GLU A 6 14.130 3.716 -14.910 1.00 93.06 O
|
| 103 |
+
ATOM 47 CG GLU A 6 15.765 5.624 -18.700 1.00 93.06 C
|
| 104 |
+
ATOM 48 CD GLU A 6 15.655 5.374 -20.206 1.00 93.06 C
|
| 105 |
+
ATOM 49 OE1 GLU A 6 14.919 6.108 -20.894 1.00 93.06 O
|
| 106 |
+
ATOM 50 OE2 GLU A 6 16.341 4.434 -20.668 1.00 93.06 O
|
| 107 |
+
ATOM 51 N ILE A 7 15.579 2.146 -15.603 1.00 94.38 N
|
| 108 |
+
ATOM 52 CA ILE A 7 15.026 1.074 -14.757 1.00 94.38 C
|
| 109 |
+
ATOM 53 C ILE A 7 15.202 1.398 -13.268 1.00 94.38 C
|
| 110 |
+
ATOM 54 CB ILE A 7 15.653 -0.291 -15.130 1.00 94.38 C
|
| 111 |
+
ATOM 55 O ILE A 7 14.277 1.205 -12.483 1.00 94.38 O
|
| 112 |
+
ATOM 56 CG1 ILE A 7 15.277 -0.743 -16.561 1.00 94.38 C
|
| 113 |
+
ATOM 57 CG2 ILE A 7 15.289 -1.397 -14.122 1.00 94.38 C
|
| 114 |
+
ATOM 58 CD1 ILE A 7 13.785 -1.010 -16.808 1.00 94.38 C
|
| 115 |
+
ATOM 59 N ASN A 8 16.354 1.935 -12.858 1.00 95.56 N
|
| 116 |
+
ATOM 60 CA ASN A 8 16.566 2.359 -11.471 1.00 95.56 C
|
| 117 |
+
ATOM 61 C ASN A 8 15.627 3.495 -11.063 1.00 95.56 C
|
| 118 |
+
ATOM 62 CB ASN A 8 18.023 2.795 -11.277 1.00 95.56 C
|
| 119 |
+
ATOM 63 O ASN A 8 15.060 3.446 -9.973 1.00 95.56 O
|
| 120 |
+
ATOM 64 CG ASN A 8 18.998 1.644 -11.247 1.00 95.56 C
|
| 121 |
+
ATOM 65 ND2 ASN A 8 20.269 1.928 -11.400 1.00 95.56 N
|
| 122 |
+
ATOM 66 OD1 ASN A 8 18.662 0.492 -11.024 1.00 95.56 O
|
| 123 |
+
ATOM 67 N MET A 9 15.445 4.493 -11.930 1.00 95.75 N
|
| 124 |
+
ATOM 68 CA MET A 9 14.532 5.603 -11.666 1.00 95.75 C
|
| 125 |
+
ATOM 69 C MET A 9 13.087 5.124 -11.535 1.00 95.75 C
|
| 126 |
+
ATOM 70 CB MET A 9 14.665 6.672 -12.758 1.00 95.75 C
|
| 127 |
+
ATOM 71 O MET A 9 12.407 5.522 -10.593 1.00 95.75 O
|
| 128 |
+
ATOM 72 CG MET A 9 15.986 7.449 -12.656 1.00 95.75 C
|
| 129 |
+
ATOM 73 SD MET A 9 16.350 8.211 -11.045 1.00 95.75 S
|
| 130 |
+
ATOM 74 CE MET A 9 14.873 9.236 -10.810 1.00 95.75 C
|
| 131 |
+
ATOM 75 N LEU A 10 12.649 4.206 -12.400 1.00 95.19 N
|
| 132 |
+
ATOM 76 CA LEU A 10 11.334 3.576 -12.288 1.00 95.19 C
|
| 133 |
+
ATOM 77 C LEU A 10 11.183 2.801 -10.971 1.00 95.19 C
|
| 134 |
+
ATOM 78 CB LEU A 10 11.141 2.659 -13.506 1.00 95.19 C
|
| 135 |
+
ATOM 79 O LEU A 10 10.153 2.894 -10.308 1.00 95.19 O
|
| 136 |
+
ATOM 80 CG LEU A 10 9.712 2.103 -13.638 1.00 95.19 C
|
| 137 |
+
ATOM 81 CD1 LEU A 10 8.727 3.239 -13.895 1.00 95.19 C
|
| 138 |
+
ATOM 82 CD2 LEU A 10 9.652 1.125 -14.811 1.00 95.19 C
|
| 139 |
+
ATOM 83 N GLY A 11 12.230 2.080 -10.560 1.00 96.50 N
|
| 140 |
+
ATOM 84 CA GLY A 11 12.268 1.389 -9.274 1.00 96.50 C
|
| 141 |
+
ATOM 85 C GLY A 11 12.097 2.352 -8.095 1.00 96.50 C
|
| 142 |
+
ATOM 86 O GLY A 11 11.276 2.091 -7.222 1.00 96.50 O
|
| 143 |
+
ATOM 87 N PHE A 12 12.790 3.497 -8.092 1.00 97.44 N
|
| 144 |
+
ATOM 88 CA PHE A 12 12.599 4.533 -7.068 1.00 97.44 C
|
| 145 |
+
ATOM 89 C PHE A 12 11.181 5.105 -7.058 1.00 97.44 C
|
| 146 |
+
ATOM 90 CB PHE A 12 13.599 5.681 -7.258 1.00 97.44 C
|
| 147 |
+
ATOM 91 O PHE A 12 10.620 5.296 -5.982 1.00 97.44 O
|
| 148 |
+
ATOM 92 CG PHE A 12 14.995 5.397 -6.751 1.00 97.44 C
|
| 149 |
+
ATOM 93 CD1 PHE A 12 15.192 5.056 -5.399 1.00 97.44 C
|
| 150 |
+
ATOM 94 CD2 PHE A 12 16.102 5.533 -7.607 1.00 97.44 C
|
| 151 |
+
ATOM 95 CE1 PHE A 12 16.489 4.837 -4.908 1.00 97.44 C
|
| 152 |
+
ATOM 96 CE2 PHE A 12 17.402 5.328 -7.113 1.00 97.44 C
|
| 153 |
+
ATOM 97 CZ PHE A 12 17.595 4.979 -5.764 1.00 97.44 C
|
| 154 |
+
ATOM 98 N THR A 13 10.591 5.350 -8.230 1.00 97.19 N
|
| 155 |
+
ATOM 99 CA THR A 13 9.200 5.807 -8.338 1.00 97.19 C
|
| 156 |
+
ATOM 100 C THR A 13 8.236 4.801 -7.712 1.00 97.19 C
|
| 157 |
+
ATOM 101 CB THR A 13 8.833 6.062 -9.807 1.00 97.19 C
|
| 158 |
+
ATOM 102 O THR A 13 7.391 5.192 -6.909 1.00 97.19 O
|
| 159 |
+
ATOM 103 CG2 THR A 13 7.398 6.541 -9.992 1.00 97.19 C
|
| 160 |
+
ATOM 104 OG1 THR A 13 9.655 7.080 -10.327 1.00 97.19 O
|
| 161 |
+
ATOM 105 N ILE A 14 8.393 3.508 -8.015 1.00 98.19 N
|
| 162 |
+
ATOM 106 CA ILE A 14 7.569 2.451 -7.413 1.00 98.19 C
|
| 163 |
+
ATOM 107 C ILE A 14 7.776 2.400 -5.894 1.00 98.19 C
|
| 164 |
+
ATOM 108 CB ILE A 14 7.848 1.087 -8.088 1.00 98.19 C
|
| 165 |
+
ATOM 109 O ILE A 14 6.793 2.353 -5.160 1.00 98.19 O
|
| 166 |
+
ATOM 110 CG1 ILE A 14 7.326 1.081 -9.545 1.00 98.19 C
|
| 167 |
+
ATOM 111 CG2 ILE A 14 7.163 -0.048 -7.305 1.00 98.19 C
|
| 168 |
+
ATOM 112 CD1 ILE A 14 7.911 -0.052 -10.399 1.00 98.19 C
|
| 169 |
+
ATOM 113 N VAL A 15 9.026 2.444 -5.412 1.00 98.31 N
|
| 170 |
+
ATOM 114 CA VAL A 15 9.336 2.439 -3.969 1.00 98.31 C
|
| 171 |
+
ATOM 115 C VAL A 15 8.680 3.617 -3.251 1.00 98.31 C
|
| 172 |
+
ATOM 116 CB VAL A 15 10.859 2.449 -3.710 1.00 98.31 C
|
| 173 |
+
ATOM 117 O VAL A 15 8.124 3.415 -2.177 1.00 98.31 O
|
| 174 |
+
ATOM 118 CG1 VAL A 15 11.226 2.692 -2.237 1.00 98.31 C
|
| 175 |
+
ATOM 119 CG2 VAL A 15 11.500 1.108 -4.083 1.00 98.31 C
|
| 176 |
+
ATOM 120 N ALA A 16 8.726 4.822 -3.824 1.00 98.12 N
|
| 177 |
+
ATOM 121 CA ALA A 16 8.142 6.011 -3.210 1.00 98.12 C
|
| 178 |
+
ATOM 122 C ALA A 16 6.622 5.865 -3.048 1.00 98.12 C
|
| 179 |
+
ATOM 123 CB ALA A 16 8.530 7.240 -4.041 1.00 98.12 C
|
| 180 |
+
ATOM 124 O ALA A 16 6.123 5.878 -1.927 1.00 98.12 O
|
| 181 |
+
ATOM 125 N TYR A 17 5.903 5.607 -4.144 1.00 98.44 N
|
| 182 |
+
ATOM 126 CA TYR A 17 4.447 5.454 -4.103 1.00 98.44 C
|
| 183 |
+
ATOM 127 C TYR A 17 3.993 4.266 -3.245 1.00 98.44 C
|
| 184 |
+
ATOM 128 CB TYR A 17 3.921 5.288 -5.531 1.00 98.44 C
|
| 185 |
+
ATOM 129 O TYR A 17 3.035 4.380 -2.483 1.00 98.44 O
|
| 186 |
+
ATOM 130 CG TYR A 17 3.847 6.560 -6.345 1.00 98.44 C
|
| 187 |
+
ATOM 131 CD1 TYR A 17 3.043 7.625 -5.896 1.00 98.44 C
|
| 188 |
+
ATOM 132 CD2 TYR A 17 4.537 6.665 -7.567 1.00 98.44 C
|
| 189 |
+
ATOM 133 CE1 TYR A 17 2.952 8.807 -6.652 1.00 98.44 C
|
| 190 |
+
ATOM 134 CE2 TYR A 17 4.442 7.844 -8.331 1.00 98.44 C
|
| 191 |
+
ATOM 135 OH TYR A 17 3.572 10.062 -8.596 1.00 98.44 O
|
| 192 |
+
ATOM 136 CZ TYR A 17 3.658 8.920 -7.867 1.00 98.44 C
|
| 193 |
+
ATOM 137 N ALA A 18 4.676 3.121 -3.338 1.00 98.50 N
|
| 194 |
+
ATOM 138 CA ALA A 18 4.351 1.964 -2.509 1.00 98.50 C
|
| 195 |
+
ATOM 139 C ALA A 18 4.667 2.217 -1.024 1.00 98.50 C
|
| 196 |
+
ATOM 140 CB ALA A 18 5.098 0.741 -3.049 1.00 98.50 C
|
| 197 |
+
ATOM 141 O ALA A 18 3.925 1.767 -0.156 1.00 98.50 O
|
| 198 |
+
ATOM 142 N GLY A 19 5.742 2.947 -0.719 1.00 98.12 N
|
| 199 |
+
ATOM 143 CA GLY A 19 6.115 3.326 0.644 1.00 98.12 C
|
| 200 |
+
ATOM 144 C GLY A 19 5.111 4.278 1.296 1.00 98.12 C
|
| 201 |
+
ATOM 145 O GLY A 19 4.735 4.060 2.452 1.00 98.12 O
|
| 202 |
+
ATOM 146 N ASP A 20 4.637 5.273 0.546 1.00 98.06 N
|
| 203 |
+
ATOM 147 CA ASP A 20 3.592 6.201 0.990 1.00 98.06 C
|
| 204 |
+
ATOM 148 C ASP A 20 2.285 5.439 1.251 1.00 98.06 C
|
| 205 |
+
ATOM 149 CB ASP A 20 3.401 7.323 -0.050 1.00 98.06 C
|
| 206 |
+
ATOM 150 O ASP A 20 1.762 5.474 2.365 1.00 98.06 O
|
| 207 |
+
ATOM 151 CG ASP A 20 4.580 8.309 -0.135 1.00 98.06 C
|
| 208 |
+
ATOM 152 OD1 ASP A 20 5.423 8.328 0.793 1.00 98.06 O
|
| 209 |
+
ATOM 153 OD2 ASP A 20 4.637 9.055 -1.141 1.00 98.06 O
|
| 210 |
+
ATOM 154 N ALA A 21 1.838 4.619 0.291 1.00 98.75 N
|
| 211 |
+
ATOM 155 CA ALA A 21 0.651 3.780 0.459 1.00 98.75 C
|
| 212 |
+
ATOM 156 C ALA A 21 0.752 2.843 1.670 1.00 98.75 C
|
| 213 |
+
ATOM 157 CB ALA A 21 0.453 2.946 -0.806 1.00 98.75 C
|
| 214 |
+
ATOM 158 O ALA A 21 -0.206 2.666 2.420 1.00 98.75 O
|
| 215 |
+
ATOM 159 N ARG A 22 1.918 2.225 1.885 1.00 98.75 N
|
| 216 |
+
ATOM 160 CA ARG A 22 2.144 1.345 3.034 1.00 98.75 C
|
| 217 |
+
ATOM 161 C ARG A 22 2.034 2.099 4.354 1.00 98.75 C
|
| 218 |
+
ATOM 162 CB ARG A 22 3.508 0.668 2.882 1.00 98.75 C
|
| 219 |
+
ATOM 163 O ARG A 22 1.535 1.525 5.318 1.00 98.75 O
|
| 220 |
+
ATOM 164 CG ARG A 22 3.721 -0.416 3.941 1.00 98.75 C
|
| 221 |
+
ATOM 165 CD ARG A 22 5.031 -1.157 3.671 1.00 98.75 C
|
| 222 |
+
ATOM 166 NE ARG A 22 5.240 -2.239 4.652 1.00 98.75 N
|
| 223 |
+
ATOM 167 NH1 ARG A 22 6.218 -0.981 6.305 1.00 98.75 N
|
| 224 |
+
ATOM 168 NH2 ARG A 22 5.816 -3.153 6.653 1.00 98.75 N
|
| 225 |
+
ATOM 169 CZ ARG A 22 5.759 -2.118 5.860 1.00 98.75 C
|
| 226 |
+
ATOM 170 N SER A 23 2.510 3.339 4.406 1.00 98.62 N
|
| 227 |
+
ATOM 171 CA SER A 23 2.422 4.174 5.607 1.00 98.62 C
|
| 228 |
+
ATOM 172 C SER A 23 0.965 4.516 5.916 1.00 98.62 C
|
| 229 |
+
ATOM 173 CB SER A 23 3.283 5.430 5.461 1.00 98.62 C
|
| 230 |
+
ATOM 174 O SER A 23 0.506 4.203 7.013 1.00 98.62 O
|
| 231 |
+
ATOM 175 OG SER A 23 4.623 5.043 5.188 1.00 98.62 O
|
| 232 |
+
ATOM 176 N ASP A 24 0.212 4.987 4.918 1.00 98.81 N
|
| 233 |
+
ATOM 177 CA ASP A 24 -1.225 5.265 5.042 1.00 98.81 C
|
| 234 |
+
ATOM 178 C ASP A 24 -2.008 4.034 5.534 1.00 98.81 C
|
| 235 |
+
ATOM 179 CB ASP A 24 -1.786 5.710 3.678 1.00 98.81 C
|
| 236 |
+
ATOM 180 O ASP A 24 -2.852 4.135 6.422 1.00 98.81 O
|
| 237 |
+
ATOM 181 CG ASP A 24 -1.464 7.151 3.265 1.00 98.81 C
|
| 238 |
+
ATOM 182 OD1 ASP A 24 -0.836 7.877 4.065 1.00 98.81 O
|
| 239 |
+
ATOM 183 OD2 ASP A 24 -1.887 7.526 2.144 1.00 98.81 O
|
| 240 |
+
ATOM 184 N LEU A 25 -1.701 2.838 5.018 1.00 98.88 N
|
| 241 |
+
ATOM 185 CA LEU A 25 -2.360 1.596 5.441 1.00 98.88 C
|
| 242 |
+
ATOM 186 C LEU A 25 -2.030 1.185 6.876 1.00 98.88 C
|
| 243 |
+
ATOM 187 CB LEU A 25 -1.967 0.459 4.489 1.00 98.88 C
|
| 244 |
+
ATOM 188 O LEU A 25 -2.892 0.659 7.584 1.00 98.88 O
|
| 245 |
+
ATOM 189 CG LEU A 25 -2.581 0.612 3.096 1.00 98.88 C
|
| 246 |
+
ATOM 190 CD1 LEU A 25 -1.926 -0.384 2.145 1.00 98.88 C
|
| 247 |
+
ATOM 191 CD2 LEU A 25 -4.095 0.403 3.107 1.00 98.88 C
|
| 248 |
+
ATOM 192 N MET A 26 -0.790 1.398 7.314 1.00 98.69 N
|
| 249 |
+
ATOM 193 CA MET A 26 -0.400 1.128 8.698 1.00 98.69 C
|
| 250 |
+
ATOM 194 C MET A 26 -1.075 2.109 9.661 1.00 98.69 C
|
| 251 |
+
ATOM 195 CB MET A 26 1.127 1.180 8.837 1.00 98.69 C
|
| 252 |
+
ATOM 196 O MET A 26 -1.540 1.690 10.724 1.00 98.69 O
|
| 253 |
+
ATOM 197 CG MET A 26 1.819 -0.008 8.149 1.00 98.69 C
|
| 254 |
+
ATOM 198 SD MET A 26 1.516 -1.665 8.837 1.00 98.69 S
|
| 255 |
+
ATOM 199 CE MET A 26 2.288 -1.501 10.465 1.00 98.69 C
|
| 256 |
+
ATOM 200 N ASP A 27 -1.196 3.377 9.269 1.00 98.75 N
|
| 257 |
+
ATOM 201 CA ASP A 27 -1.918 4.387 10.040 1.00 98.75 C
|
| 258 |
+
ATOM 202 C ASP A 27 -3.424 4.093 10.064 1.00 98.75 C
|
| 259 |
+
ATOM 203 CB ASP A 27 -1.603 5.788 9.491 1.00 98.75 C
|
| 260 |
+
ATOM 204 O ASP A 27 -4.041 4.160 11.126 1.00 98.75 O
|
| 261 |
+
ATOM 205 CG ASP A 27 -0.193 6.285 9.852 1.00 98.75 C
|
| 262 |
+
ATOM 206 OD1 ASP A 27 0.465 5.658 10.721 1.00 98.75 O
|
| 263 |
+
ATOM 207 OD2 ASP A 27 0.204 7.340 9.315 1.00 98.75 O
|
| 264 |
+
ATOM 208 N ALA A 28 -4.013 3.644 8.951 1.00 98.81 N
|
| 265 |
+
ATOM 209 CA ALA A 28 -5.409 3.209 8.896 1.00 98.81 C
|
| 266 |
+
ATOM 210 C ALA A 28 -5.707 2.089 9.906 1.00 98.81 C
|
| 267 |
+
ATOM 211 CB ALA A 28 -5.735 2.746 7.472 1.00 98.81 C
|
| 268 |
+
ATOM 212 O ALA A 28 -6.714 2.138 10.615 1.00 98.81 O
|
| 269 |
+
ATOM 213 N LEU A 29 -4.815 1.099 10.027 1.00 98.69 N
|
| 270 |
+
ATOM 214 CA LEU A 29 -4.935 0.045 11.041 1.00 98.69 C
|
| 271 |
+
ATOM 215 C LEU A 29 -4.868 0.602 12.468 1.00 98.69 C
|
| 272 |
+
ATOM 216 CB LEU A 29 -3.824 -1.001 10.847 1.00 98.69 C
|
| 273 |
+
ATOM 217 O LEU A 29 -5.593 0.121 13.341 1.00 98.69 O
|
| 274 |
+
ATOM 218 CG LEU A 29 -4.006 -1.902 9.620 1.00 98.69 C
|
| 275 |
+
ATOM 219 CD1 LEU A 29 -2.753 -2.759 9.426 1.00 98.69 C
|
| 276 |
+
ATOM 220 CD2 LEU A 29 -5.199 -2.845 9.778 1.00 98.69 C
|
| 277 |
+
ATOM 221 N ALA A 30 -4.016 1.600 12.715 1.00 98.56 N
|
| 278 |
+
ATOM 222 CA ALA A 30 -3.907 2.243 14.021 1.00 98.56 C
|
| 279 |
+
ATOM 223 C ALA A 30 -5.182 3.030 14.368 1.00 98.56 C
|
| 280 |
+
ATOM 224 CB ALA A 30 -2.651 3.122 14.045 1.00 98.56 C
|
| 281 |
+
ATOM 225 O ALA A 30 -5.738 2.837 15.448 1.00 98.56 O
|
| 282 |
+
ATOM 226 N PHE A 31 -5.695 3.837 13.435 1.00 98.62 N
|
| 283 |
+
ATOM 227 CA PHE A 31 -6.951 4.568 13.604 1.00 98.62 C
|
| 284 |
+
ATOM 228 C PHE A 31 -8.136 3.627 13.831 1.00 98.62 C
|
| 285 |
+
ATOM 229 CB PHE A 31 -7.193 5.475 12.388 1.00 98.62 C
|
| 286 |
+
ATOM 230 O PHE A 31 -8.922 3.849 14.751 1.00 98.62 O
|
| 287 |
+
ATOM 231 CG PHE A 31 -6.461 6.801 12.457 1.00 98.62 C
|
| 288 |
+
ATOM 232 CD1 PHE A 31 -6.849 7.775 13.397 1.00 98.62 C
|
| 289 |
+
ATOM 233 CD2 PHE A 31 -5.395 7.076 11.585 1.00 98.62 C
|
| 290 |
+
ATOM 234 CE1 PHE A 31 -6.184 9.011 13.461 1.00 98.62 C
|
| 291 |
+
ATOM 235 CE2 PHE A 31 -4.721 8.306 11.652 1.00 98.62 C
|
| 292 |
+
ATOM 236 CZ PHE A 31 -5.118 9.277 12.586 1.00 98.62 C
|
| 293 |
+
ATOM 237 N ALA A 32 -8.241 2.541 13.062 1.00 98.50 N
|
| 294 |
+
ATOM 238 CA ALA A 32 -9.313 1.564 13.225 1.00 98.50 C
|
| 295 |
+
ATOM 239 C ALA A 32 -9.265 0.857 14.584 1.00 98.50 C
|
| 296 |
+
ATOM 240 CB ALA A 32 -9.225 0.560 12.081 1.00 98.50 C
|
| 297 |
+
ATOM 241 O ALA A 32 -10.299 0.719 15.235 1.00 98.50 O
|
| 298 |
+
ATOM 242 N ARG A 33 -8.069 0.469 15.047 1.00 97.38 N
|
| 299 |
+
ATOM 243 CA ARG A 33 -7.874 -0.099 16.390 1.00 97.38 C
|
| 300 |
+
ATOM 244 C ARG A 33 -8.366 0.850 17.484 1.00 97.38 C
|
| 301 |
+
ATOM 245 CB ARG A 33 -6.386 -0.413 16.577 1.00 97.38 C
|
| 302 |
+
ATOM 246 O ARG A 33 -8.932 0.399 18.475 1.00 97.38 O
|
| 303 |
+
ATOM 247 CG ARG A 33 -6.087 -1.093 17.925 1.00 97.38 C
|
| 304 |
+
ATOM 248 CD ARG A 33 -4.593 -1.054 18.236 1.00 97.38 C
|
| 305 |
+
ATOM 249 NE ARG A 33 -4.161 0.332 18.478 1.00 97.38 N
|
| 306 |
+
ATOM 250 NH1 ARG A 33 -1.909 0.072 18.147 1.00 97.38 N
|
| 307 |
+
ATOM 251 NH2 ARG A 33 -2.816 2.118 18.460 1.00 97.38 N
|
| 308 |
+
ATOM 252 CZ ARG A 33 -2.955 0.830 18.364 1.00 97.38 C
|
| 309 |
+
ATOM 253 N ASP A 34 -8.165 2.149 17.295 1.00 96.94 N
|
| 310 |
+
ATOM 254 CA ASP A 34 -8.531 3.177 18.268 1.00 96.94 C
|
| 311 |
+
ATOM 255 C ASP A 34 -10.001 3.655 18.103 1.00 96.94 C
|
| 312 |
+
ATOM 256 CB ASP A 34 -7.472 4.297 18.220 1.00 96.94 C
|
| 313 |
+
ATOM 257 O ASP A 34 -10.477 4.492 18.869 1.00 96.94 O
|
| 314 |
+
ATOM 258 CG ASP A 34 -6.024 3.859 18.568 1.00 96.94 C
|
| 315 |
+
ATOM 259 OD1 ASP A 34 -5.759 2.701 18.990 1.00 96.94 O
|
| 316 |
+
ATOM 260 OD2 ASP A 34 -5.106 4.695 18.427 1.00 96.94 O
|
| 317 |
+
ATOM 261 N GLY A 35 -10.754 3.079 17.153 1.00 96.88 N
|
| 318 |
+
ATOM 262 CA GLY A 35 -12.182 3.337 16.917 1.00 96.88 C
|
| 319 |
+
ATOM 263 C GLY A 35 -12.490 4.452 15.908 1.00 96.88 C
|
| 320 |
+
ATOM 264 O GLY A 35 -13.653 4.798 15.703 1.00 96.88 O
|
| 321 |
+
ATOM 265 N TYR A 36 -11.471 5.010 15.256 1.00 98.31 N
|
| 322 |
+
ATOM 266 CA TYR A 36 -11.576 6.084 14.265 1.00 98.31 C
|
| 323 |
+
ATOM 267 C TYR A 36 -11.770 5.518 12.847 1.00 98.31 C
|
| 324 |
+
ATOM 268 CB TYR A 36 -10.336 6.973 14.381 1.00 98.31 C
|
| 325 |
+
ATOM 269 O TYR A 36 -10.902 5.621 11.980 1.00 98.31 O
|
| 326 |
+
ATOM 270 CG TYR A 36 -10.127 7.613 15.738 1.00 98.31 C
|
| 327 |
+
ATOM 271 CD1 TYR A 36 -11.034 8.578 16.214 1.00 98.31 C
|
| 328 |
+
ATOM 272 CD2 TYR A 36 -9.018 7.242 16.520 1.00 98.31 C
|
| 329 |
+
ATOM 273 CE1 TYR A 36 -10.835 9.168 17.478 1.00 98.31 C
|
| 330 |
+
ATOM 274 CE2 TYR A 36 -8.808 7.835 17.778 1.00 98.31 C
|
| 331 |
+
ATOM 275 OH TYR A 36 -9.525 9.369 19.477 1.00 98.31 O
|
| 332 |
+
ATOM 276 CZ TYR A 36 -9.719 8.795 18.260 1.00 98.31 C
|
| 333 |
+
ATOM 277 N PHE A 37 -12.904 4.852 12.618 1.00 98.12 N
|
| 334 |
+
ATOM 278 CA PHE A 37 -13.140 4.084 11.388 1.00 98.12 C
|
| 335 |
+
ATOM 279 C PHE A 37 -13.266 4.938 10.123 1.00 98.12 C
|
| 336 |
+
ATOM 280 CB PHE A 37 -14.397 3.221 11.551 1.00 98.12 C
|
| 337 |
+
ATOM 281 O PHE A 37 -12.864 4.487 9.055 1.00 98.12 O
|
| 338 |
+
ATOM 282 CG PHE A 37 -14.333 2.289 12.739 1.00 98.12 C
|
| 339 |
+
ATOM 283 CD1 PHE A 37 -13.359 1.278 12.772 1.00 98.12 C
|
| 340 |
+
ATOM 284 CD2 PHE A 37 -15.202 2.463 13.832 1.00 98.12 C
|
| 341 |
+
ATOM 285 CE1 PHE A 37 -13.240 0.460 13.903 1.00 98.12 C
|
| 342 |
+
ATOM 286 CE2 PHE A 37 -15.089 1.633 14.960 1.00 98.12 C
|
| 343 |
+
ATOM 287 CZ PHE A 37 -14.096 0.639 15.001 1.00 98.12 C
|
| 344 |
+
ATOM 288 N GLU A 38 -13.814 6.150 10.224 1.00 98.25 N
|
| 345 |
+
ATOM 289 CA GLU A 38 -13.940 7.061 9.079 1.00 98.25 C
|
| 346 |
+
ATOM 290 C GLU A 38 -12.555 7.490 8.584 1.00 98.25 C
|
| 347 |
+
ATOM 291 CB GLU A 38 -14.831 8.245 9.479 1.00 98.25 C
|
| 348 |
+
ATOM 292 O GLU A 38 -12.219 7.240 7.428 1.00 98.25 O
|
| 349 |
+
ATOM 293 CG GLU A 38 -15.162 9.190 8.311 1.00 98.25 C
|
| 350 |
+
ATOM 294 CD GLU A 38 -16.205 10.257 8.700 1.00 98.25 C
|
| 351 |
+
ATOM 295 OE1 GLU A 38 -16.863 10.805 7.786 1.00 98.25 O
|
| 352 |
+
ATOM 296 OE2 GLU A 38 -16.410 10.479 9.919 1.00 98.25 O
|
| 353 |
+
ATOM 297 N GLN A 39 -11.699 7.979 9.489 1.00 98.38 N
|
| 354 |
+
ATOM 298 CA GLN A 39 -10.314 8.340 9.171 1.00 98.38 C
|
| 355 |
+
ATOM 299 C GLN A 39 -9.511 7.147 8.637 1.00 98.38 C
|
| 356 |
+
ATOM 300 CB GLN A 39 -9.606 8.889 10.419 1.00 98.38 C
|
| 357 |
+
ATOM 301 O GLN A 39 -8.713 7.291 7.713 1.00 98.38 O
|
| 358 |
+
ATOM 302 CG GLN A 39 -10.220 10.186 10.967 1.00 98.38 C
|
| 359 |
+
ATOM 303 CD GLN A 39 -11.218 9.978 12.105 1.00 98.38 C
|
| 360 |
+
ATOM 304 NE2 GLN A 39 -11.245 10.874 13.068 1.00 98.38 N
|
| 361 |
+
ATOM 305 OE1 GLN A 39 -11.979 9.024 12.182 1.00 98.38 O
|
| 362 |
+
ATOM 306 N ALA A 40 -9.734 5.949 9.186 1.00 98.69 N
|
| 363 |
+
ATOM 307 CA ALA A 40 -9.098 4.742 8.673 1.00 98.69 C
|
| 364 |
+
ATOM 308 C ALA A 40 -9.495 4.457 7.214 1.00 98.69 C
|
| 365 |
+
ATOM 309 CB ALA A 40 -9.446 3.565 9.589 1.00 98.69 C
|
| 366 |
+
ATOM 310 O ALA A 40 -8.640 4.099 6.407 1.00 98.69 O
|
| 367 |
+
ATOM 311 N ARG A 41 -10.774 4.627 6.852 1.00 98.44 N
|
| 368 |
+
ATOM 312 CA ARG A 41 -11.250 4.409 5.476 1.00 98.44 C
|
| 369 |
+
ATOM 313 C ARG A 41 -10.730 5.487 4.514 1.00 98.44 C
|
| 370 |
+
ATOM 314 CB ARG A 41 -12.784 4.273 5.449 1.00 98.44 C
|
| 371 |
+
ATOM 315 O ARG A 41 -10.333 5.127 3.411 1.00 98.44 O
|
| 372 |
+
ATOM 316 CG ARG A 41 -13.275 2.964 6.106 1.00 98.44 C
|
| 373 |
+
ATOM 317 CD ARG A 41 -14.811 2.845 6.081 1.00 98.44 C
|
| 374 |
+
ATOM 318 NE ARG A 41 -15.339 1.767 6.964 1.00 98.44 N
|
| 375 |
+
ATOM 319 NH1 ARG A 41 -14.931 -0.098 5.669 1.00 98.44 N
|
| 376 |
+
ATOM 320 NH2 ARG A 41 -15.897 -0.376 7.621 1.00 98.44 N
|
| 377 |
+
ATOM 321 CZ ARG A 41 -15.393 0.458 6.751 1.00 98.44 C
|
| 378 |
+
ATOM 322 N GLU A 42 -10.633 6.746 4.943 1.00 98.56 N
|
| 379 |
+
ATOM 323 CA GLU A 42 -10.013 7.828 4.152 1.00 98.56 C
|
| 380 |
+
ATOM 324 C GLU A 42 -8.541 7.527 3.813 1.00 98.56 C
|
| 381 |
+
ATOM 325 CB GLU A 42 -10.087 9.157 4.923 1.00 98.56 C
|
| 382 |
+
ATOM 326 O GLU A 42 -8.117 7.668 2.665 1.00 98.56 O
|
| 383 |
+
ATOM 327 CG GLU A 42 -11.508 9.733 5.036 1.00 98.56 C
|
| 384 |
+
ATOM 328 CD GLU A 42 -11.566 11.044 5.844 1.00 98.56 C
|
| 385 |
+
ATOM 329 OE1 GLU A 42 -12.630 11.702 5.803 1.00 98.56 O
|
| 386 |
+
ATOM 330 OE2 GLU A 42 -10.560 11.405 6.502 1.00 98.56 O
|
| 387 |
+
ATOM 331 N LEU A 43 -7.762 7.038 4.783 1.00 98.75 N
|
| 388 |
+
ATOM 332 CA LEU A 43 -6.369 6.637 4.551 1.00 98.75 C
|
| 389 |
+
ATOM 333 C LEU A 43 -6.253 5.443 3.592 1.00 98.75 C
|
| 390 |
+
ATOM 334 CB LEU A 43 -5.708 6.306 5.895 1.00 98.75 C
|
| 391 |
+
ATOM 335 O LEU A 43 -5.346 5.401 2.765 1.00 98.75 O
|
| 392 |
+
ATOM 336 CG LEU A 43 -5.371 7.534 6.752 1.00 98.75 C
|
| 393 |
+
ATOM 337 CD1 LEU A 43 -4.964 7.055 8.142 1.00 98.75 C
|
| 394 |
+
ATOM 338 CD2 LEU A 43 -4.216 8.351 6.172 1.00 98.75 C
|
| 395 |
+
ATOM 339 N VAL A 44 -7.184 4.485 3.650 1.00 98.69 N
|
| 396 |
+
ATOM 340 CA VAL A 44 -7.225 3.366 2.690 1.00 98.69 C
|
| 397 |
+
ATOM 341 C VAL A 44 -7.492 3.857 1.264 1.00 98.69 C
|
| 398 |
+
ATOM 342 CB VAL A 44 -8.265 2.311 3.117 1.00 98.69 C
|
| 399 |
+
ATOM 343 O VAL A 44 -6.936 3.295 0.317 1.00 98.69 O
|
| 400 |
+
ATOM 344 CG1 VAL A 44 -8.504 1.215 2.067 1.00 98.69 C
|
| 401 |
+
ATOM 345 CG2 VAL A 44 -7.803 1.579 4.379 1.00 98.69 C
|
| 402 |
+
ATOM 346 N GLU A 45 -8.317 4.890 1.088 1.00 98.50 N
|
| 403 |
+
ATOM 347 CA GLU A 45 -8.545 5.518 -0.220 1.00 98.50 C
|
| 404 |
+
ATOM 348 C GLU A 45 -7.287 6.239 -0.728 1.00 98.50 C
|
| 405 |
+
ATOM 349 CB GLU A 45 -9.760 6.460 -0.171 1.00 98.50 C
|
| 406 |
+
ATOM 350 O GLU A 45 -6.864 5.984 -1.855 1.00 98.50 O
|
| 407 |
+
ATOM 351 CG GLU A 45 -11.079 5.681 -0.026 1.00 98.50 C
|
| 408 |
+
ATOM 352 CD GLU A 45 -12.340 6.565 -0.037 1.00 98.50 C
|
| 409 |
+
ATOM 353 OE1 GLU A 45 -13.442 5.965 -0.038 1.00 98.50 O
|
| 410 |
+
ATOM 354 OE2 GLU A 45 -12.219 7.809 -0.091 1.00 98.50 O
|
| 411 |
+
ATOM 355 N SER A 46 -6.622 7.031 0.121 1.00 98.31 N
|
| 412 |
+
ATOM 356 CA SER A 46 -5.331 7.670 -0.202 1.00 98.31 C
|
| 413 |
+
ATOM 357 C SER A 46 -4.264 6.645 -0.616 1.00 98.31 C
|
| 414 |
+
ATOM 358 CB SER A 46 -4.844 8.468 1.013 1.00 98.31 C
|
| 415 |
+
ATOM 359 O SER A 46 -3.605 6.778 -1.656 1.00 98.31 O
|
| 416 |
+
ATOM 360 OG SER A 46 -3.585 9.061 0.765 1.00 98.31 O
|
| 417 |
+
ATOM 361 N ALA A 47 -4.151 5.549 0.140 1.00 98.69 N
|
| 418 |
+
ATOM 362 CA ALA A 47 -3.233 4.464 -0.175 1.00 98.69 C
|
| 419 |
+
ATOM 363 C ALA A 47 -3.542 3.816 -1.531 1.00 98.69 C
|
| 420 |
+
ATOM 364 CB ALA A 47 -3.310 3.416 0.933 1.00 98.69 C
|
| 421 |
+
ATOM 365 O ALA A 47 -2.623 3.471 -2.277 1.00 98.69 O
|
| 422 |
+
ATOM 366 N ASN A 48 -4.825 3.657 -1.871 1.00 98.56 N
|
| 423 |
+
ATOM 367 CA ASN A 48 -5.242 3.086 -3.147 1.00 98.56 C
|
| 424 |
+
ATOM 368 C ASN A 48 -4.774 3.936 -4.335 1.00 98.56 C
|
| 425 |
+
ATOM 369 CB ASN A 48 -6.764 2.921 -3.158 1.00 98.56 C
|
| 426 |
+
ATOM 370 O ASN A 48 -4.274 3.380 -5.311 1.00 98.56 O
|
| 427 |
+
ATOM 371 CG ASN A 48 -7.233 2.275 -4.443 1.00 98.56 C
|
| 428 |
+
ATOM 372 ND2 ASN A 48 -7.952 3.005 -5.261 1.00 98.56 N
|
| 429 |
+
ATOM 373 OD1 ASN A 48 -6.972 1.117 -4.723 1.00 98.56 O
|
| 430 |
+
ATOM 374 N ASP A 49 -4.882 5.260 -4.254 1.00 98.31 N
|
| 431 |
+
ATOM 375 CA ASP A 49 -4.442 6.156 -5.331 1.00 98.31 C
|
| 432 |
+
ATOM 376 C ASP A 49 -2.927 6.045 -5.582 1.00 98.31 C
|
| 433 |
+
ATOM 377 CB ASP A 49 -4.842 7.599 -4.986 1.00 98.31 C
|
| 434 |
+
ATOM 378 O ASP A 49 -2.462 5.982 -6.731 1.00 98.31 O
|
| 435 |
+
ATOM 379 CG ASP A 49 -6.351 7.861 -5.086 1.00 98.31 C
|
| 436 |
+
ATOM 380 OD1 ASP A 49 -7.070 7.010 -5.669 1.00 98.31 O
|
| 437 |
+
ATOM 381 OD2 ASP A 49 -6.758 8.969 -4.673 1.00 98.31 O
|
| 438 |
+
ATOM 382 N SER A 50 -2.151 5.926 -4.504 1.00 98.31 N
|
| 439 |
+
ATOM 383 CA SER A 50 -0.705 5.689 -4.565 1.00 98.31 C
|
| 440 |
+
ATOM 384 C SER A 50 -0.369 4.303 -5.137 1.00 98.31 C
|
| 441 |
+
ATOM 385 CB SER A 50 -0.105 5.883 -3.173 1.00 98.31 C
|
| 442 |
+
ATOM 386 O SER A 50 0.478 4.189 -6.029 1.00 98.31 O
|
| 443 |
+
ATOM 387 OG SER A 50 -0.180 7.245 -2.814 1.00 98.31 O
|
| 444 |
+
ATOM 388 N ILE A 51 -1.080 3.249 -4.713 1.00 98.62 N
|
| 445 |
+
ATOM 389 CA ILE A 51 -0.931 1.887 -5.258 1.00 98.62 C
|
| 446 |
+
ATOM 390 C ILE A 51 -1.241 1.860 -6.751 1.00 98.62 C
|
| 447 |
+
ATOM 391 CB ILE A 51 -1.826 0.878 -4.499 1.00 98.62 C
|
| 448 |
+
ATOM 392 O ILE A 51 -0.467 1.292 -7.518 1.00 98.62 O
|
| 449 |
+
ATOM 393 CG1 ILE A 51 -1.223 0.608 -3.109 1.00 98.62 C
|
| 450 |
+
ATOM 394 CG2 ILE A 51 -1.983 -0.457 -5.256 1.00 98.62 C
|
| 451 |
+
ATOM 395 CD1 ILE A 51 -2.191 -0.069 -2.133 1.00 98.62 C
|
| 452 |
+
ATOM 396 N VAL A 52 -2.340 2.481 -7.187 1.00 98.38 N
|
| 453 |
+
ATOM 397 CA VAL A 52 -2.730 2.536 -8.603 1.00 98.38 C
|
| 454 |
+
ATOM 398 C VAL A 52 -1.640 3.208 -9.435 1.00 98.38 C
|
| 455 |
+
ATOM 399 CB VAL A 52 -4.085 3.257 -8.757 1.00 98.38 C
|
| 456 |
+
ATOM 400 O VAL A 52 -1.316 2.727 -10.525 1.00 98.38 O
|
| 457 |
+
ATOM 401 CG1 VAL A 52 -4.402 3.629 -10.214 1.00 98.38 C
|
| 458 |
+
ATOM 402 CG2 VAL A 52 -5.226 2.353 -8.270 1.00 98.38 C
|
| 459 |
+
ATOM 403 N SER A 53 -1.035 4.275 -8.912 1.00 97.56 N
|
| 460 |
+
ATOM 404 CA SER A 53 0.066 4.979 -9.575 1.00 97.56 C
|
| 461 |
+
ATOM 405 C SER A 53 1.295 4.077 -9.747 1.00 97.56 C
|
| 462 |
+
ATOM 406 CB SER A 53 0.411 6.261 -8.809 1.00 97.56 C
|
| 463 |
+
ATOM 407 O SER A 53 1.803 3.937 -10.859 1.00 97.56 O
|
| 464 |
+
ATOM 408 OG SER A 53 -0.729 7.101 -8.757 1.00 97.56 O
|
| 465 |
+
ATOM 409 N ALA A 54 1.723 3.383 -8.688 1.00 97.94 N
|
| 466 |
+
ATOM 410 CA ALA A 54 2.848 2.446 -8.743 1.00 97.94 C
|
| 467 |
+
ATOM 411 C ALA A 54 2.567 1.215 -9.626 1.00 97.94 C
|
| 468 |
+
ATOM 412 CB ALA A 54 3.158 2.008 -7.310 1.00 97.94 C
|
| 469 |
+
ATOM 413 O ALA A 54 3.402 0.804 -10.434 1.00 97.94 O
|
| 470 |
+
ATOM 414 N HIS A 55 1.375 0.632 -9.498 1.00 97.94 N
|
| 471 |
+
ATOM 415 CA HIS A 55 0.964 -0.566 -10.226 1.00 97.94 C
|
| 472 |
+
ATOM 416 C HIS A 55 0.821 -0.308 -11.726 1.00 97.94 C
|
| 473 |
+
ATOM 417 CB HIS A 55 -0.340 -1.096 -9.623 1.00 97.94 C
|
| 474 |
+
ATOM 418 O HIS A 55 1.092 -1.192 -12.541 1.00 97.94 O
|
| 475 |
+
ATOM 419 CG HIS A 55 -0.761 -2.416 -10.213 1.00 97.94 C
|
| 476 |
+
ATOM 420 CD2 HIS A 55 -0.377 -3.660 -9.790 1.00 97.94 C
|
| 477 |
+
ATOM 421 ND1 HIS A 55 -1.558 -2.596 -11.320 1.00 97.94 N
|
| 478 |
+
ATOM 422 CE1 HIS A 55 -1.654 -3.915 -11.554 1.00 97.94 C
|
| 479 |
+
ATOM 423 NE2 HIS A 55 -0.972 -4.606 -10.633 1.00 97.94 N
|
| 480 |
+
ATOM 424 N ARG A 56 0.449 0.913 -12.128 1.00 97.69 N
|
| 481 |
+
ATOM 425 CA ARG A 56 0.449 1.305 -13.540 1.00 97.69 C
|
| 482 |
+
ATOM 426 C ARG A 56 1.852 1.238 -14.142 1.00 97.69 C
|
| 483 |
+
ATOM 427 CB ARG A 56 -0.160 2.702 -13.661 1.00 97.69 C
|
| 484 |
+
ATOM 428 O ARG A 56 2.012 0.682 -15.226 1.00 97.69 O
|
| 485 |
+
ATOM 429 CG ARG A 56 -0.254 3.132 -15.126 1.00 97.69 C
|
| 486 |
+
ATOM 430 CD ARG A 56 -0.925 4.498 -15.210 1.00 97.69 C
|
| 487 |
+
ATOM 431 NE ARG A 56 -1.008 4.946 -16.609 1.00 97.69 N
|
| 488 |
+
ATOM 432 NH1 ARG A 56 -2.167 6.876 -16.199 1.00 97.69 N
|
| 489 |
+
ATOM 433 NH2 ARG A 56 -1.533 6.385 -18.288 1.00 97.69 N
|
| 490 |
+
ATOM 434 CZ ARG A 56 -1.567 6.064 -17.025 1.00 97.69 C
|
| 491 |
+
ATOM 435 N GLU A 57 2.857 1.747 -13.436 1.00 95.44 N
|
| 492 |
+
ATOM 436 CA GLU A 57 4.254 1.684 -13.878 1.00 95.44 C
|
| 493 |
+
ATOM 437 C GLU A 57 4.769 0.240 -13.953 1.00 95.44 C
|
| 494 |
+
ATOM 438 CB GLU A 57 5.128 2.536 -12.944 1.00 95.44 C
|
| 495 |
+
ATOM 439 O GLU A 57 5.374 -0.153 -14.952 1.00 95.44 O
|
| 496 |
+
ATOM 440 CG GLU A 57 4.856 4.049 -13.038 1.00 95.44 C
|
| 497 |
+
ATOM 441 CD GLU A 57 4.818 4.576 -14.484 1.00 95.44 C
|
| 498 |
+
ATOM 442 OE1 GLU A 57 3.866 5.317 -14.822 1.00 95.44 O
|
| 499 |
+
ATOM 443 OE2 GLU A 57 5.695 4.181 -15.287 1.00 95.44 O
|
| 500 |
+
ATOM 444 N GLN A 58 4.447 -0.585 -12.951 1.00 96.25 N
|
| 501 |
+
ATOM 445 CA GLN A 58 4.724 -2.025 -12.975 1.00 96.25 C
|
| 502 |
+
ATOM 446 C GLN A 58 4.062 -2.717 -14.179 1.00 96.25 C
|
| 503 |
+
ATOM 447 CB GLN A 58 4.241 -2.631 -11.648 1.00 96.25 C
|
| 504 |
+
ATOM 448 O GLN A 58 4.712 -3.489 -14.882 1.00 96.25 O
|
| 505 |
+
ATOM 449 CG GLN A 58 4.362 -4.163 -11.581 1.00 96.25 C
|
| 506 |
+
ATOM 450 CD GLN A 58 3.750 -4.720 -10.299 1.00 96.25 C
|
| 507 |
+
ATOM 451 NE2 GLN A 58 4.400 -5.601 -9.581 1.00 96.25 N
|
| 508 |
+
ATOM 452 OE1 GLN A 58 2.654 -4.366 -9.916 1.00 96.25 O
|
| 509 |
+
ATOM 453 N THR A 59 2.784 -2.427 -14.444 1.00 96.69 N
|
| 510 |
+
ATOM 454 CA THR A 59 2.023 -3.030 -15.551 1.00 96.69 C
|
| 511 |
+
ATOM 455 C THR A 59 2.626 -2.664 -16.905 1.00 96.69 C
|
| 512 |
+
ATOM 456 CB THR A 59 0.550 -2.592 -15.519 1.00 96.69 C
|
| 513 |
+
ATOM 457 O THR A 59 2.758 -3.530 -17.770 1.00 96.69 O
|
| 514 |
+
ATOM 458 CG2 THR A 59 -0.282 -3.236 -16.631 1.00 96.69 C
|
| 515 |
+
ATOM 459 OG1 THR A 59 -0.063 -2.969 -14.308 1.00 96.69 O
|
| 516 |
+
ATOM 460 N ASN A 60 3.024 -1.401 -17.091 1.00 94.62 N
|
| 517 |
+
ATOM 461 CA ASN A 60 3.681 -0.955 -18.318 1.00 94.62 C
|
| 518 |
+
ATOM 462 C ASN A 60 4.998 -1.709 -18.549 1.00 94.62 C
|
| 519 |
+
ATOM 463 CB ASN A 60 3.938 0.558 -18.245 1.00 94.62 C
|
| 520 |
+
ATOM 464 O ASN A 60 5.239 -2.178 -19.658 1.00 94.62 O
|
| 521 |
+
ATOM 465 CG ASN A 60 2.687 1.413 -18.303 1.00 94.62 C
|
| 522 |
+
ATOM 466 ND2 ASN A 60 2.783 2.630 -17.818 1.00 94.62 N
|
| 523 |
+
ATOM 467 OD1 ASN A 60 1.633 1.042 -18.802 1.00 94.62 O
|
| 524 |
+
ATOM 468 N LEU A 61 5.812 -1.876 -17.502 1.00 93.50 N
|
| 525 |
+
ATOM 469 CA LEU A 61 7.084 -2.594 -17.595 1.00 93.50 C
|
| 526 |
+
ATOM 470 C LEU A 61 6.888 -4.072 -17.978 1.00 93.50 C
|
| 527 |
+
ATOM 471 CB LEU A 61 7.827 -2.441 -16.256 1.00 93.50 C
|
| 528 |
+
ATOM 472 O LEU A 61 7.577 -4.569 -18.865 1.00 93.50 O
|
| 529 |
+
ATOM 473 CG LEU A 61 9.266 -2.985 -16.281 1.00 93.50 C
|
| 530 |
+
ATOM 474 CD1 LEU A 61 10.186 -2.134 -17.162 1.00 93.50 C
|
| 531 |
+
ATOM 475 CD2 LEU A 61 9.828 -2.989 -14.858 1.00 93.50 C
|
| 532 |
+
ATOM 476 N LEU A 62 5.914 -4.756 -17.366 1.00 94.44 N
|
| 533 |
+
ATOM 477 CA LEU A 62 5.568 -6.143 -17.710 1.00 94.44 C
|
| 534 |
+
ATOM 478 C LEU A 62 5.064 -6.272 -19.154 1.00 94.44 C
|
| 535 |
+
ATOM 479 CB LEU A 62 4.481 -6.653 -16.745 1.00 94.44 C
|
| 536 |
+
ATOM 480 O LEU A 62 5.383 -7.241 -19.843 1.00 94.44 O
|
| 537 |
+
ATOM 481 CG LEU A 62 4.958 -6.912 -15.306 1.00 94.44 C
|
| 538 |
+
ATOM 482 CD1 LEU A 62 3.743 -7.190 -14.418 1.00 94.44 C
|
| 539 |
+
ATOM 483 CD2 LEU A 62 5.895 -8.118 -15.223 1.00 94.44 C
|
| 540 |
+
ATOM 484 N ALA A 63 4.277 -5.300 -19.625 1.00 95.12 N
|
| 541 |
+
ATOM 485 CA ALA A 63 3.796 -5.283 -21.001 1.00 95.12 C
|
| 542 |
+
ATOM 486 C ALA A 63 4.955 -5.122 -21.994 1.00 95.12 C
|
| 543 |
+
ATOM 487 CB ALA A 63 2.745 -4.178 -21.157 1.00 95.12 C
|
| 544 |
+
ATOM 488 O ALA A 63 5.025 -5.870 -22.966 1.00 95.12 O
|
| 545 |
+
ATOM 489 N GLU A 64 5.874 -4.186 -21.742 1.00 92.75 N
|
| 546 |
+
ATOM 490 CA GLU A 64 7.086 -4.012 -22.549 1.00 92.75 C
|
| 547 |
+
ATOM 491 C GLU A 64 7.918 -5.312 -22.597 1.00 92.75 C
|
| 548 |
+
ATOM 492 CB GLU A 64 7.912 -2.830 -22.003 1.00 92.75 C
|
| 549 |
+
ATOM 493 O GLU A 64 8.336 -5.719 -23.684 1.00 92.75 O
|
| 550 |
+
ATOM 494 CG GLU A 64 7.305 -1.433 -22.253 1.00 92.75 C
|
| 551 |
+
ATOM 495 CD GLU A 64 8.120 -0.303 -21.583 1.00 92.75 C
|
| 552 |
+
ATOM 496 OE1 GLU A 64 7.648 0.861 -21.533 1.00 92.75 O
|
| 553 |
+
ATOM 497 OE2 GLU A 64 9.260 -0.555 -21.132 1.00 92.75 O
|
| 554 |
+
ATOM 498 N GLU A 65 8.074 -6.017 -21.466 1.00 91.44 N
|
| 555 |
+
ATOM 499 CA GLU A 65 8.799 -7.299 -21.404 1.00 91.44 C
|
| 556 |
+
ATOM 500 C GLU A 65 8.145 -8.353 -22.300 1.00 91.44 C
|
| 557 |
+
ATOM 501 CB GLU A 65 8.826 -7.854 -19.964 1.00 91.44 C
|
| 558 |
+
ATOM 502 O GLU A 65 8.802 -9.026 -23.097 1.00 91.44 O
|
| 559 |
+
ATOM 503 CG GLU A 65 10.066 -8.742 -19.746 1.00 91.44 C
|
| 560 |
+
ATOM 504 CD GLU A 65 10.265 -9.191 -18.289 1.00 91.44 C
|
| 561 |
+
ATOM 505 OE1 GLU A 65 11.421 -9.533 -17.944 1.00 91.44 O
|
| 562 |
+
ATOM 506 OE2 GLU A 65 9.274 -9.211 -17.522 1.00 91.44 O
|
| 563 |
+
ATOM 507 N ALA A 66 6.817 -8.464 -22.211 1.00 93.50 N
|
| 564 |
+
ATOM 508 CA ALA A 66 6.033 -9.422 -22.979 1.00 93.50 C
|
| 565 |
+
ATOM 509 C ALA A 66 6.080 -9.154 -24.494 1.00 93.50 C
|
| 566 |
+
ATOM 510 CB ALA A 66 4.597 -9.397 -22.444 1.00 93.50 C
|
| 567 |
+
ATOM 511 O ALA A 66 5.958 -10.092 -25.285 1.00 93.50 O
|
| 568 |
+
ATOM 512 N TYR A 67 6.283 -7.897 -24.909 1.00 93.75 N
|
| 569 |
+
ATOM 513 CA TYR A 67 6.494 -7.525 -26.313 1.00 93.75 C
|
| 570 |
+
ATOM 514 C TYR A 67 7.919 -7.804 -26.821 1.00 93.75 C
|
| 571 |
+
ATOM 515 CB TYR A 67 6.073 -6.065 -26.548 1.00 93.75 C
|
| 572 |
+
ATOM 516 O TYR A 67 8.168 -7.666 -28.022 1.00 93.75 O
|
| 573 |
+
ATOM 517 CG TYR A 67 4.572 -5.874 -26.667 1.00 93.75 C
|
| 574 |
+
ATOM 518 CD1 TYR A 67 3.876 -6.451 -27.748 1.00 93.75 C
|
| 575 |
+
ATOM 519 CD2 TYR A 67 3.870 -5.117 -25.712 1.00 93.75 C
|
| 576 |
+
ATOM 520 CE1 TYR A 67 2.480 -6.297 -27.853 1.00 93.75 C
|
| 577 |
+
ATOM 521 CE2 TYR A 67 2.473 -4.978 -25.797 1.00 93.75 C
|
| 578 |
+
ATOM 522 OH TYR A 67 0.428 -5.433 -26.961 1.00 93.75 O
|
| 579 |
+
ATOM 523 CZ TYR A 67 1.777 -5.572 -26.870 1.00 93.75 C
|
| 580 |
+
ATOM 524 N GLY A 68 8.828 -8.256 -25.953 1.00 89.38 N
|
| 581 |
+
ATOM 525 CA GLY A 68 10.177 -8.688 -26.316 1.00 89.38 C
|
| 582 |
+
ATOM 526 C GLY A 68 11.278 -7.672 -26.019 1.00 89.38 C
|
| 583 |
+
ATOM 527 O GLY A 68 12.415 -7.891 -26.447 1.00 89.38 O
|
| 584 |
+
ATOM 528 N ASP A 69 10.980 -6.589 -25.294 1.00 88.50 N
|
| 585 |
+
ATOM 529 CA ASP A 69 12.035 -5.736 -24.751 1.00 88.50 C
|
| 586 |
+
ATOM 530 C ASP A 69 12.769 -6.493 -23.631 1.00 88.50 C
|
| 587 |
+
ATOM 531 CB ASP A 69 11.502 -4.368 -24.273 1.00 88.50 C
|
| 588 |
+
ATOM 532 O ASP A 69 12.163 -7.025 -22.707 1.00 88.50 O
|
| 589 |
+
ATOM 533 CG ASP A 69 11.601 -3.242 -25.315 1.00 88.50 C
|
| 590 |
+
ATOM 534 OD1 ASP A 69 11.620 -3.510 -26.534 1.00 88.50 O
|
| 591 |
+
ATOM 535 OD2 ASP A 69 11.868 -2.078 -24.912 1.00 88.50 O
|
| 592 |
+
ATOM 536 N ASN A 70 14.100 -6.533 -23.712 1.00 83.81 N
|
| 593 |
+
ATOM 537 CA ASN A 70 14.951 -7.048 -22.642 1.00 83.81 C
|
| 594 |
+
ATOM 538 C ASN A 70 15.485 -5.881 -21.813 1.00 83.81 C
|
| 595 |
+
ATOM 539 CB ASN A 70 16.100 -7.889 -23.230 1.00 83.81 C
|
| 596 |
+
ATOM 540 O ASN A 70 16.066 -4.938 -22.361 1.00 83.81 O
|
| 597 |
+
ATOM 541 CG ASN A 70 15.795 -9.375 -23.289 1.00 83.81 C
|
| 598 |
+
ATOM 542 ND2 ASN A 70 16.350 -10.081 -24.245 1.00 83.81 N
|
| 599 |
+
ATOM 543 OD1 ASN A 70 15.127 -9.953 -22.457 1.00 83.81 O
|
| 600 |
+
ATOM 544 N PHE A 71 15.356 -5.980 -20.493 1.00 87.12 N
|
| 601 |
+
ATOM 545 CA PHE A 71 15.896 -4.999 -19.554 1.00 87.12 C
|
| 602 |
+
ATOM 546 C PHE A 71 16.942 -5.638 -18.648 1.00 87.12 C
|
| 603 |
+
ATOM 547 CB PHE A 71 14.790 -4.343 -18.720 1.00 87.12 C
|
| 604 |
+
ATOM 548 O PHE A 71 16.871 -6.819 -18.310 1.00 87.12 O
|
| 605 |
+
ATOM 549 CG PHE A 71 13.421 -4.343 -19.354 1.00 87.12 C
|
| 606 |
+
ATOM 550 CD1 PHE A 71 13.093 -3.426 -20.370 1.00 87.12 C
|
| 607 |
+
ATOM 551 CD2 PHE A 71 12.476 -5.280 -18.911 1.00 87.12 C
|
| 608 |
+
ATOM 552 CE1 PHE A 71 11.800 -3.428 -20.921 1.00 87.12 C
|
| 609 |
+
ATOM 553 CE2 PHE A 71 11.192 -5.268 -19.454 1.00 87.12 C
|
| 610 |
+
ATOM 554 CZ PHE A 71 10.855 -4.356 -20.462 1.00 87.12 C
|
| 611 |
+
ATOM 555 N GLU A 72 17.913 -4.842 -18.210 1.00 86.12 N
|
| 612 |
+
ATOM 556 CA GLU A 72 18.822 -5.272 -17.154 1.00 86.12 C
|
| 613 |
+
ATOM 557 C GLU A 72 18.104 -5.170 -15.805 1.00 86.12 C
|
| 614 |
+
ATOM 558 CB GLU A 72 20.116 -4.449 -17.196 1.00 86.12 C
|
| 615 |
+
ATOM 559 O GLU A 72 17.750 -4.077 -15.355 1.00 86.12 O
|
| 616 |
+
ATOM 560 CG GLU A 72 21.208 -5.072 -16.309 1.00 86.12 C
|
| 617 |
+
ATOM 561 CD GLU A 72 22.486 -4.220 -16.243 1.00 86.12 C
|
| 618 |
+
ATOM 562 OE1 GLU A 72 23.268 -4.391 -15.272 1.00 86.12 O
|
| 619 |
+
ATOM 563 OE2 GLU A 72 22.681 -3.328 -17.094 1.00 86.12 O
|
| 620 |
+
ATOM 564 N VAL A 73 17.899 -6.312 -15.150 1.00 82.31 N
|
| 621 |
+
ATOM 565 CA VAL A 73 17.302 -6.358 -13.814 1.00 82.31 C
|
| 622 |
+
ATOM 566 C VAL A 73 18.214 -5.634 -12.824 1.00 82.31 C
|
| 623 |
+
ATOM 567 CB VAL A 73 17.033 -7.804 -13.364 1.00 82.31 C
|
| 624 |
+
ATOM 568 O VAL A 73 19.400 -5.950 -12.700 1.00 82.31 O
|
| 625 |
+
ATOM 569 CG1 VAL A 73 16.384 -7.832 -11.977 1.00 82.31 C
|
| 626 |
+
ATOM 570 CG2 VAL A 73 16.090 -8.527 -14.333 1.00 82.31 C
|
| 627 |
+
ATOM 571 N SER A 74 17.655 -4.677 -12.084 1.00 93.00 N
|
| 628 |
+
ATOM 572 CA SER A 74 18.369 -3.956 -11.034 1.00 93.00 C
|
| 629 |
+
ATOM 573 C SER A 74 17.823 -4.288 -9.650 1.00 93.00 C
|
| 630 |
+
ATOM 574 CB SER A 74 18.377 -2.454 -11.316 1.00 93.00 C
|
| 631 |
+
ATOM 575 O SER A 74 16.638 -4.566 -9.474 1.00 93.00 O
|
| 632 |
+
ATOM 576 OG SER A 74 17.245 -1.792 -10.791 1.00 93.00 O
|
| 633 |
+
ATOM 577 N PHE A 75 18.693 -4.225 -8.639 1.00 95.88 N
|
| 634 |
+
ATOM 578 CA PHE A 75 18.302 -4.469 -7.249 1.00 95.88 C
|
| 635 |
+
ATOM 579 C PHE A 75 17.225 -3.485 -6.765 1.00 95.88 C
|
| 636 |
+
ATOM 580 CB PHE A 75 19.558 -4.387 -6.373 1.00 95.88 C
|
| 637 |
+
ATOM 581 O PHE A 75 16.320 -3.872 -6.034 1.00 95.88 O
|
| 638 |
+
ATOM 582 CG PHE A 75 19.314 -4.802 -4.938 1.00 95.88 C
|
| 639 |
+
ATOM 583 CD1 PHE A 75 19.014 -3.837 -3.956 1.00 95.88 C
|
| 640 |
+
ATOM 584 CD2 PHE A 75 19.351 -6.165 -4.592 1.00 95.88 C
|
| 641 |
+
ATOM 585 CE1 PHE A 75 18.754 -4.237 -2.634 1.00 95.88 C
|
| 642 |
+
ATOM 586 CE2 PHE A 75 19.094 -6.563 -3.268 1.00 95.88 C
|
| 643 |
+
ATOM 587 CZ PHE A 75 18.796 -5.600 -2.290 1.00 95.88 C
|
| 644 |
+
ATOM 588 N ILE A 76 17.294 -2.226 -7.212 1.00 96.56 N
|
| 645 |
+
ATOM 589 CA ILE A 76 16.311 -1.188 -6.870 1.00 96.56 C
|
| 646 |
+
ATOM 590 C ILE A 76 14.945 -1.530 -7.471 1.00 96.56 C
|
| 647 |
+
ATOM 591 CB ILE A 76 16.804 0.204 -7.333 1.00 96.56 C
|
| 648 |
+
ATOM 592 O ILE A 76 13.938 -1.409 -6.781 1.00 96.56 O
|
| 649 |
+
ATOM 593 CG1 ILE A 76 18.110 0.584 -6.595 1.00 96.56 C
|
| 650 |
+
ATOM 594 CG2 ILE A 76 15.733 1.285 -7.089 1.00 96.56 C
|
| 651 |
+
ATOM 595 CD1 ILE A 76 18.831 1.789 -7.208 1.00 96.56 C
|
| 652 |
+
ATOM 596 N MET A 77 14.903 -2.000 -8.723 1.00 95.94 N
|
| 653 |
+
ATOM 597 CA MET A 77 13.653 -2.439 -9.343 1.00 95.94 C
|
| 654 |
+
ATOM 598 C MET A 77 13.062 -3.645 -8.608 1.00 95.94 C
|
| 655 |
+
ATOM 599 CB MET A 77 13.872 -2.728 -10.834 1.00 95.94 C
|
| 656 |
+
ATOM 600 O MET A 77 11.885 -3.609 -8.270 1.00 95.94 O
|
| 657 |
+
ATOM 601 CG MET A 77 12.597 -3.229 -11.529 1.00 95.94 C
|
| 658 |
+
ATOM 602 SD MET A 77 11.127 -2.180 -11.350 1.00 95.94 S
|
| 659 |
+
ATOM 603 CE MET A 77 11.647 -0.774 -12.350 1.00 95.94 C
|
| 660 |
+
ATOM 604 N ILE A 78 13.871 -4.666 -8.291 1.00 96.75 N
|
| 661 |
+
ATOM 605 CA ILE A 78 13.417 -5.822 -7.492 1.00 96.75 C
|
| 662 |
+
ATOM 606 C ILE A 78 12.808 -5.344 -6.167 1.00 96.75 C
|
| 663 |
+
ATOM 607 CB ILE A 78 14.570 -6.824 -7.244 1.00 96.75 C
|
| 664 |
+
ATOM 608 O ILE A 78 11.685 -5.709 -5.837 1.00 96.75 O
|
| 665 |
+
ATOM 609 CG1 ILE A 78 15.031 -7.483 -8.565 1.00 96.75 C
|
| 666 |
+
ATOM 610 CG2 ILE A 78 14.140 -7.915 -6.241 1.00 96.75 C
|
| 667 |
+
ATOM 611 CD1 ILE A 78 16.354 -8.255 -8.426 1.00 96.75 C
|
| 668 |
+
ATOM 612 N HIS A 79 13.505 -4.465 -5.444 1.00 97.44 N
|
| 669 |
+
ATOM 613 CA HIS A 79 13.011 -3.925 -4.182 1.00 97.44 C
|
| 670 |
+
ATOM 614 C HIS A 79 11.703 -3.130 -4.338 1.00 97.44 C
|
| 671 |
+
ATOM 615 CB HIS A 79 14.106 -3.054 -3.561 1.00 97.44 C
|
| 672 |
+
ATOM 616 O HIS A 79 10.814 -3.239 -3.492 1.00 97.44 O
|
| 673 |
+
ATOM 617 CG HIS A 79 13.708 -2.514 -2.215 1.00 97.44 C
|
| 674 |
+
ATOM 618 CD2 HIS A 79 13.629 -1.198 -1.850 1.00 97.44 C
|
| 675 |
+
ATOM 619 ND1 HIS A 79 13.278 -3.262 -1.144 1.00 97.44 N
|
| 676 |
+
ATOM 620 CE1 HIS A 79 12.951 -2.414 -0.155 1.00 97.44 C
|
| 677 |
+
ATOM 621 NE2 HIS A 79 13.179 -1.146 -0.528 1.00 97.44 N
|
| 678 |
+
ATOM 622 N GLY A 80 11.558 -2.360 -5.420 1.00 97.50 N
|
| 679 |
+
ATOM 623 CA GLY A 80 10.308 -1.677 -5.753 1.00 97.50 C
|
| 680 |
+
ATOM 624 C GLY A 80 9.156 -2.652 -5.973 1.00 97.50 C
|
| 681 |
+
ATOM 625 O GLY A 80 8.096 -2.479 -5.377 1.00 97.50 O
|
| 682 |
+
ATOM 626 N GLN A 81 9.377 -3.711 -6.756 1.00 97.94 N
|
| 683 |
+
ATOM 627 CA GLN A 81 8.385 -4.765 -6.996 1.00 97.94 C
|
| 684 |
+
ATOM 628 C GLN A 81 7.973 -5.461 -5.690 1.00 97.94 C
|
| 685 |
+
ATOM 629 CB GLN A 81 8.945 -5.793 -7.995 1.00 97.94 C
|
| 686 |
+
ATOM 630 O GLN A 81 6.780 -5.582 -5.416 1.00 97.94 O
|
| 687 |
+
ATOM 631 CG GLN A 81 9.238 -5.218 -9.392 1.00 97.94 C
|
| 688 |
+
ATOM 632 CD GLN A 81 7.987 -4.876 -10.176 1.00 97.94 C
|
| 689 |
+
ATOM 633 NE2 GLN A 81 7.950 -3.753 -10.859 1.00 97.94 N
|
| 690 |
+
ATOM 634 OE1 GLN A 81 7.032 -5.628 -10.204 1.00 97.94 O
|
| 691 |
+
ATOM 635 N ASP A 82 8.937 -5.849 -4.849 1.00 98.44 N
|
| 692 |
+
ATOM 636 CA ASP A 82 8.668 -6.475 -3.547 1.00 98.44 C
|
| 693 |
+
ATOM 637 C ASP A 82 7.845 -5.552 -2.635 1.00 98.44 C
|
| 694 |
+
ATOM 638 CB ASP A 82 9.992 -6.820 -2.840 1.00 98.44 C
|
| 695 |
+
ATOM 639 O ASP A 82 6.860 -5.971 -2.017 1.00 98.44 O
|
| 696 |
+
ATOM 640 CG ASP A 82 10.749 -8.018 -3.425 1.00 98.44 C
|
| 697 |
+
ATOM 641 OD1 ASP A 82 10.115 -8.849 -4.113 1.00 98.44 O
|
| 698 |
+
ATOM 642 OD2 ASP A 82 11.958 -8.121 -3.112 1.00 98.44 O
|
| 699 |
+
ATOM 643 N THR A 83 8.223 -4.274 -2.568 1.00 98.25 N
|
| 700 |
+
ATOM 644 CA THR A 83 7.530 -3.269 -1.750 1.00 98.25 C
|
| 701 |
+
ATOM 645 C THR A 83 6.100 -3.064 -2.237 1.00 98.25 C
|
| 702 |
+
ATOM 646 CB THR A 83 8.287 -1.933 -1.743 1.00 98.25 C
|
| 703 |
+
ATOM 647 O THR A 83 5.172 -3.081 -1.429 1.00 98.25 O
|
| 704 |
+
ATOM 648 CG2 THR A 83 7.672 -0.922 -0.774 1.00 98.25 C
|
| 705 |
+
ATOM 649 OG1 THR A 83 9.609 -2.147 -1.305 1.00 98.25 O
|
| 706 |
+
ATOM 650 N LEU A 84 5.891 -2.932 -3.548 1.00 98.69 N
|
| 707 |
+
ATOM 651 CA LEU A 84 4.562 -2.764 -4.129 1.00 98.69 C
|
| 708 |
+
ATOM 652 C LEU A 84 3.674 -3.983 -3.874 1.00 98.69 C
|
| 709 |
+
ATOM 653 CB LEU A 84 4.716 -2.457 -5.625 1.00 98.69 C
|
| 710 |
+
ATOM 654 O LEU A 84 2.580 -3.836 -3.334 1.00 98.69 O
|
| 711 |
+
ATOM 655 CG LEU A 84 3.380 -2.342 -6.378 1.00 98.69 C
|
| 712 |
+
ATOM 656 CD1 LEU A 84 2.463 -1.270 -5.784 1.00 98.69 C
|
| 713 |
+
ATOM 657 CD2 LEU A 84 3.659 -2.001 -7.837 1.00 98.69 C
|
| 714 |
+
ATOM 658 N MET A 85 4.149 -5.188 -4.189 1.00 98.56 N
|
| 715 |
+
ATOM 659 CA MET A 85 3.338 -6.402 -4.057 1.00 98.56 C
|
| 716 |
+
ATOM 660 C MET A 85 2.970 -6.700 -2.599 1.00 98.56 C
|
| 717 |
+
ATOM 661 CB MET A 85 4.077 -7.596 -4.678 1.00 98.56 C
|
| 718 |
+
ATOM 662 O MET A 85 1.833 -7.075 -2.310 1.00 98.56 O
|
| 719 |
+
ATOM 663 CG MET A 85 4.217 -7.487 -6.203 1.00 98.56 C
|
| 720 |
+
ATOM 664 SD MET A 85 2.684 -7.249 -7.145 1.00 98.56 S
|
| 721 |
+
ATOM 665 CE MET A 85 1.749 -8.731 -6.687 1.00 98.56 C
|
| 722 |
+
ATOM 666 N THR A 86 3.895 -6.492 -1.657 1.00 98.75 N
|
| 723 |
+
ATOM 667 CA THR A 86 3.588 -6.647 -0.224 1.00 98.75 C
|
| 724 |
+
ATOM 668 C THR A 86 2.640 -5.563 0.292 1.00 98.75 C
|
| 725 |
+
ATOM 669 CB THR A 86 4.852 -6.685 0.644 1.00 98.75 C
|
| 726 |
+
ATOM 670 O THR A 86 1.806 -5.845 1.151 1.00 98.75 O
|
| 727 |
+
ATOM 671 CG2 THR A 86 5.696 -7.933 0.386 1.00 98.75 C
|
| 728 |
+
ATOM 672 OG1 THR A 86 5.673 -5.564 0.433 1.00 98.75 O
|
| 729 |
+
ATOM 673 N THR A 87 2.705 -4.349 -0.257 1.00 98.81 N
|
| 730 |
+
ATOM 674 CA THR A 87 1.776 -3.258 0.076 1.00 98.81 C
|
| 731 |
+
ATOM 675 C THR A 87 0.375 -3.514 -0.475 1.00 98.81 C
|
| 732 |
+
ATOM 676 CB THR A 87 2.317 -1.913 -0.421 1.00 98.81 C
|
| 733 |
+
ATOM 677 O THR A 87 -0.603 -3.272 0.223 1.00 98.81 O
|
| 734 |
+
ATOM 678 CG2 THR A 87 1.417 -0.744 -0.038 1.00 98.81 C
|
| 735 |
+
ATOM 679 OG1 THR A 87 3.574 -1.702 0.179 1.00 98.81 O
|
| 736 |
+
ATOM 680 N MET A 88 0.251 -4.079 -1.678 1.00 98.75 N
|
| 737 |
+
ATOM 681 CA MET A 88 -1.042 -4.501 -2.232 1.00 98.75 C
|
| 738 |
+
ATOM 682 C MET A 88 -1.685 -5.612 -1.397 1.00 98.75 C
|
| 739 |
+
ATOM 683 CB MET A 88 -0.863 -4.981 -3.673 1.00 98.75 C
|
| 740 |
+
ATOM 684 O MET A 88 -2.878 -5.555 -1.111 1.00 98.75 O
|
| 741 |
+
ATOM 685 CG MET A 88 -0.544 -3.826 -4.620 1.00 98.75 C
|
| 742 |
+
ATOM 686 SD MET A 88 -0.168 -4.357 -6.306 1.00 98.75 S
|
| 743 |
+
ATOM 687 CE MET A 88 -1.810 -4.903 -6.850 1.00 98.75 C
|
| 744 |
+
ATOM 688 N LEU A 89 -0.893 -6.583 -0.928 1.00 98.75 N
|
| 745 |
+
ATOM 689 CA LEU A 89 -1.395 -7.588 0.011 1.00 98.75 C
|
| 746 |
+
ATOM 690 C LEU A 89 -1.889 -6.942 1.315 1.00 98.75 C
|
| 747 |
+
ATOM 691 CB LEU A 89 -0.295 -8.629 0.275 1.00 98.75 C
|
| 748 |
+
ATOM 692 O LEU A 89 -2.955 -7.301 1.812 1.00 98.75 O
|
| 749 |
+
ATOM 693 CG LEU A 89 -0.689 -9.694 1.317 1.00 98.75 C
|
| 750 |
+
ATOM 694 CD1 LEU A 89 -1.888 -10.535 0.873 1.00 98.75 C
|
| 751 |
+
ATOM 695 CD2 LEU A 89 0.493 -10.634 1.557 1.00 98.75 C
|
| 752 |
+
ATOM 696 N LEU A 90 -1.137 -5.979 1.860 1.00 98.75 N
|
| 753 |
+
ATOM 697 CA LEU A 90 -1.557 -5.232 3.047 1.00 98.75 C
|
| 754 |
+
ATOM 698 C LEU A 90 -2.870 -4.476 2.792 1.00 98.75 C
|
| 755 |
+
ATOM 699 CB LEU A 90 -0.420 -4.293 3.491 1.00 98.75 C
|
| 756 |
+
ATOM 700 O LEU A 90 -3.763 -4.535 3.631 1.00 98.75 O
|
| 757 |
+
ATOM 701 CG LEU A 90 -0.761 -3.415 4.709 1.00 98.75 C
|
| 758 |
+
ATOM 702 CD1 LEU A 90 -1.053 -4.245 5.960 1.00 98.75 C
|
| 759 |
+
ATOM 703 CD2 LEU A 90 0.401 -2.471 5.012 1.00 98.75 C
|
| 760 |
+
ATOM 704 N TYR A 91 -3.015 -3.822 1.638 1.00 98.69 N
|
| 761 |
+
ATOM 705 CA TYR A 91 -4.232 -3.109 1.237 1.00 98.69 C
|
| 762 |
+
ATOM 706 C TYR A 91 -5.469 -4.011 1.260 1.00 98.69 C
|
| 763 |
+
ATOM 707 CB TYR A 91 -4.027 -2.520 -0.164 1.00 98.69 C
|
| 764 |
+
ATOM 708 O TYR A 91 -6.497 -3.645 1.839 1.00 98.69 O
|
| 765 |
+
ATOM 709 CG TYR A 91 -5.278 -1.932 -0.777 1.00 98.69 C
|
| 766 |
+
ATOM 710 CD1 TYR A 91 -6.031 -2.678 -1.704 1.00 98.69 C
|
| 767 |
+
ATOM 711 CD2 TYR A 91 -5.689 -0.640 -0.415 1.00 98.69 C
|
| 768 |
+
ATOM 712 CE1 TYR A 91 -7.180 -2.113 -2.285 1.00 98.69 C
|
| 769 |
+
ATOM 713 CE2 TYR A 91 -6.855 -0.085 -0.961 1.00 98.69 C
|
| 770 |
+
ATOM 714 OH TYR A 91 -8.728 -0.281 -2.438 1.00 98.69 O
|
| 771 |
+
ATOM 715 CZ TYR A 91 -7.588 -0.811 -1.919 1.00 98.69 C
|
| 772 |
+
ATOM 716 N ASP A 92 -5.357 -5.212 0.688 1.00 98.25 N
|
| 773 |
+
ATOM 717 CA ASP A 92 -6.447 -6.186 0.687 1.00 98.25 C
|
| 774 |
+
ATOM 718 C ASP A 92 -6.807 -6.628 2.112 1.00 98.25 C
|
| 775 |
+
ATOM 719 CB ASP A 92 -6.064 -7.398 -0.177 1.00 98.25 C
|
| 776 |
+
ATOM 720 O ASP A 92 -7.984 -6.775 2.440 1.00 98.25 O
|
| 777 |
+
ATOM 721 CG ASP A 92 -6.064 -7.110 -1.684 1.00 98.25 C
|
| 778 |
+
ATOM 722 OD1 ASP A 92 -6.756 -6.151 -2.106 1.00 98.25 O
|
| 779 |
+
ATOM 723 OD2 ASP A 92 -5.437 -7.914 -2.409 1.00 98.25 O
|
| 780 |
+
ATOM 724 N GLN A 93 -5.807 -6.791 2.983 1.00 98.56 N
|
| 781 |
+
ATOM 725 CA GLN A 93 -5.997 -7.218 4.370 1.00 98.56 C
|
| 782 |
+
ATOM 726 C GLN A 93 -6.569 -6.122 5.277 1.00 98.56 C
|
| 783 |
+
ATOM 727 CB GLN A 93 -4.662 -7.723 4.928 1.00 98.56 C
|
| 784 |
+
ATOM 728 O GLN A 93 -7.411 -6.416 6.128 1.00 98.56 O
|
| 785 |
+
ATOM 729 CG GLN A 93 -4.251 -9.064 4.310 1.00 98.56 C
|
| 786 |
+
ATOM 730 CD GLN A 93 -2.919 -9.571 4.850 1.00 98.56 C
|
| 787 |
+
ATOM 731 NE2 GLN A 93 -2.760 -10.869 4.984 1.00 98.56 N
|
| 788 |
+
ATOM 732 OE1 GLN A 93 -1.998 -8.844 5.185 1.00 98.56 O
|
| 789 |
+
ATOM 733 N VAL A 94 -6.143 -4.865 5.112 1.00 98.50 N
|
| 790 |
+
ATOM 734 CA VAL A 94 -6.539 -3.741 5.980 1.00 98.50 C
|
| 791 |
+
ATOM 735 C VAL A 94 -8.052 -3.567 6.008 1.00 98.50 C
|
| 792 |
+
ATOM 736 CB VAL A 94 -5.837 -2.436 5.554 1.00 98.50 C
|
| 793 |
+
ATOM 737 O VAL A 94 -8.613 -3.359 7.078 1.00 98.50 O
|
| 794 |
+
ATOM 738 CG1 VAL A 94 -6.410 -1.189 6.239 1.00 98.50 C
|
| 795 |
+
ATOM 739 CG2 VAL A 94 -4.333 -2.500 5.862 1.00 98.50 C
|
| 796 |
+
ATOM 740 N LYS A 95 -8.735 -3.741 4.873 1.00 95.94 N
|
| 797 |
+
ATOM 741 CA LYS A 95 -10.202 -3.646 4.802 1.00 95.94 C
|
| 798 |
+
ATOM 742 C LYS A 95 -10.888 -4.639 5.740 1.00 95.94 C
|
| 799 |
+
ATOM 743 CB LYS A 95 -10.661 -3.875 3.360 1.00 95.94 C
|
| 800 |
+
ATOM 744 O LYS A 95 -11.765 -4.247 6.504 1.00 95.94 O
|
| 801 |
+
ATOM 745 CG LYS A 95 -10.153 -2.773 2.423 1.00 95.94 C
|
| 802 |
+
ATOM 746 CD LYS A 95 -10.524 -3.126 0.985 1.00 95.94 C
|
| 803 |
+
ATOM 747 CE LYS A 95 -9.937 -2.080 0.044 1.00 95.94 C
|
| 804 |
+
ATOM 748 NZ LYS A 95 -10.142 -2.476 -1.366 1.00 95.94 N
|
| 805 |
+
ATOM 749 N PHE A 96 -10.435 -5.896 5.741 1.00 98.31 N
|
| 806 |
+
ATOM 750 CA PHE A 96 -10.957 -6.912 6.655 1.00 98.31 C
|
| 807 |
+
ATOM 751 C PHE A 96 -10.659 -6.566 8.115 1.00 98.31 C
|
| 808 |
+
ATOM 752 CB PHE A 96 -10.383 -8.293 6.314 1.00 98.31 C
|
| 809 |
+
ATOM 753 O PHE A 96 -11.524 -6.740 8.965 1.00 98.31 O
|
| 810 |
+
ATOM 754 CG PHE A 96 -10.817 -8.832 4.967 1.00 98.31 C
|
| 811 |
+
ATOM 755 CD1 PHE A 96 -12.118 -9.339 4.799 1.00 98.31 C
|
| 812 |
+
ATOM 756 CD2 PHE A 96 -9.927 -8.822 3.880 1.00 98.31 C
|
| 813 |
+
ATOM 757 CE1 PHE A 96 -12.526 -9.834 3.547 1.00 98.31 C
|
| 814 |
+
ATOM 758 CE2 PHE A 96 -10.336 -9.304 2.625 1.00 98.31 C
|
| 815 |
+
ATOM 759 CZ PHE A 96 -11.635 -9.814 2.459 1.00 98.31 C
|
| 816 |
+
ATOM 760 N PHE A 97 -9.467 -6.044 8.417 1.00 98.50 N
|
| 817 |
+
ATOM 761 CA PHE A 97 -9.126 -5.638 9.781 1.00 98.50 C
|
| 818 |
+
ATOM 762 C PHE A 97 -9.964 -4.461 10.282 1.00 98.50 C
|
| 819 |
+
ATOM 763 CB PHE A 97 -7.634 -5.307 9.878 1.00 98.50 C
|
| 820 |
+
ATOM 764 O PHE A 97 -10.380 -4.477 11.437 1.00 98.50 O
|
| 821 |
+
ATOM 765 CG PHE A 97 -6.723 -6.516 9.840 1.00 98.50 C
|
| 822 |
+
ATOM 766 CD1 PHE A 97 -6.845 -7.512 10.828 1.00 98.50 C
|
| 823 |
+
ATOM 767 CD2 PHE A 97 -5.727 -6.633 8.853 1.00 98.50 C
|
| 824 |
+
ATOM 768 CE1 PHE A 97 -5.993 -8.629 10.815 1.00 98.50 C
|
| 825 |
+
ATOM 769 CE2 PHE A 97 -4.862 -7.742 8.851 1.00 98.50 C
|
| 826 |
+
ATOM 770 CZ PHE A 97 -5.002 -8.745 9.825 1.00 98.50 C
|
| 827 |
+
ATOM 771 N ILE A 98 -10.244 -3.465 9.437 1.00 98.56 N
|
| 828 |
+
ATOM 772 CA ILE A 98 -11.130 -2.346 9.785 1.00 98.56 C
|
| 829 |
+
ATOM 773 C ILE A 98 -12.526 -2.874 10.123 1.00 98.56 C
|
| 830 |
+
ATOM 774 CB ILE A 98 -11.169 -1.299 8.647 1.00 98.56 C
|
| 831 |
+
ATOM 775 O ILE A 98 -13.069 -2.533 11.173 1.00 98.56 O
|
| 832 |
+
ATOM 776 CG1 ILE A 98 -9.792 -0.608 8.522 1.00 98.56 C
|
| 833 |
+
ATOM 777 CG2 ILE A 98 -12.263 -0.240 8.895 1.00 98.56 C
|
| 834 |
+
ATOM 778 CD1 ILE A 98 -9.658 0.333 7.323 1.00 98.56 C
|
| 835 |
+
ATOM 779 N ASP A 99 -13.080 -3.745 9.278 1.00 98.12 N
|
| 836 |
+
ATOM 780 CA ASP A 99 -14.399 -4.333 9.511 1.00 98.12 C
|
| 837 |
+
ATOM 781 C ASP A 99 -14.421 -5.197 10.791 1.00 98.12 C
|
| 838 |
+
ATOM 782 CB ASP A 99 -14.821 -5.157 8.283 1.00 98.12 C
|
| 839 |
+
ATOM 783 O ASP A 99 -15.390 -5.159 11.553 1.00 98.12 O
|
| 840 |
+
ATOM 784 CG ASP A 99 -15.089 -4.344 7.002 1.00 98.12 C
|
| 841 |
+
ATOM 785 OD1 ASP A 99 -15.264 -3.096 7.062 1.00 98.12 O
|
| 842 |
+
ATOM 786 OD2 ASP A 99 -15.198 -5.006 5.945 1.00 98.12 O
|
| 843 |
+
ATOM 787 N GLU A 100 -13.349 -5.944 11.075 1.00 98.50 N
|
| 844 |
+
ATOM 788 CA GLU A 100 -13.188 -6.706 12.321 1.00 98.50 C
|
| 845 |
+
ATOM 789 C GLU A 100 -13.131 -5.787 13.552 1.00 98.50 C
|
| 846 |
+
ATOM 790 CB GLU A 100 -11.937 -7.601 12.253 1.00 98.50 C
|
| 847 |
+
ATOM 791 O GLU A 100 -13.866 -6.025 14.512 1.00 98.50 O
|
| 848 |
+
ATOM 792 CG GLU A 100 -12.109 -8.859 11.379 1.00 98.50 C
|
| 849 |
+
ATOM 793 CD GLU A 100 -12.951 -9.957 12.052 1.00 98.50 C
|
| 850 |
+
ATOM 794 OE1 GLU A 100 -13.966 -10.401 11.453 1.00 98.50 O
|
| 851 |
+
ATOM 795 OE2 GLU A 100 -12.610 -10.359 13.185 1.00 98.50 O
|
| 852 |
+
ATOM 796 N TYR A 101 -12.342 -4.706 13.526 1.00 98.31 N
|
| 853 |
+
ATOM 797 CA TYR A 101 -12.304 -3.734 14.626 1.00 98.31 C
|
| 854 |
+
ATOM 798 C TYR A 101 -13.661 -3.055 14.843 1.00 98.31 C
|
| 855 |
+
ATOM 799 CB TYR A 101 -11.211 -2.679 14.399 1.00 98.31 C
|
| 856 |
+
ATOM 800 O TYR A 101 -14.079 -2.874 15.986 1.00 98.31 O
|
| 857 |
+
ATOM 801 CG TYR A 101 -9.798 -3.126 14.716 1.00 98.31 C
|
| 858 |
+
ATOM 802 CD1 TYR A 101 -9.478 -3.545 16.023 1.00 98.31 C
|
| 859 |
+
ATOM 803 CD2 TYR A 101 -8.791 -3.054 13.736 1.00 98.31 C
|
| 860 |
+
ATOM 804 CE1 TYR A 101 -8.160 -3.917 16.343 1.00 98.31 C
|
| 861 |
+
ATOM 805 CE2 TYR A 101 -7.469 -3.418 14.052 1.00 98.31 C
|
| 862 |
+
ATOM 806 OH TYR A 101 -5.874 -4.186 15.668 1.00 98.31 O
|
| 863 |
+
ATOM 807 CZ TYR A 101 -7.154 -3.852 15.357 1.00 98.31 C
|
| 864 |
+
ATOM 808 N GLU A 102 -14.401 -2.749 13.775 1.00 97.75 N
|
| 865 |
+
ATOM 809 CA GLU A 102 -15.742 -2.168 13.879 1.00 97.75 C
|
| 866 |
+
ATOM 810 C GLU A 102 -16.743 -3.148 14.518 1.00 97.75 C
|
| 867 |
+
ATOM 811 CB GLU A 102 -16.201 -1.712 12.483 1.00 97.75 C
|
| 868 |
+
ATOM 812 O GLU A 102 -17.590 -2.761 15.329 1.00 97.75 O
|
| 869 |
+
ATOM 813 CG GLU A 102 -17.351 -0.704 12.580 1.00 97.75 C
|
| 870 |
+
ATOM 814 CD GLU A 102 -17.980 -0.350 11.224 1.00 97.75 C
|
| 871 |
+
ATOM 815 OE1 GLU A 102 -19.231 -0.204 11.242 1.00 97.75 O
|
| 872 |
+
ATOM 816 OE2 GLU A 102 -17.278 -0.299 10.184 1.00 97.75 O
|
| 873 |
+
ATOM 817 N ARG A 103 -16.638 -4.445 14.201 1.00 97.94 N
|
| 874 |
+
ATOM 818 CA ARG A 103 -17.444 -5.497 14.844 1.00 97.94 C
|
| 875 |
+
ATOM 819 C ARG A 103 -17.079 -5.672 16.315 1.00 97.94 C
|
| 876 |
+
ATOM 820 CB ARG A 103 -17.270 -6.825 14.100 1.00 97.94 C
|
| 877 |
+
ATOM 821 O ARG A 103 -17.986 -5.806 17.135 1.00 97.94 O
|
| 878 |
+
ATOM 822 CG ARG A 103 -17.944 -6.815 12.722 1.00 97.94 C
|
| 879 |
+
ATOM 823 CD ARG A 103 -17.564 -8.073 11.936 1.00 97.94 C
|
| 880 |
+
ATOM 824 NE ARG A 103 -18.208 -9.270 12.508 1.00 97.94 N
|
| 881 |
+
ATOM 825 NH1 ARG A 103 -16.754 -10.858 11.669 1.00 97.94 N
|
| 882 |
+
ATOM 826 NH2 ARG A 103 -18.532 -11.484 12.859 1.00 97.94 N
|
| 883 |
+
ATOM 827 CZ ARG A 103 -17.823 -10.521 12.335 1.00 97.94 C
|
| 884 |
+
ATOM 828 N ILE A 104 -15.787 -5.659 16.644 1.00 97.12 N
|
| 885 |
+
ATOM 829 CA ILE A 104 -15.295 -5.741 18.026 1.00 97.12 C
|
| 886 |
+
ATOM 830 C ILE A 104 -15.841 -4.566 18.841 1.00 97.12 C
|
| 887 |
+
ATOM 831 CB ILE A 104 -13.751 -5.824 18.052 1.00 97.12 C
|
| 888 |
+
ATOM 832 O ILE A 104 -16.448 -4.802 19.882 1.00 97.12 O
|
| 889 |
+
ATOM 833 CG1 ILE A 104 -13.291 -7.204 17.526 1.00 97.12 C
|
| 890 |
+
ATOM 834 CG2 ILE A 104 -13.203 -5.597 19.474 1.00 97.12 C
|
| 891 |
+
ATOM 835 CD1 ILE A 104 -11.802 -7.264 17.162 1.00 97.12 C
|
| 892 |
+
ATOM 836 N ARG A 105 -15.755 -3.337 18.318 1.00 95.94 N
|
| 893 |
+
ATOM 837 CA ARG A 105 -16.294 -2.130 18.962 1.00 95.94 C
|
| 894 |
+
ATOM 838 C ARG A 105 -17.781 -2.267 19.299 1.00 95.94 C
|
| 895 |
+
ATOM 839 CB ARG A 105 -16.046 -0.930 18.032 1.00 95.94 C
|
| 896 |
+
ATOM 840 O ARG A 105 -18.184 -2.053 20.436 1.00 95.94 O
|
| 897 |
+
ATOM 841 CG ARG A 105 -16.372 0.419 18.684 1.00 95.94 C
|
| 898 |
+
ATOM 842 CD ARG A 105 -15.236 0.858 19.602 1.00 95.94 C
|
| 899 |
+
ATOM 843 NE ARG A 105 -15.605 2.084 20.321 1.00 95.94 N
|
| 900 |
+
ATOM 844 NH1 ARG A 105 -13.536 2.538 21.220 1.00 95.94 N
|
| 901 |
+
ATOM 845 NH2 ARG A 105 -15.318 3.707 21.878 1.00 95.94 N
|
| 902 |
+
ATOM 846 CZ ARG A 105 -14.816 2.770 21.127 1.00 95.94 C
|
| 903 |
+
ATOM 847 N LYS A 106 -18.595 -2.715 18.336 1.00 96.62 N
|
| 904 |
+
ATOM 848 CA LYS A 106 -20.039 -2.948 18.544 1.00 96.62 C
|
| 905 |
+
ATOM 849 C LYS A 106 -20.314 -3.980 19.642 1.00 96.62 C
|
| 906 |
+
ATOM 850 CB LYS A 106 -20.687 -3.396 17.224 1.00 96.62 C
|
| 907 |
+
ATOM 851 O LYS A 106 -21.301 -3.863 20.366 1.00 96.62 O
|
| 908 |
+
ATOM 852 CG LYS A 106 -20.795 -2.236 16.227 1.00 96.62 C
|
| 909 |
+
ATOM 853 CD LYS A 106 -21.181 -2.707 14.817 1.00 96.62 C
|
| 910 |
+
ATOM 854 CE LYS A 106 -21.112 -1.481 13.896 1.00 96.62 C
|
| 911 |
+
ATOM 855 NZ LYS A 106 -21.061 -1.817 12.453 1.00 96.62 N
|
| 912 |
+
ATOM 856 N ILE A 107 -19.469 -5.007 19.759 1.00 96.88 N
|
| 913 |
+
ATOM 857 CA ILE A 107 -19.577 -6.005 20.829 1.00 96.88 C
|
| 914 |
+
ATOM 858 C ILE A 107 -19.204 -5.377 22.173 1.00 96.88 C
|
| 915 |
+
ATOM 859 CB ILE A 107 -18.740 -7.265 20.511 1.00 96.88 C
|
| 916 |
+
ATOM 860 O ILE A 107 -19.968 -5.541 23.119 1.00 96.88 O
|
| 917 |
+
ATOM 861 CG1 ILE A 107 -19.349 -8.011 19.301 1.00 96.88 C
|
| 918 |
+
ATOM 862 CG2 ILE A 107 -18.667 -8.210 21.728 1.00 96.88 C
|
| 919 |
+
ATOM 863 CD1 ILE A 107 -18.420 -9.074 18.700 1.00 96.88 C
|
| 920 |
+
ATOM 864 N GLU A 108 -18.085 -4.651 22.254 1.00 95.25 N
|
| 921 |
+
ATOM 865 CA GLU A 108 -17.607 -3.970 23.468 1.00 95.25 C
|
| 922 |
+
ATOM 866 C GLU A 108 -18.648 -2.994 24.033 1.00 95.25 C
|
| 923 |
+
ATOM 867 CB GLU A 108 -16.295 -3.227 23.175 1.00 95.25 C
|
| 924 |
+
ATOM 868 O GLU A 108 -18.908 -3.008 25.238 1.00 95.25 O
|
| 925 |
+
ATOM 869 CG GLU A 108 -15.119 -4.193 22.961 1.00 95.25 C
|
| 926 |
+
ATOM 870 CD GLU A 108 -13.836 -3.476 22.519 1.00 95.25 C
|
| 927 |
+
ATOM 871 OE1 GLU A 108 -12.751 -3.925 22.950 1.00 95.25 O
|
| 928 |
+
ATOM 872 OE2 GLU A 108 -13.930 -2.491 21.749 1.00 95.25 O
|
| 929 |
+
ATOM 873 N GLU A 109 -19.308 -2.228 23.161 1.00 94.75 N
|
| 930 |
+
ATOM 874 CA GLU A 109 -20.429 -1.349 23.511 1.00 94.75 C
|
| 931 |
+
ATOM 875 C GLU A 109 -21.620 -2.134 24.085 1.00 94.75 C
|
| 932 |
+
ATOM 876 CB GLU A 109 -20.877 -0.577 22.257 1.00 94.75 C
|
| 933 |
+
ATOM 877 O GLU A 109 -22.236 -1.715 25.065 1.00 94.75 O
|
| 934 |
+
ATOM 878 CG GLU A 109 -19.876 0.513 21.840 1.00 94.75 C
|
| 935 |
+
ATOM 879 CD GLU A 109 -20.205 1.172 20.488 1.00 94.75 C
|
| 936 |
+
ATOM 880 OE1 GLU A 109 -19.408 2.050 20.077 1.00 94.75 O
|
| 937 |
+
ATOM 881 OE2 GLU A 109 -21.234 0.810 19.865 1.00 94.75 O
|
| 938 |
+
ATOM 882 N HIS A 110 -21.934 -3.307 23.524 1.00 95.31 N
|
| 939 |
+
ATOM 883 CA HIS A 110 -23.048 -4.138 23.989 1.00 95.31 C
|
| 940 |
+
ATOM 884 C HIS A 110 -22.797 -4.783 25.362 1.00 95.31 C
|
| 941 |
+
ATOM 885 CB HIS A 110 -23.357 -5.208 22.932 1.00 95.31 C
|
| 942 |
+
ATOM 886 O HIS A 110 -23.748 -5.057 26.095 1.00 95.31 O
|
| 943 |
+
ATOM 887 CG HIS A 110 -24.730 -5.808 23.096 1.00 95.31 C
|
| 944 |
+
ATOM 888 CD2 HIS A 110 -25.052 -7.033 23.617 1.00 95.31 C
|
| 945 |
+
ATOM 889 ND1 HIS A 110 -25.908 -5.190 22.755 1.00 95.31 N
|
| 946 |
+
ATOM 890 CE1 HIS A 110 -26.917 -6.022 23.056 1.00 95.31 C
|
| 947 |
+
ATOM 891 NE2 HIS A 110 -26.448 -7.169 23.572 1.00 95.31 N
|
| 948 |
+
ATOM 892 N ILE A 111 -21.531 -5.032 25.714 1.00 95.94 N
|
| 949 |
+
ATOM 893 CA ILE A 111 -21.133 -5.654 26.989 1.00 95.94 C
|
| 950 |
+
ATOM 894 C ILE A 111 -20.604 -4.651 28.027 1.00 95.94 C
|
| 951 |
+
ATOM 895 CB ILE A 111 -20.190 -6.857 26.764 1.00 95.94 C
|
| 952 |
+
ATOM 896 O ILE A 111 -20.225 -5.064 29.123 1.00 95.94 O
|
| 953 |
+
ATOM 897 CG1 ILE A 111 -18.840 -6.419 26.165 1.00 95.94 C
|
| 954 |
+
ATOM 898 CG2 ILE A 111 -20.895 -7.916 25.893 1.00 95.94 C
|
| 955 |
+
ATOM 899 CD1 ILE A 111 -17.843 -7.561 25.938 1.00 95.94 C
|
| 956 |
+
ATOM 900 N GLY A 112 -20.612 -3.350 27.715 1.00 91.62 N
|
| 957 |
+
ATOM 901 CA GLY A 112 -20.260 -2.273 28.645 1.00 91.62 C
|
| 958 |
+
ATOM 902 C GLY A 112 -18.768 -2.178 28.975 1.00 91.62 C
|
| 959 |
+
ATOM 903 O GLY A 112 -18.418 -1.829 30.101 1.00 91.62 O
|
| 960 |
+
ATOM 904 N LEU A 113 -17.891 -2.530 28.029 1.00 85.75 N
|
| 961 |
+
ATOM 905 CA LEU A 113 -16.432 -2.427 28.190 1.00 85.75 C
|
| 962 |
+
ATOM 906 C LEU A 113 -15.848 -1.076 27.736 1.00 85.75 C
|
| 963 |
+
ATOM 907 CB LEU A 113 -15.743 -3.616 27.491 1.00 85.75 C
|
| 964 |
+
ATOM 908 O LEU A 113 -14.630 -0.899 27.801 1.00 85.75 O
|
| 965 |
+
ATOM 909 CG LEU A 113 -15.888 -4.967 28.212 1.00 85.75 C
|
| 966 |
+
ATOM 910 CD1 LEU A 113 -15.156 -6.037 27.401 1.00 85.75 C
|
| 967 |
+
ATOM 911 CD2 LEU A 113 -15.288 -4.983 29.621 1.00 85.75 C
|
| 968 |
+
ATOM 912 N GLN A 114 -16.691 -0.134 27.304 1.00 63.09 N
|
| 969 |
+
ATOM 913 CA GLN A 114 -16.309 1.199 26.823 1.00 63.09 C
|
| 970 |
+
ATOM 914 C GLN A 114 -17.167 2.303 27.422 1.00 63.09 C
|
| 971 |
+
ATOM 915 CB GLN A 114 -16.368 1.225 25.294 1.00 63.09 C
|
| 972 |
+
ATOM 916 O GLN A 114 -18.384 2.074 27.603 1.00 63.09 O
|
| 973 |
+
ATOM 917 CG GLN A 114 -15.102 0.568 24.738 1.00 63.09 C
|
| 974 |
+
ATOM 918 CD GLN A 114 -15.129 0.399 23.237 1.00 63.09 C
|
| 975 |
+
ATOM 919 NE2 GLN A 114 -14.002 0.021 22.676 1.00 63.09 N
|
| 976 |
+
ATOM 920 OE1 GLN A 114 -16.138 0.582 22.578 1.00 63.09 O
|
| 977 |
+
ATOM 921 OXT GLN A 114 -16.557 3.361 27.686 1.00 63.09 O
|
| 978 |
+
TER 922 GLN A 114
|
| 979 |
+
ENDMDL
|
| 980 |
+
END
|
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