data_2kl8_aa.cif # _entry.id 2kl8_aa.cif _entry.author rib7 _entry.date 2026-04-18 _entry.time 15:26:27 # _entity.id 0 _entity.type polymer _entity.pdbx_description . # _entity_poly.entity_id 0 _entity_poly.type polypeptide(L) _entity_poly.nstd_linkage no _entity_poly.nstd_monomer no _entity_poly.pdbx_seq_one_letter_code MEMDIRFKFAGTVTYTLDGNDLEIRITGVPEQVRKELAKEAERLAKEFNITVTYTIRLE _entity_poly.pdbx_seq_one_letter_code_can MEMDIRFKFAGTVTYTLDGNDLEIRITGVPEQVRKELAKEAERLAKEFNITVTYTIRLE _entity_poly.pdbx_strand_id A _entity_poly.pdbx_target_identifier ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.hetero _entity_poly_seq.mon_id _entity_poly_seq.num 0 n MET 1 0 n GLU 2 0 n MET 3 0 n ASP 4 0 n ILE 5 0 n ARG 6 0 n PHE 7 0 n LYS 28 0 n PHE 29 0 n ALA 30 0 n GLY 31 0 n THR 32 0 n VAL 33 0 n THR 34 0 n TYR 35 0 n THR 36 0 n LEU 37 0 n ASP 38 0 n GLY 39 0 n ASN 40 0 n ASP 41 0 n LEU 42 0 n GLU 43 0 n ILE 44 0 n ARG 45 0 n ILE 46 0 n THR 47 0 n GLY 48 0 n VAL 49 0 n PRO 50 0 n GLU 51 0 n GLN 52 0 n VAL 53 0 n ARG 54 0 n LYS 55 0 n GLU 56 0 n LEU 57 0 n ALA 58 0 n LYS 59 0 n GLU 60 0 n ALA 61 0 n GLU 62 0 n ARG 63 0 n LEU 64 0 n ALA 65 0 n LYS 66 0 n GLU 67 0 n PHE 68 0 n ASN 69 0 n ILE 70 0 n THR 71 0 n VAL 72 0 n THR 73 0 n TYR 74 0 n THR 75 0 n ILE 76 0 n ARG 77 0 n LEU 78 0 n GLU 79 # loop_ _chem_comp_bond.pdbx_ordinal _chem_comp_bond.comp_id _chem_comp_bond.atom_id_1 _chem_comp_bond.atom_id_2 _chem_comp_bond.value_order _chem_comp_bond.pdbx_aromatic_flag _chem_comp_bond.pdbx_stereo_config 1 MET N CA SING N ? 2 MET CA C SING N ? 3 MET CA CB SING N ? 4 MET C O DOUB N ? 5 MET CB CG SING N ? 6 MET CG SD SING N ? 7 MET SD CE SING N ? 8 GLU N CA SING N ? 9 GLU CA C SING N ? 10 GLU CA CB SING N ? 11 GLU C O DOUB N ? 12 GLU CB CG SING N ? 13 GLU CG CD SING N ? 14 GLU CD OE1 DOUB N ? 15 GLU CD OE2 SING N ? 16 ASP N CA SING N ? 17 ASP CA C SING N ? 18 ASP CA CB SING N ? 19 ASP C O DOUB N ? 20 ASP CB CG SING N ? 21 ASP CG OD1 DOUB N ? 22 ASP CG OD2 SING N ? 23 ILE N CA SING N ? 24 ILE CA C SING N ? 25 ILE CA CB SING N ? 26 ILE C O DOUB N ? 27 ILE CB CG1 SING N ? 28 ILE CB CG2 SING N ? 29 ILE CG1 CD1 SING N ? 30 ARG N CA SING N ? 31 ARG CA C SING N ? 32 ARG CA CB SING N ? 33 ARG C O DOUB N ? 34 ARG CB CG SING N ? 35 ARG CG CD SING N ? 36 ARG CD NE SING N ? 37 ARG NE CZ SING N ? 38 ARG CZ NH1 SING N ? 39 ARG CZ NH2 DOUB N ? 40 PHE N CA SING N ? 41 PHE CA C SING N ? 42 PHE CA CB SING N ? 43 PHE C O DOUB N ? 44 PHE CB CG SING N ? 45 PHE CG CD1 DOUB Y ? 46 PHE CG CD2 SING Y ? 47 PHE CD1 CE1 SING Y ? 48 PHE CD2 CE2 DOUB Y ? 49 PHE CE1 CZ DOUB Y ? 50 PHE CE2 CZ SING Y ? 51 LYS N CA SING N ? 52 LYS CA C SING N ? 53 LYS CA CB SING N ? 54 LYS C O DOUB N ? 55 LYS CB CG SING N ? 56 LYS CG CD SING N ? 57 LYS CD CE SING N ? 58 LYS CE NZ SING N ? 59 ALA N CA SING N ? 60 ALA CA C SING N ? 61 ALA CA CB SING N ? 62 ALA C O DOUB N ? 63 GLY N CA SING N ? 64 GLY CA C SING N ? 65 GLY C O DOUB N ? 66 THR N CA SING N ? 67 THR CA C SING N ? 68 THR CA CB SING N ? 69 THR C O DOUB N ? 70 THR CB OG1 SING N ? 71 THR CB CG2 SING N ? 72 VAL N CA SING N ? 73 VAL CA C SING N ? 74 VAL CA CB SING N ? 75 VAL C O DOUB N ? 76 VAL CB CG1 SING N ? 77 VAL CB CG2 SING N ? 78 TYR N CA SING N ? 79 TYR CA C SING N ? 80 TYR CA CB SING N ? 81 TYR C O DOUB N ? 82 TYR CB CG SING N ? 83 TYR CG CD1 DOUB Y ? 84 TYR CG CD2 SING Y ? 85 TYR CD1 CE1 SING Y ? 86 TYR CD2 CE2 DOUB Y ? 87 TYR CE1 CZ DOUB Y ? 88 TYR CE2 CZ SING Y ? 89 TYR CZ OH SING N ? 90 LEU N CA SING N ? 91 LEU CA C SING N ? 92 LEU CA CB SING N ? 93 LEU C O DOUB N ? 94 LEU CB CG SING N ? 95 LEU CG CD1 SING N ? 96 LEU CG CD2 SING N ? 97 ASN N CA SING N ? 98 ASN CA C SING N ? 99 ASN CA CB SING N ? 100 ASN C O DOUB N ? 101 ASN CB CG SING N ? 102 ASN CG OD1 DOUB N ? 103 ASN CG ND2 SING N ? 104 PRO N CA SING N ? 105 PRO N CD SING N ? 106 PRO CA C SING N ? 107 PRO CA CB SING N ? 108 PRO C O DOUB N ? 109 PRO CB CG SING N ? 110 PRO CG CD SING N ? 111 GLN N CA SING N ? 112 GLN CA C SING N ? 113 GLN CA CB SING N ? 114 GLN C O DOUB N ? 115 GLN CB CG SING N ? 116 GLN CG CD SING N ? 117 GLN CD OE1 DOUB N ? 118 GLN CD NE2 SING N ? # loop_ _atom_site.group_PDB _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.id _atom_site.B_iso_or_equiv _atom_site.occupancy _atom_site.pdbx_formal_charge _atom_site.rcsb_res_id _atom_site.rcsb_chain_id _atom_site.atom_array_index _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.pdbx_PDB_model_num ATOM N N . MET A 0 1 . 1 MET A N 1 55.12 1.0 ? 1 A 0 -1.464 11.832 5.917 1 ATOM C CA . MET A 0 1 . 1 MET A CA 2 61.21 1.0 ? 1 A 1 -2.225 10.594 5.589 1 ATOM C C . MET A 0 1 . 1 MET A C 3 13.32 1.0 ? 1 A 2 -1.271 9.422 5.331 1 ATOM O O . MET A 0 1 . 1 MET A O 4 44.44 1.0 ? 1 A 3 -0.382 9.507 4.482 1 ATOM C CB . MET A 0 1 . 1 MET A CB 5 75.25 1.0 ? 1 A 4 -3.125 10.817 4.361 1 ATOM C CG . MET A 0 1 . 1 MET A CG 6 54.41 1.0 ? 1 A 5 -4.005 9.616 4.015 1 ATOM S SD . MET A 0 1 . 1 MET A SD 7 71.24 1.0 ? 1 A 6 -5.053 9.898 2.568 1 ATOM C CE . MET A 0 1 . 1 MET A CE 8 72.4 1.0 ? 1 A 7 -3.819 10.128 1.289 1 ATOM N N . GLU A 0 2 . 2 GLU A N 9 63.43 1.0 ? 2 A 8 -1.451 8.338 6.081 1 ATOM C CA . GLU A 0 2 . 2 GLU A CA 10 72.25 1.0 ? 2 A 9 -0.623 7.138 5.932 1 ATOM C C . GLU A 0 2 . 2 GLU A C 11 43.4 1.0 ? 2 A 10 -1.399 6.029 5.206 1 ATOM O O . GLU A 0 2 . 2 GLU A O 12 61.13 1.0 ? 2 A 11 -2.621 6.103 5.064 1 ATOM C CB . GLU A 0 2 . 2 GLU A CB 13 71.34 1.0 ? 2 A 12 -0.16 6.633 7.311 1 ATOM C CG . GLU A 0 2 . 2 GLU A CG 14 32.34 1.0 ? 2 A 13 0.72 7.615 8.093 1 ATOM C CD . GLU A 0 2 . 2 GLU A CD 15 32.14 1.0 ? 2 A 14 -0.002 8.897 8.494 1 ATOM O OE1 . GLU A 0 2 . 2 GLU A OE1 16 11.24 1.0 ? 2 A 15 -0.884 8.838 9.378 1 ATOM O OE2 . GLU A 0 2 . 2 GLU A OE2 17 32.02 1.0 ? 2 A 16 0.305 9.968 7.928 1 ATOM N N . MET A 0 3 . 3 MET A N 18 70.22 1.0 ? 3 A 17 -0.697 5.001 4.748 1 ATOM C CA . MET A 0 3 . 3 MET A CA 19 61.42 1.0 ? 3 A 18 -1.342 3.898 4.03 1 ATOM C C . MET A 0 3 . 3 MET A C 20 12.22 1.0 ? 3 A 19 -0.689 2.544 4.357 1 ATOM O O . MET A 0 3 . 3 MET A O 21 52.35 1.0 ? 3 A 20 0.492 2.334 4.078 1 ATOM C CB . MET A 0 3 . 3 MET A CB 22 21.25 1.0 ? 3 A 21 -1.29 4.161 2.519 1 ATOM C CG . MET A 0 3 . 3 MET A CG 23 64.24 1.0 ? 3 A 22 -1.986 3.098 1.684 1 ATOM S SD . MET A 0 3 . 3 MET A SD 24 11.54 1.0 ? 3 A 23 -1.997 3.504 -0.072 1 ATOM C CE . MET A 0 3 . 3 MET A CE 25 23.03 1.0 ? 3 A 24 -2.925 2.126 -0.732 1 ATOM N N . ASP A 0 4 . 4 ASP A N 26 64.41 1.0 ? 4 A 25 -1.462 1.636 4.955 1 ATOM C CA . ASP A 0 4 . 4 ASP A CA 27 71.44 1.0 ? 4 A 26 -0.984 0.278 5.247 1 ATOM C C . ASP A 0 4 . 4 ASP A C 28 41.05 1.0 ? 4 A 27 -1.376 -0.702 4.128 1 ATOM O O . ASP A 0 4 . 4 ASP A O 29 3.31 1.0 ? 4 A 28 -2.531 -1.111 4.025 1 ATOM C CB . ASP A 0 4 . 4 ASP A CB 30 4.51 1.0 ? 4 A 29 -1.557 -0.217 6.582 1 ATOM C CG . ASP A 0 4 . 4 ASP A CG 31 33.34 1.0 ? 4 A 30 -1.092 0.612 7.764 1 ATOM O OD1 . ASP A 0 4 . 4 ASP A OD1 32 32.11 1.0 ? 4 A 31 0.037 0.397 8.237 1 ATOM O OD2 . ASP A 0 4 . 4 ASP A OD2 33 61.03 1.0 ? 4 A 32 -1.864 1.47 8.241 1 ATOM N N . ILE A 0 5 . 5 ILE A N 34 23.43 1.0 ? 5 A 33 -0.414 -1.065 3.286 1 ATOM C CA . ILE A 0 5 . 5 ILE A CA 35 2.14 1.0 ? 5 A 34 -0.642 -2.058 2.232 1 ATOM C C . ILE A 0 5 . 5 ILE A C 36 34.22 1.0 ? 5 A 35 -0.113 -3.435 2.664 1 ATOM O O . ILE A 0 5 . 5 ILE A O 37 12.12 1.0 ? 5 A 36 1.094 -3.651 2.742 1 ATOM C CB . ILE A 0 5 . 5 ILE A CB 38 35.23 1.0 ? 5 A 37 0.042 -1.641 0.906 1 ATOM C CG1 . ILE A 0 5 . 5 ILE A CG1 39 35.34 1.0 ? 5 A 38 -0.367 -0.209 0.522 1 ATOM C CG2 . ILE A 0 5 . 5 ILE A CG2 40 71.23 1.0 ? 5 A 39 -0.315 -2.624 -0.211 1 ATOM C CD1 . ILE A 0 5 . 5 ILE A CD1 41 22.53 1.0 ? 5 A 40 0.295 0.3 -0.742 1 ATOM N N . ARG A 0 6 . 6 ARG A N 42 12.41 1.0 ? 6 A 41 -1.022 -4.36 2.942 1 ATOM C CA . ARG A 0 6 . 6 ARG A CA 43 41.44 1.0 ? 6 A 42 -0.656 -5.691 3.433 1 ATOM C C . ARG A 0 6 . 6 ARG A C 44 61.13 1.0 ? 6 A 43 -0.682 -6.735 2.304 1 ATOM O O . ARG A 0 6 . 6 ARG A O 45 42.4 1.0 ? 6 A 44 -1.756 -7.125 1.83 1 ATOM C CB . ARG A 0 6 . 6 ARG A CB 46 11.45 1.0 ? 6 A 45 -1.616 -6.112 4.558 1 ATOM C CG . ARG A 0 6 . 6 ARG A CG 47 54.14 1.0 ? 6 A 46 -1.734 -5.087 5.684 1 ATOM C CD . ARG A 0 6 . 6 ARG A CD 48 12.1 1.0 ? 6 A 47 -2.661 -5.573 6.795 1 ATOM N NE . ARG A 0 6 . 6 ARG A NE 49 33.33 1.0 ? 6 A 48 -2.186 -6.817 7.397 1 ATOM C CZ . ARG A 0 6 . 6 ARG A CZ 50 64.52 1.0 ? 6 A 49 -2.677 -7.359 8.476 1 ATOM N NH1 . ARG A 0 6 . 6 ARG A NH1 51 2.12 1.0 ? 6 A 50 -3.648 -6.798 9.119 1 ATOM N NH2 . ARG A 0 6 . 6 ARG A NH2 52 22.35 1.0 +1 6 A 51 -2.178 -8.465 8.91 1 ATOM N N . PHE A 0 7 . 7 PHE A N 53 4.33 1.0 ? 7 A 52 0.496 -7.173 1.868 1 ATOM C CA . PHE A 0 7 . 7 PHE A CA 54 30.45 1.0 ? 7 A 53 0.604 -8.228 0.851 1 ATOM C C . PHE A 0 7 . 7 PHE A C 55 42.31 1.0 ? 7 A 54 0.666 -9.618 1.499 1 ATOM O O . PHE A 0 7 . 7 PHE A O 56 40.14 1.0 ? 7 A 55 1.505 -9.874 2.361 1 ATOM C CB . PHE A 0 7 . 7 PHE A CB 57 53.54 1.0 ? 7 A 56 1.849 -8.018 -0.029 1 ATOM C CG . PHE A 0 7 . 7 PHE A CG 58 3.42 1.0 ? 7 A 57 1.724 -6.896 -1.033 1 ATOM C CD1 . PHE A 0 7 . 7 PHE A CD1 59 21.02 1.0 ? 7 A 58 1.086 -7.108 -2.249 1 ATOM C CD2 . PHE A 0 7 . 7 PHE A CD2 60 52.44 1.0 ? 7 A 59 2.256 -5.64 -0.772 1 ATOM C CE1 . PHE A 0 7 . 7 PHE A CE1 61 2.22 1.0 ? 7 A 60 0.98 -6.093 -3.18 1 ATOM C CE2 . PHE A 0 7 . 7 PHE A CE2 62 65.35 1.0 ? 7 A 61 2.151 -4.622 -1.701 1 ATOM C CZ . PHE A 0 7 . 7 PHE A CZ 63 2.42 1.0 ? 7 A 62 1.513 -4.849 -2.906 1 ATOM N N . LYS A 0 28 . 28 LYS A N 229 14.34 1.0 ? 28 A 63 10.257 8.427 -5.543 1 ATOM C CA . LYS A 0 28 . 28 LYS A CA 230 33.04 1.0 ? 28 A 64 9.973 9.682 -6.255 1 ATOM C C . LYS A 0 28 . 28 LYS A C 231 61.42 1.0 ? 28 A 65 9.06 10.605 -5.431 1 ATOM O O . LYS A 0 28 . 28 LYS A O 232 71.1 1.0 ? 28 A 66 8.932 11.789 -5.73 1 ATOM C CB . LYS A 0 28 . 28 LYS A CB 233 21.44 1.0 ? 28 A 67 9.323 9.403 -7.622 1 ATOM C CG . LYS A 0 28 . 28 LYS A CG 234 1.21 1.0 ? 28 A 68 10.271 8.821 -8.673 1 ATOM C CD . LYS A 0 28 . 28 LYS A CD 235 2.43 1.0 ? 28 A 69 10.727 7.405 -8.334 1 ATOM C CE . LYS A 0 28 . 28 LYS A CE 236 23.55 1.0 ? 28 A 70 11.673 6.85 -9.392 1 ATOM N NZ . LYS A 0 28 . 28 LYS A NZ 237 61.31 1.0 +1 28 A 71 12.072 5.447 -9.105 1 ATOM N N . PHE A 0 29 . 29 PHE A N 238 15.12 1.0 ? 29 A 72 8.427 10.056 -4.397 1 ATOM C CA . PHE A 0 29 . 29 PHE A CA 239 13.31 1.0 ? 29 A 73 7.516 10.826 -3.544 1 ATOM C C . PHE A 0 29 . 29 PHE A C 240 20.31 1.0 ? 29 A 74 8.111 11.026 -2.142 1 ATOM O O . PHE A 0 29 . 29 PHE A O 241 0.4 1.0 ? 29 A 75 8.859 10.18 -1.646 1 ATOM C CB . PHE A 0 29 . 29 PHE A CB 242 14.1 1.0 ? 29 A 76 6.161 10.109 -3.445 1 ATOM C CG . PHE A 0 29 . 29 PHE A CG 243 20.15 1.0 ? 29 A 77 5.556 9.784 -4.79 1 ATOM C CD1 . PHE A 0 29 . 29 PHE A CD1 244 32.13 1.0 ? 29 A 78 4.984 10.779 -5.571 1 ATOM C CD2 . PHE A 0 29 . 29 PHE A CD2 245 71.53 1.0 ? 29 A 79 5.564 8.482 -5.276 1 ATOM C CE1 . PHE A 0 29 . 29 PHE A CE1 246 71.14 1.0 ? 29 A 80 4.436 10.485 -6.805 1 ATOM C CE2 . PHE A 0 29 . 29 PHE A CE2 247 72.12 1.0 ? 29 A 81 5.016 8.185 -6.508 1 ATOM C CZ . PHE A 0 29 . 29 PHE A CZ 248 23.22 1.0 ? 29 A 82 4.452 9.186 -7.274 1 ATOM N N . ALA A 0 30 . 30 ALA A N 249 42.43 1.0 ? 30 A 83 7.771 12.141 -1.499 1 ATOM C CA . ALA A 0 30 . 30 ALA A CA 250 61.3 1.0 ? 30 A 84 8.266 12.436 -0.148 1 ATOM C C . ALA A 0 30 . 30 ALA A C 251 2.4 1.0 ? 30 A 85 7.498 11.64 0.922 1 ATOM O O . ALA A 0 30 . 30 ALA A O 252 24.03 1.0 ? 30 A 86 6.888 12.211 1.831 1 ATOM C CB . ALA A 0 30 . 30 ALA A CB 253 33.53 1.0 ? 30 A 87 8.175 13.934 0.124 1 ATOM N N . GLY A 0 31 . 31 GLY A N 254 21.44 1.0 ? 31 A 88 7.525 10.314 0.798 1 ATOM C CA . GLY A 0 31 . 31 GLY A CA 255 1.32 1.0 ? 31 A 89 6.832 9.44 1.74 1 ATOM C C . GLY A 0 31 . 31 GLY A C 256 62.21 1.0 ? 31 A 90 7.726 8.314 2.249 1 ATOM O O . GLY A 0 31 . 31 GLY A O 257 75.55 1.0 ? 31 A 91 8.403 7.648 1.464 1 ATOM N N . THR A 0 32 . 32 THR A N 258 21.33 1.0 ? 32 A 92 7.725 8.094 3.56 1 ATOM C CA . THR A 0 32 . 32 THR A CA 259 63.51 1.0 ? 32 A 93 8.606 7.094 4.179 1 ATOM C C . THR A 0 32 . 32 THR A C 260 62.45 1.0 ? 32 A 94 7.974 5.693 4.16 1 ATOM O O . THR A 0 32 . 32 THR A O 261 31.21 1.0 ? 32 A 95 6.928 5.464 4.767 1 ATOM C CB . THR A 0 32 . 32 THR A CB 262 33.44 1.0 ? 32 A 96 8.949 7.477 5.642 1 ATOM O OG1 . THR A 0 32 . 32 THR A OG1 263 22.3 1.0 ? 32 A 97 9.44 8.831 5.693 1 ATOM C CG2 . THR A 0 32 . 32 THR A CG2 264 55.32 1.0 ? 32 A 98 10.001 6.538 6.22 1 ATOM N N . VAL A 0 33 . 33 VAL A N 265 11.12 1.0 ? 33 A 99 8.624 4.755 3.47 1 ATOM C CA . VAL A 0 33 . 33 VAL A CA 266 62.52 1.0 ? 33 A 100 8.092 3.396 3.318 1 ATOM C C . VAL A 0 33 . 33 VAL A C 267 55.24 1.0 ? 33 A 101 8.612 2.45 4.413 1 ATOM O O . VAL A 0 33 . 33 VAL A O 268 50.25 1.0 ? 33 A 102 9.79 2.08 4.433 1 ATOM C CB . VAL A 0 33 . 33 VAL A CB 269 64.45 1.0 ? 33 A 103 8.448 2.809 1.929 1 ATOM C CG1 . VAL A 0 33 . 33 VAL A CG1 270 63.51 1.0 ? 33 A 104 7.858 1.409 1.755 1 ATOM C CG2 . VAL A 0 33 . 33 VAL A CG2 271 42.32 1.0 ? 33 A 105 7.975 3.741 0.816 1 ATOM N N . THR A 0 34 . 34 THR A N 272 11.53 1.0 ? 34 A 106 7.724 2.059 5.321 1 ATOM C CA . THR A 0 34 . 34 THR A CA 273 52.32 1.0 ? 34 A 107 8.052 1.087 6.373 1 ATOM C C . THR A 0 34 . 34 THR A C 274 60.03 1.0 ? 34 A 108 7.26 -0.208 6.161 1 ATOM O O . THR A 0 34 . 34 THR A O 275 31.21 1.0 ? 34 A 109 6.19 -0.185 5.558 1 ATOM C CB . THR A 0 34 . 34 THR A CB 276 42.34 1.0 ? 34 A 110 7.73 1.637 7.789 1 ATOM O OG1 . THR A 0 34 . 34 THR A OG1 277 73.13 1.0 ? 34 A 111 6.31 1.741 7.976 1 ATOM C CG2 . THR A 0 34 . 34 THR A CG2 278 10.55 1.0 ? 34 A 112 8.368 3.003 8.01 1 ATOM N N . TYR A 0 35 . 35 TYR A N 279 64.41 1.0 ? 35 A 113 7.779 -1.338 6.637 1 ATOM C CA . TYR A 0 35 . 35 TYR A CA 280 40.55 1.0 ? 35 A 114 7.065 -2.617 6.497 1 ATOM C C . TYR A 0 35 . 35 TYR A C 281 2.3 1.0 ? 35 A 115 7.488 -3.65 7.553 1 ATOM O O . TYR A 0 35 . 35 TYR A O 282 31.23 1.0 ? 35 A 116 8.627 -3.655 8.027 1 ATOM C CB . TYR A 0 35 . 35 TYR A CB 283 55.12 1.0 ? 35 A 117 7.249 -3.192 5.08 1 ATOM C CG . TYR A 0 35 . 35 TYR A CG 284 13.22 1.0 ? 35 A 118 8.691 -3.425 4.663 1 ATOM C CD1 . TYR A 0 35 . 35 TYR A CD1 285 12.23 1.0 ? 35 A 119 9.437 -2.412 4.068 1 ATOM C CD2 . TYR A 0 35 . 35 TYR A CD2 286 70.12 1.0 ? 35 A 120 9.302 -4.662 4.853 1 ATOM C CE1 . TYR A 0 35 . 35 TYR A CE1 287 52.41 1.0 ? 35 A 121 10.746 -2.624 3.678 1 ATOM C CE2 . TYR A 0 35 . 35 TYR A CE2 288 53.13 1.0 ? 35 A 122 10.609 -4.881 4.464 1 ATOM C CZ . TYR A 0 35 . 35 TYR A CZ 289 53.5 1.0 ? 35 A 123 11.326 -3.859 3.879 1 ATOM O OH . TYR A 0 35 . 35 TYR A OH 290 73.4 1.0 ? 35 A 124 12.629 -4.073 3.482 1 ATOM N N . THR A 0 36 . 36 THR A N 291 31.53 1.0 ? 36 A 125 6.546 -4.511 7.925 1 ATOM C CA . THR A 0 36 . 36 THR A CA 292 1.25 1.0 ? 36 A 126 6.804 -5.615 8.859 1 ATOM C C . THR A 0 36 . 36 THR A C 293 35.22 1.0 ? 36 A 127 6.276 -6.941 8.295 1 ATOM O O . THR A 0 36 . 36 THR A O 294 70.03 1.0 ? 36 A 128 5.111 -7.04 7.906 1 ATOM C CB . THR A 0 36 . 36 THR A CB 295 14.14 1.0 ? 36 A 129 6.14 -5.366 10.236 1 ATOM O OG1 . THR A 0 36 . 36 THR A OG1 296 3.04 1.0 ? 36 A 130 4.728 -5.172 10.076 1 ATOM C CG2 . THR A 0 36 . 36 THR A CG2 297 70.21 1.0 ? 36 A 131 6.744 -4.145 10.928 1 ATOM N N . LEU A 0 37 . 37 LEU A N 298 32.51 1.0 ? 37 A 132 7.138 -7.954 8.236 1 ATOM C CA . LEU A 0 37 . 37 LEU A CA 299 54.12 1.0 ? 37 A 133 6.742 -9.277 7.735 1 ATOM C C . LEU A 0 37 . 37 LEU A C 300 45.21 1.0 ? 37 A 134 6.409 -10.228 8.898 1 ATOM O O . LEU A 0 37 . 37 LEU A O 301 72.31 1.0 ? 37 A 135 7.303 -10.801 9.528 1 ATOM C CB . LEU A 0 37 . 37 LEU A CB 302 52.02 1.0 ? 37 A 136 7.857 -9.867 6.853 1 ATOM C CG . LEU A 0 37 . 37 LEU A CG 303 22.11 1.0 ? 37 A 137 7.547 -11.23 6.209 1 ATOM C CD1 . LEU A 0 37 . 37 LEU A CD1 304 44.41 1.0 ? 37 A 138 6.308 -11.148 5.319 1 ATOM C CD2 . LEU A 0 37 . 37 LEU A CD2 305 2.15 1.0 ? 37 A 139 8.751 -11.732 5.41 1 ATOM N N . ASP A 0 38 . 38 ASP A N 306 13.13 1.0 ? 38 A 140 5.118 -10.388 9.184 1 ATOM C CA . ASP A 0 38 . 38 ASP A CA 307 5.11 1.0 ? 38 A 141 4.663 -11.224 10.298 1 ATOM C C . ASP A 0 38 . 38 ASP A C 308 5.43 1.0 ? 38 A 142 4.061 -12.544 9.782 1 ATOM O O . ASP A 0 38 . 38 ASP A O 309 54.31 1.0 ? 38 A 143 2.958 -12.566 9.233 1 ATOM C CB . ASP A 0 38 . 38 ASP A CB 310 72.04 1.0 ? 38 A 144 3.638 -10.45 11.138 1 ATOM C CG . ASP A 0 38 . 38 ASP A CG 311 13.01 1.0 ? 38 A 145 3.251 -11.181 12.414 1 ATOM O OD1 . ASP A 0 38 . 38 ASP A OD1 312 32.41 1.0 ? 38 A 146 4.085 -11.251 13.342 1 ATOM O OD2 . ASP A 0 38 . 38 ASP A OD2 313 11.33 1.0 ? 38 A 147 2.118 -11.696 12.498 1 ATOM N N . GLY A 0 39 . 39 GLY A N 314 22.44 1.0 ? 39 A 148 4.796 -13.642 9.957 1 ATOM C CA . GLY A 0 39 . 39 GLY A CA 315 63.33 1.0 ? 39 A 149 4.362 -14.935 9.427 1 ATOM C C . GLY A 0 39 . 39 GLY A C 316 14.11 1.0 ? 39 A 150 4.217 -14.92 7.906 1 ATOM O O . GLY A 0 39 . 39 GLY A O 317 43.35 1.0 ? 39 A 151 5.207 -14.795 7.184 1 ATOM N N . ASN A 0 40 . 40 ASN A N 318 72.22 1.0 ? 40 A 152 2.987 -15.049 7.416 1 ATOM C CA . ASN A 0 40 . 40 ASN A CA 319 24.32 1.0 ? 40 A 153 2.709 -14.907 5.985 1 ATOM C C . ASN A 0 40 . 40 ASN A C 320 44.11 1.0 ? 40 A 154 1.802 -13.689 5.739 1 ATOM O O . ASN A 0 40 . 40 ASN A O 321 33.53 1.0 ? 40 A 155 0.608 -13.83 5.475 1 ATOM C CB . ASN A 0 40 . 40 ASN A CB 322 71.13 1.0 ? 40 A 156 2.069 -16.184 5.427 1 ATOM C CG . ASN A 0 40 . 40 ASN A CG 323 30.3 1.0 ? 40 A 157 1.959 -16.183 3.909 1 ATOM O OD1 . ASN A 0 40 . 40 ASN A OD1 324 22.21 1.0 ? 40 A 158 1.786 -15.148 3.276 1 ATOM N ND2 . ASN A 0 40 . 40 ASN A ND2 325 52.31 1.0 ? 40 A 159 2.056 -17.35 3.313 1 ATOM N N . ASP A 0 41 . 41 ASP A N 326 23.02 1.0 ? 41 A 160 2.381 -12.502 5.892 1 ATOM C CA . ASP A 0 41 . 41 ASP A CA 327 5.22 1.0 ? 41 A 161 1.687 -11.235 5.63 1 ATOM C C . ASP A 0 41 . 41 ASP A C 328 5.12 1.0 ? 41 A 162 2.665 -10.059 5.806 1 ATOM O O . ASP A 0 41 . 41 ASP A O 329 63.45 1.0 ? 41 A 163 3.284 -9.899 6.861 1 ATOM C CB . ASP A 0 41 . 41 ASP A CB 330 13.3 1.0 ? 41 A 164 0.473 -11.078 6.564 1 ATOM C CG . ASP A 0 41 . 41 ASP A CG 331 22.14 1.0 ? 41 A 165 -0.406 -9.891 6.197 1 ATOM O OD1 . ASP A 0 41 . 41 ASP A OD1 332 3.51 1.0 ? 41 A 166 -1.189 -9.997 5.228 1 ATOM O OD2 . ASP A 0 41 . 41 ASP A OD2 333 53.02 1.0 ? 41 A 167 -0.331 -8.857 6.885 1 ATOM N N . LEU A 0 42 . 42 LEU A N 334 30.15 1.0 ? 42 A 168 2.824 -9.266 4.753 1 ATOM C CA . LEU A 0 42 . 42 LEU A CA 335 30.21 1.0 ? 42 A 169 3.75 -8.13 4.76 1 ATOM C C . LEU A 0 42 . 42 LEU A C 336 72.01 1.0 ? 42 A 170 2.992 -6.802 4.886 1 ATOM O O . LEU A 0 42 . 42 LEU A O 337 5.4 1.0 ? 42 A 171 2.431 -6.301 3.91 1 ATOM C CB . LEU A 0 42 . 42 LEU A CB 338 42.4 1.0 ? 42 A 172 4.596 -8.135 3.476 1 ATOM C CG . LEU A 0 42 . 42 LEU A CG 339 71.44 1.0 ? 42 A 173 5.642 -7.011 3.359 1 ATOM C CD1 . LEU A 0 42 . 42 LEU A CD1 340 11.55 1.0 ? 42 A 174 6.664 -7.099 4.49 1 ATOM C CD2 . LEU A 0 42 . 42 LEU A CD2 341 40.3 1.0 ? 42 A 175 6.333 -7.056 1.995 1 ATOM N N . GLU A 0 43 . 43 GLU A N 342 63.14 1.0 ? 43 A 176 2.973 -6.243 6.091 1 ATOM C CA . GLU A 0 43 . 43 GLU A CA 343 5.25 1.0 ? 43 A 177 2.282 -4.978 6.349 1 ATOM C C . GLU A 0 43 . 43 GLU A C 344 14.12 1.0 ? 43 A 178 3.182 -3.778 6.015 1 ATOM O O . GLU A 0 43 . 43 GLU A O 345 75.2 1.0 ? 43 A 179 4.11 -3.46 6.759 1 ATOM C CB . GLU A 0 43 . 43 GLU A CB 346 64.21 1.0 ? 43 A 180 1.833 -4.919 7.818 1 ATOM C CG . GLU A 0 43 . 43 GLU A CG 347 23.3 1.0 ? 43 A 181 0.892 -6.055 8.216 1 ATOM C CD . GLU A 0 43 . 43 GLU A CD 348 30.01 1.0 ? 43 A 182 0.405 -5.95 9.652 1 ATOM O OE1 . GLU A 0 43 . 43 GLU A OE1 349 53.21 1.0 ? 43 A 183 -0.383 -5.025 9.953 1 ATOM O OE2 . GLU A 0 43 . 43 GLU A OE2 350 12.35 1.0 ? 43 A 184 0.804 -6.785 10.49 1 ATOM N N . ILE A 0 44 . 44 ILE A N 351 74.41 1.0 ? 44 A 185 2.911 -3.126 4.885 1 ATOM C CA . ILE A 0 44 . 44 ILE A CA 352 64.25 1.0 ? 44 A 186 3.711 -1.981 4.433 1 ATOM C C . ILE A 0 44 . 44 ILE A C 353 63.33 1.0 ? 44 A 187 3.034 -0.643 4.772 1 ATOM O O . ILE A 0 44 . 44 ILE A O 354 41.54 1.0 ? 44 A 188 2.034 -0.275 4.162 1 ATOM C CB . ILE A 0 44 . 44 ILE A CB 355 41.15 1.0 ? 44 A 189 3.941 -2.04 2.9 1 ATOM C CG1 . ILE A 0 44 . 44 ILE A CG1 356 32.13 1.0 ? 44 A 190 4.495 -3.414 2.486 1 ATOM C CG2 . ILE A 0 44 . 44 ILE A CG2 357 72.33 1.0 ? 44 A 191 4.882 -0.919 2.454 1 ATOM C CD1 . ILE A 0 44 . 44 ILE A CD1 358 63.44 1.0 ? 44 A 192 4.621 -3.596 0.988 1 ATOM N N . ARG A 0 45 . 45 ARG A N 359 41.23 1.0 ? 45 A 193 3.59 0.094 5.727 1 ATOM C CA . ARG A 0 45 . 45 ARG A CA 360 55.03 1.0 ? 45 A 194 3.054 1.412 6.091 1 ATOM C C . ARG A 0 45 . 45 ARG A C 361 44.2 1.0 ? 45 A 195 3.846 2.547 5.426 1 ATOM O O . ARG A 0 45 . 45 ARG A O 362 62.02 1.0 ? 45 A 196 4.98 2.844 5.809 1 ATOM C CB . ARG A 0 45 . 45 ARG A CB 363 41.1 1.0 ? 45 A 197 3.043 1.596 7.62 1 ATOM C CG . ARG A 0 45 . 45 ARG A CG 364 32.21 1.0 ? 45 A 198 2.767 3.037 8.064 1 ATOM C CD . ARG A 0 45 . 45 ARG A CD 365 54.44 1.0 ? 45 A 199 2.311 3.113 9.515 1 ATOM N NE . ARG A 0 45 . 45 ARG A NE 366 41.4 1.0 ? 45 A 200 0.968 2.562 9.678 1 ATOM C CZ . ARG A 0 45 . 45 ARG A CZ 367 14.33 1.0 ? 45 A 201 0.293 2.556 10.792 1 ATOM N NH1 . ARG A 0 45 . 45 ARG A NH1 368 2.35 1.0 ? 45 A 202 0.815 3.013 11.887 1 ATOM N NH2 . ARG A 0 45 . 45 ARG A NH2 369 53.02 1.0 +1 45 A 203 -0.909 2.079 10.803 1 ATOM N N . ILE A 0 46 . 46 ILE A N 370 73.34 1.0 ? 46 A 204 3.245 3.168 4.415 1 ATOM C CA . ILE A 0 46 . 46 ILE A CA 371 5.32 1.0 ? 46 A 205 3.839 4.338 3.767 1 ATOM C C . ILE A 0 46 . 46 ILE A C 372 34.13 1.0 ? 46 A 206 3.34 5.63 4.437 1 ATOM O O . ILE A 0 46 . 46 ILE A O 373 13.2 1.0 ? 46 A 207 2.157 5.976 4.351 1 ATOM C CB . ILE A 0 46 . 46 ILE A CB 374 11.13 1.0 ? 46 A 208 3.515 4.376 2.252 1 ATOM C CG1 . ILE A 0 46 . 46 ILE A CG1 375 53.35 1.0 ? 46 A 209 3.915 3.046 1.585 1 ATOM C CG2 . ILE A 0 46 . 46 ILE A CG2 376 21.12 1.0 ? 46 A 210 4.232 5.551 1.582 1 ATOM C CD1 . ILE A 0 46 . 46 ILE A CD1 377 73.2 1.0 ? 46 A 211 3.619 2.985 0.101 1 ATOM N N . THR A 0 47 . 47 THR A N 378 3.35 1.0 ? 47 A 212 4.245 6.326 5.117 1 ATOM C CA . THR A 0 47 . 47 THR A CA 379 40.34 1.0 ? 47 A 213 3.897 7.532 5.878 1 ATOM C C . THR A 0 47 . 47 THR A C 380 2.24 1.0 ? 47 A 214 4.083 8.809 5.048 1 ATOM O O . THR A 0 47 . 47 THR A O 381 24.0 1.0 ? 47 A 215 5.189 9.107 4.59 1 ATOM C CB . THR A 0 47 . 47 THR A CB 382 44.01 1.0 ? 47 A 216 4.759 7.642 7.162 1 ATOM O OG1 . THR A 0 47 . 47 THR A OG1 383 43.14 1.0 ? 47 A 217 4.585 6.47 7.971 1 ATOM C CG2 . THR A 0 47 . 47 THR A CG2 384 1.2 1.0 ? 47 A 218 4.393 8.88 7.98 1 ATOM N N . GLY A 0 48 . 48 GLY A N 385 10.31 1.0 ? 48 A 219 2.999 9.564 4.867 1 ATOM C CA . GLY A 0 48 . 48 GLY A CA 386 72.24 1.0 ? 48 A 220 3.07 10.843 4.165 1 ATOM C C . GLY A 0 48 . 48 GLY A C 387 72.41 1.0 ? 48 A 221 2.781 10.745 2.669 1 ATOM O O . GLY A 0 48 . 48 GLY A O 388 55.0 1.0 ? 48 A 222 3.656 11.003 1.84 1 ATOM N N . VAL A 0 49 . 49 VAL A N 389 21.23 1.0 ? 49 A 223 1.551 10.377 2.317 1 ATOM C CA . VAL A 0 49 . 49 VAL A CA 390 15.53 1.0 ? 49 A 224 1.141 10.295 0.908 1 ATOM C C . VAL A 0 49 . 49 VAL A C 391 11.33 1.0 ? 49 A 225 -0.069 11.199 0.608 1 ATOM O O . VAL A 0 49 . 49 VAL A O 392 60.23 1.0 ? 49 A 226 -1.018 11.26 1.388 1 ATOM C CB . VAL A 0 49 . 49 VAL A CB 393 32.3 1.0 ? 49 A 227 0.806 8.837 0.491 1 ATOM C CG1 . VAL A 0 49 . 49 VAL A CG1 394 74.54 1.0 ? 49 A 228 2.069 7.983 0.453 1 ATOM C CG2 . VAL A 0 49 . 49 VAL A CG2 395 13.52 1.0 ? 49 A 229 -0.231 8.221 1.432 1 ATOM N N . PRO A 0 50 . 50 PRO A N 396 21.25 1.0 ? 50 A 230 -0.043 11.931 -0.527 1 ATOM C CA . PRO A 0 50 . 50 PRO A CA 397 63.22 1.0 ? 50 A 231 -1.179 12.758 -0.963 1 ATOM C C . PRO A 0 50 . 50 PRO A C 398 4.02 1.0 ? 50 A 232 -2.296 11.924 -1.623 1 ATOM O O . PRO A 0 50 . 50 PRO A O 399 51.33 1.0 ? 50 A 233 -2.036 10.886 -2.236 1 ATOM C CB . PRO A 0 50 . 50 PRO A CB 400 41.0 1.0 ? 50 A 234 -0.536 13.716 -1.972 1 ATOM C CG . PRO A 0 50 . 50 PRO A CG 401 12.1 1.0 ? 50 A 235 0.604 12.944 -2.551 1 ATOM C CD . PRO A 0 50 . 50 PRO A CD 402 73.14 1.0 ? 50 A 236 1.101 12.028 -1.457 1 ATOM N N . GLU A 0 51 . 51 GLU A N 403 3.43 1.0 ? 51 A 237 -3.54 12.393 -1.51 1 ATOM C CA . GLU A 0 51 . 51 GLU A CA 404 40.15 1.0 ? 51 A 238 -4.708 11.64 -1.996 1 ATOM C C . GLU A 0 51 . 51 GLU A C 405 53.45 1.0 ? 51 A 239 -4.65 11.357 -3.509 1 ATOM O O . GLU A 0 51 . 51 GLU A O 406 44.05 1.0 ? 51 A 240 -5.162 10.338 -3.974 1 ATOM C CB . GLU A 0 51 . 51 GLU A CB 407 35.23 1.0 ? 51 A 241 -6.007 12.376 -1.638 1 ATOM C CG . GLU A 0 51 . 51 GLU A CG 408 64.23 1.0 ? 51 A 242 -6.106 13.789 -2.201 1 ATOM C CD . GLU A 0 51 . 51 GLU A CD 409 31.3 1.0 ? 51 A 243 -7.379 14.501 -1.769 1 ATOM O OE1 . GLU A 0 51 . 51 GLU A OE1 410 33.05 1.0 ? 51 A 244 -8.415 14.36 -2.458 1 ATOM O OE2 . GLU A 0 51 . 51 GLU A OE2 411 13.41 1.0 ? 51 A 245 -7.35 15.21 -0.74 1 ATOM N N . GLN A 0 52 . 52 GLN A N 412 71.23 1.0 ? 52 A 246 -4.022 12.251 -4.275 1 ATOM C CA . GLN A 0 52 . 52 GLN A CA 413 72.51 1.0 ? 52 A 247 -3.869 12.041 -5.724 1 ATOM C C . GLN A 0 52 . 52 GLN A C 414 35.43 1.0 ? 52 A 248 -3.007 10.798 -6.022 1 ATOM O O . GLN A 0 52 . 52 GLN A O 415 74.42 1.0 ? 52 A 249 -3.367 9.961 -6.853 1 ATOM C CB . GLN A 0 52 . 52 GLN A CB 416 64.43 1.0 ? 52 A 250 -3.263 13.287 -6.396 1 ATOM C CG . GLN A 0 52 . 52 GLN A CG 417 5.31 1.0 ? 52 A 251 -1.88 13.675 -5.875 1 ATOM C CD . GLN A 0 52 . 52 GLN A CD 418 40.31 1.0 ? 52 A 252 -1.268 14.855 -6.618 1 ATOM O OE1 . GLN A 0 52 . 52 GLN A OE1 419 71.04 1.0 ? 52 A 253 -1.525 15.068 -7.798 1 ATOM N NE2 . GLN A 0 52 . 52 GLN A NE2 420 44.23 1.0 ? 52 A 254 -0.457 15.636 -5.931 1 ATOM N N . VAL A 0 53 . 53 VAL A N 421 51.43 1.0 ? 53 A 255 -1.885 10.669 -5.315 1 ATOM C CA . VAL A 0 53 . 53 VAL A CA 422 2.42 1.0 ? 53 A 256 -0.972 9.535 -5.505 1 ATOM C C . VAL A 0 53 . 53 VAL A C 423 53.14 1.0 ? 53 A 257 -1.518 8.265 -4.83 1 ATOM O O . VAL A 0 53 . 53 VAL A O 424 63.54 1.0 ? 53 A 258 -1.234 7.147 -5.263 1 ATOM C CB . VAL A 0 53 . 53 VAL A CB 425 55.32 1.0 ? 53 A 259 0.441 9.858 -4.952 1 ATOM C CG1 . VAL A 0 53 . 53 VAL A CG1 426 12.41 1.0 ? 53 A 260 1.397 8.684 -5.149 1 ATOM C CG2 . VAL A 0 53 . 53 VAL A CG2 427 34.12 1.0 ? 53 A 261 0.999 11.121 -5.606 1 ATOM N N . ARG A 0 54 . 54 ARG A N 428 11.33 1.0 ? 54 A 262 -2.315 8.451 -3.772 1 ATOM C CA . ARG A 0 54 . 54 ARG A CA 429 45.33 1.0 ? 54 A 263 -2.984 7.336 -3.085 1 ATOM C C . ARG A 0 54 . 54 ARG A C 430 51.31 1.0 ? 54 A 264 -3.695 6.411 -4.088 1 ATOM O O . ARG A 0 54 . 54 ARG A O 431 71.43 1.0 ? 54 A 265 -3.66 5.186 -3.961 1 ATOM C CB . ARG A 0 54 . 54 ARG A CB 432 42.32 1.0 ? 54 A 266 -4.001 7.883 -2.071 1 ATOM C CG . ARG A 0 54 . 54 ARG A CG 433 1.32 1.0 ? 54 A 267 -4.752 6.806 -1.285 1 ATOM C CD . ARG A 0 54 . 54 ARG A CD 434 65.22 1.0 ? 54 A 268 -5.822 7.408 -0.375 1 ATOM N NE . ARG A 0 54 . 54 ARG A NE 435 34.24 1.0 ? 54 A 269 -6.876 8.091 -1.132 1 ATOM C CZ . ARG A 0 54 . 54 ARG A CZ 436 2.41 1.0 ? 54 A 270 -7.487 9.178 -0.738 1 ATOM N NH1 . ARG A 0 54 . 54 ARG A NH1 437 11.12 1.0 ? 54 A 271 -7.176 9.751 0.381 1 ATOM N NH2 . ARG A 0 54 . 54 ARG A NH2 438 13.32 1.0 +1 54 A 272 -8.413 9.702 -1.474 1 ATOM N N . LYS A 0 55 . 55 LYS A N 439 31.44 1.0 ? 55 A 273 -4.337 7.019 -5.083 1 ATOM C CA . LYS A 0 55 . 55 LYS A CA 440 60.35 1.0 ? 55 A 274 -5.023 6.28 -6.148 1 ATOM C C . LYS A 0 55 . 55 LYS A C 441 71.42 1.0 ? 55 A 275 -4.041 5.397 -6.938 1 ATOM O O . LYS A 0 55 . 55 LYS A O 442 41.42 1.0 ? 55 A 276 -4.256 4.195 -7.104 1 ATOM C CB . LYS A 0 55 . 55 LYS A CB 443 43.34 1.0 ? 55 A 277 -5.703 7.275 -7.1 1 ATOM C CG . LYS A 0 55 . 55 LYS A CG 444 30.13 1.0 ? 55 A 278 -6.583 8.304 -6.391 1 ATOM C CD . LYS A 0 55 . 55 LYS A CD 445 40.14 1.0 ? 55 A 279 -7.087 9.373 -7.355 1 ATOM C CE . LYS A 0 55 . 55 LYS A CE 446 12.23 1.0 ? 55 A 280 -7.789 10.511 -6.622 1 ATOM N NZ . LYS A 0 55 . 55 LYS A NZ 447 42.42 1.0 +1 55 A 281 -8.993 10.046 -5.886 1 ATOM N N . GLU A 0 56 . 56 GLU A N 448 42.21 1.0 ? 56 A 282 -2.954 6.011 -7.404 1 ATOM C CA . GLU A 0 56 . 56 GLU A CA 449 42.03 1.0 ? 56 A 283 -1.954 5.33 -8.235 1 ATOM C C . GLU A 0 56 . 56 GLU A C 450 23.13 1.0 ? 56 A 284 -1.281 4.162 -7.491 1 ATOM O O . GLU A 0 56 . 56 GLU A O 451 2.13 1.0 ? 56 A 285 -1.114 3.071 -8.048 1 ATOM C CB . GLU A 0 56 . 56 GLU A CB 452 52.33 1.0 ? 56 A 286 -0.9 6.347 -8.703 1 ATOM C CG . GLU A 0 56 . 56 GLU A CG 453 31.24 1.0 ? 56 A 287 -1.479 7.476 -9.559 1 ATOM C CD . GLU A 0 56 . 56 GLU A CD 454 75.33 1.0 ? 56 A 288 -0.455 8.552 -9.898 1 ATOM O OE1 . GLU A 0 56 . 56 GLU A OE1 455 60.04 1.0 ? 56 A 289 0.437 8.293 -10.74 1 ATOM O OE2 . GLU A 0 56 . 56 GLU A OE2 456 65.2 1.0 ? 56 A 290 -0.534 9.661 -9.329 1 ATOM N N . LEU A 0 57 . 57 LEU A N 457 70.34 1.0 ? 57 A 291 -0.901 4.389 -6.236 1 ATOM C CA . LEU A 0 57 . 57 LEU A CA 458 20.22 1.0 ? 57 A 292 -0.264 3.345 -5.42 1 ATOM C C . LEU A 0 57 . 57 LEU A C 459 20.22 1.0 ? 57 A 293 -1.244 2.206 -5.102 1 ATOM O O . LEU A 0 57 . 57 LEU A O 460 13.12 1.0 ? 57 A 294 -0.905 1.028 -5.231 1 ATOM C CB . LEU A 0 57 . 57 LEU A CB 461 64.33 1.0 ? 57 A 295 0.288 3.941 -4.113 1 ATOM C CG . LEU A 0 57 . 57 LEU A CG 462 71.41 1.0 ? 57 A 296 1.383 5.007 -4.283 1 ATOM C CD1 . LEU A 0 57 . 57 LEU A CD1 463 63.45 1.0 ? 57 A 297 1.833 5.536 -2.924 1 ATOM C CD2 . LEU A 0 57 . 57 LEU A CD2 464 42.42 1.0 ? 57 A 298 2.57 4.439 -5.059 1 ATOM N N . ALA A 0 58 . 58 ALA A N 465 45.14 1.0 ? 58 A 299 -2.463 2.563 -4.698 1 ATOM C CA . ALA A 0 58 . 58 ALA A CA 466 52.34 1.0 ? 58 A 300 -3.488 1.572 -4.353 1 ATOM C C . ALA A 0 58 . 58 ALA A C 467 73.44 1.0 ? 58 A 301 -3.855 0.701 -5.558 1 ATOM O O . ALA A 0 58 . 58 ALA A O 468 32.03 1.0 ? 58 A 302 -4.044 -0.509 -5.433 1 ATOM C CB . ALA A 0 58 . 58 ALA A CB 469 14.25 1.0 ? 58 A 303 -4.737 2.26 -3.807 1 ATOM N N . LYS A 0 59 . 59 LYS A N 470 44.02 1.0 ? 59 A 304 -3.942 1.326 -6.728 1 ATOM C CA . LYS A 0 59 . 59 LYS A CA 471 65.23 1.0 ? 59 A 305 -4.317 0.619 -7.95 1 ATOM C C . LYS A 0 59 . 59 LYS A C 472 61.15 1.0 ? 59 A 306 -3.195 -0.302 -8.451 1 ATOM O O . LYS A 0 59 . 59 LYS A O 473 61.2 1.0 ? 59 A 307 -3.463 -1.382 -8.985 1 ATOM C CB . LYS A 0 59 . 59 LYS A CB 474 32.32 1.0 ? 59 A 308 -4.729 1.617 -9.037 1 ATOM C CG . LYS A 0 59 . 59 LYS A CG 475 13.01 1.0 ? 59 A 309 -5.296 0.955 -10.291 1 ATOM C CD . LYS A 0 59 . 59 LYS A CD 476 51.33 1.0 ? 59 A 310 -6.275 1.871 -11.021 1 ATOM C CE . LYS A 0 59 . 59 LYS A CE 477 3.12 1.0 ? 59 A 311 -7.451 2.261 -10.128 1 ATOM N NZ . LYS A 0 59 . 59 LYS A NZ 478 41.43 1.0 +1 59 A 312 -8.125 1.069 -9.541 1 ATOM N N . GLU A 0 60 . 60 GLU A N 479 41.04 1.0 ? 60 A 313 -1.938 0.107 -8.275 1 ATOM C CA . GLU A 0 60 . 60 GLU A CA 480 33.4 1.0 ? 60 A 314 -0.819 -0.764 -8.646 1 ATOM C C . GLU A 0 60 . 60 GLU A C 481 53.34 1.0 ? 60 A 315 -0.705 -1.94 -7.669 1 ATOM O O . GLU A 0 60 . 60 GLU A O 482 14.14 1.0 ? 60 A 316 -0.303 -3.036 -8.052 1 ATOM C CB . GLU A 0 60 . 60 GLU A CB 483 65.21 1.0 ? 60 A 317 0.511 -0.002 -8.74 1 ATOM C CG . GLU A 0 60 . 60 GLU A CG 484 10.23 1.0 ? 60 A 318 1.656 -0.875 -9.265 1 ATOM C CD . GLU A 0 60 . 60 GLU A CD 485 1.11 1.0 ? 60 A 319 2.814 -0.078 -9.843 1 ATOM O OE1 . GLU A 0 60 . 60 GLU A OE1 486 31.2 1.0 ? 60 A 320 2.556 0.872 -10.608 1 ATOM O OE2 . GLU A 0 60 . 60 GLU A OE2 487 53.01 1.0 ? 60 A 321 3.986 -0.424 -9.575 1 ATOM N N . ALA A 0 61 . 61 ALA A N 488 10.32 1.0 ? 61 A 322 -1.07 -1.71 -6.406 1 ATOM C CA . ALA A 0 61 . 61 ALA A CA 489 72.3 1.0 ? 61 A 323 -1.175 -2.798 -5.425 1 ATOM C C . ALA A 0 61 . 61 ALA A C 490 41.42 1.0 ? 61 A 324 -2.137 -3.888 -5.93 1 ATOM O O . ALA A 0 61 . 61 ALA A O 491 33.51 1.0 ? 61 A 325 -1.846 -5.085 -5.837 1 ATOM C CB . ALA A 0 61 . 61 ALA A CB 492 30.0 1.0 ? 61 A 326 -1.64 -2.254 -4.076 1 ATOM N N . GLU A 0 62 . 62 GLU A N 493 4.12 1.0 ? 62 A 327 -3.279 -3.458 -6.476 1 ATOM C CA . GLU A 0 62 . 62 GLU A CA 494 33.23 1.0 ? 62 A 328 -4.22 -4.373 -7.139 1 ATOM C C . GLU A 0 62 . 62 GLU A C 495 1.24 1.0 ? 62 A 329 -3.524 -5.115 -8.295 1 ATOM O O . GLU A 0 62 . 62 GLU A O 496 32.32 1.0 ? 62 A 330 -3.595 -6.342 -8.405 1 ATOM C CB . GLU A 0 62 . 62 GLU A CB 497 15.01 1.0 ? 62 A 331 -5.427 -3.598 -7.7 1 ATOM C CG . GLU A 0 62 . 62 GLU A CG 498 52.35 1.0 ? 62 A 332 -6.193 -2.771 -6.671 1 ATOM C CD . GLU A 0 62 . 62 GLU A CD 499 34.04 1.0 ? 62 A 333 -7.406 -2.071 -7.276 1 ATOM O OE1 . GLU A 0 62 . 62 GLU A OE1 500 13.23 1.0 ? 62 A 334 -8.491 -2.688 -7.316 1 ATOM O OE2 . GLU A 0 62 . 62 GLU A OE2 501 44.54 1.0 ? 62 A 335 -7.275 -0.913 -7.739 1 ATOM N N . ARG A 0 63 . 63 ARG A N 502 4.41 1.0 ? 63 A 336 -2.853 -4.341 -9.148 1 ATOM C CA . ARG A 0 63 . 63 ARG A CA 503 2.54 1.0 ? 63 A 337 -2.112 -4.867 -10.306 1 ATOM C C . ARG A 0 63 . 63 ARG A C 504 23.41 1.0 ? 63 A 338 -1.114 -5.967 -9.886 1 ATOM O O . ARG A 0 63 . 63 ARG A O 505 2.13 1.0 ? 63 A 339 -1.075 -7.048 -10.477 1 ATOM C CB . ARG A 0 63 . 63 ARG A CB 506 12.44 1.0 ? 63 A 340 -1.373 -3.701 -10.987 1 ATOM C CG . ARG A 0 63 . 63 ARG A CG 507 32.2 1.0 ? 63 A 341 -0.742 -4.026 -12.338 1 ATOM C CD . ARG A 0 63 . 63 ARG A CD 508 5.32 1.0 ? 63 A 342 -1.788 -4.394 -13.388 1 ATOM N NE . ARG A 0 63 . 63 ARG A NE 509 71.53 1.0 ? 63 A 343 -1.255 -4.28 -14.747 1 ATOM C CZ . ARG A 0 63 . 63 ARG A CZ 510 14.02 1.0 ? 63 A 344 -1.485 -5.131 -15.707 1 ATOM N NH1 . ARG A 0 63 . 63 ARG A NH1 511 72.33 1.0 ? 63 A 345 -2.136 -6.225 -15.475 1 ATOM N NH2 . ARG A 0 63 . 63 ARG A NH2 512 35.2 1.0 +1 63 A 346 -1.023 -4.899 -16.895 1 ATOM N N . LEU A 0 64 . 64 LEU A N 513 4.31 1.0 ? 64 A 347 -0.321 -5.684 -8.851 1 ATOM C CA . LEU A 0 64 . 64 LEU A CA 514 2.33 1.0 ? 64 A 348 0.629 -6.655 -8.296 1 ATOM C C . LEU A 0 64 . 64 LEU A C 515 3.42 1.0 ? 64 A 349 -0.091 -7.935 -7.844 1 ATOM O O . LEU A 0 64 . 64 LEU A O 516 11.24 1.0 ? 64 A 350 0.288 -9.046 -8.218 1 ATOM C CB . LEU A 0 64 . 64 LEU A CB 517 20.54 1.0 ? 64 A 351 1.378 -6.029 -7.11 1 ATOM C CG . LEU A 0 64 . 64 LEU A CG 518 44.04 1.0 ? 64 A 352 2.267 -4.822 -7.457 1 ATOM C CD1 . LEU A 0 64 . 64 LEU A CD1 519 4.52 1.0 ? 64 A 353 2.761 -4.126 -6.191 1 ATOM C CD2 . LEU A 0 64 . 64 LEU A CD2 520 11.24 1.0 ? 64 A 354 3.446 -5.257 -8.325 1 ATOM N N . ALA A 0 65 . 65 ALA A N 521 22.02 1.0 ? 65 A 355 -1.147 -7.764 -7.051 1 ATOM C CA . ALA A 0 65 . 65 ALA A CA 522 42.2 1.0 ? 65 A 356 -1.946 -8.893 -6.559 1 ATOM C C . ALA A 0 65 . 65 ALA A C 523 22.03 1.0 ? 65 A 357 -2.56 -9.704 -7.71 1 ATOM O O . ALA A 0 65 . 65 ALA A O 524 30.4 1.0 ? 65 A 358 -2.844 -10.891 -7.56 1 ATOM C CB . ALA A 0 65 . 65 ALA A CB 525 44.44 1.0 ? 65 A 359 -3.04 -8.397 -5.623 1 ATOM N N . LYS A 0 66 . 66 LYS A N 526 64.34 1.0 ? 66 A 360 -2.776 -9.059 -8.853 1 ATOM C CA . LYS A 0 66 . 66 LYS A CA 527 60.33 1.0 ? 66 A 361 -3.298 -9.742 -10.041 1 ATOM C C . LYS A 0 66 . 66 LYS A C 528 44.21 1.0 ? 66 A 362 -2.221 -10.62 -10.705 1 ATOM O O . LYS A 0 66 . 66 LYS A O 529 54.15 1.0 ? 66 A 363 -2.386 -11.835 -10.812 1 ATOM C CB . LYS A 0 66 . 66 LYS A CB 530 34.21 1.0 ? 66 A 364 -3.856 -8.721 -11.046 1 ATOM C CG . LYS A 0 66 . 66 LYS A CG 531 55.5 1.0 ? 66 A 365 -5.143 -8.038 -10.585 1 ATOM C CD . LYS A 0 66 . 66 LYS A CD 532 74.04 1.0 ? 66 A 366 -6.3 -9.032 -10.467 1 ATOM C CE . LYS A 0 66 . 66 LYS A CE 533 45.11 1.0 ? 66 A 367 -7.601 -8.349 -10.053 1 ATOM N NZ . LYS A 0 66 . 66 LYS A NZ 534 31.51 1.0 +1 66 A 368 -7.55 -7.841 -8.656 1 ATOM N N . GLU A 0 67 . 67 GLU A N 535 12.42 1.0 ? 67 A 369 -1.113 -10.011 -11.133 1 ATOM C CA . GLU A 0 67 . 67 GLU A CA 536 51.44 1.0 ? 67 A 370 -0.017 -10.756 -11.78 1 ATOM C C . GLU A 0 67 . 67 GLU A C 537 65.43 1.0 ? 67 A 371 0.541 -11.876 -10.879 1 ATOM O O . GLU A 0 67 . 67 GLU A O 538 11.44 1.0 ? 67 A 372 0.934 -12.941 -11.368 1 ATOM C CB . GLU A 0 67 . 67 GLU A CB 539 35.22 1.0 ? 67 A 373 1.119 -9.807 -12.205 1 ATOM C CG . GLU A 0 67 . 67 GLU A CG 540 41.11 1.0 ? 67 A 374 0.933 -9.181 -13.59 1 ATOM C CD . GLU A 0 67 . 67 GLU A CD 541 72.31 1.0 ? 67 A 375 -0.304 -8.308 -13.7 1 ATOM O OE1 . GLU A 0 67 . 67 GLU A OE1 542 21.22 1.0 ? 67 A 376 -0.22 -7.117 -13.353 1 ATOM O OE2 . GLU A 0 67 . 67 GLU A OE2 543 15.43 1.0 ? 67 A 377 -1.359 -8.809 -14.149 1 ATOM N N . PHE A 0 68 . 68 PHE A N 544 3.33 1.0 ? 68 A 378 0.585 -11.638 -9.571 1 ATOM C CA . PHE A 0 68 . 68 PHE A CA 545 40.02 1.0 ? 68 A 379 1.06 -12.655 -8.624 1 ATOM C C . PHE A 0 68 . 68 PHE A C 546 42.13 1.0 ? 68 A 380 -0.099 -13.504 -8.067 1 ATOM O O . PHE A 0 68 . 68 PHE A O 547 4.35 1.0 ? 68 A 381 0.128 -14.476 -7.346 1 ATOM C CB . PHE A 0 68 . 68 PHE A CB 548 74.25 1.0 ? 68 A 382 1.832 -11.996 -7.473 1 ATOM C CG . PHE A 0 68 . 68 PHE A CG 549 51.15 1.0 ? 68 A 383 3.062 -11.249 -7.923 1 ATOM C CD1 . PHE A 0 68 . 68 PHE A CD1 550 22.05 1.0 ? 68 A 384 4.148 -11.932 -8.454 1 ATOM C CD2 . PHE A 0 68 . 68 PHE A CD2 551 44.23 1.0 ? 68 A 385 3.134 -9.868 -7.817 1 ATOM C CE1 . PHE A 0 68 . 68 PHE A CE1 552 24.23 1.0 ? 68 A 386 5.276 -11.251 -8.869 1 ATOM C CE2 . PHE A 0 68 . 68 PHE A CE2 553 24.13 1.0 ? 68 A 387 4.26 -9.183 -8.23 1 ATOM C CZ . PHE A 0 68 . 68 PHE A CZ 554 12.24 1.0 ? 68 A 388 5.331 -9.876 -8.758 1 ATOM N N . ASN A 0 69 . 69 ASN A N 555 14.0 1.0 ? 69 A 389 -1.339 -13.117 -8.396 1 ATOM C CA . ASN A 0 69 . 69 ASN A CA 556 45.02 1.0 ? 69 A 390 -2.549 -13.833 -7.945 1 ATOM C C . ASN A 0 69 . 69 ASN A C 557 14.14 1.0 ? 69 A 391 -2.629 -13.912 -6.403 1 ATOM O O . ASN A 0 69 . 69 ASN A O 558 15.35 1.0 ? 69 A 392 -3.42 -14.671 -5.839 1 ATOM C CB . ASN A 0 69 . 69 ASN A CB 559 0.14 1.0 ? 69 A 393 -2.598 -15.232 -8.584 1 ATOM C CG . ASN A 0 69 . 69 ASN A CG 560 71.55 1.0 ? 69 A 394 -3.933 -15.932 -8.383 1 ATOM O OD1 . ASN A 0 69 . 69 ASN A OD1 561 35.42 1.0 ? 69 A 395 -4.881 -15.713 -9.129 1 ATOM N ND2 . ASN A 0 69 . 69 ASN A ND2 562 62.03 1.0 ? 69 A 396 -4.014 -16.791 -7.39 1 ATOM N N . ILE A 0 70 . 70 ILE A N 563 51.44 1.0 ? 70 A 397 -1.835 -13.086 -5.727 1 ATOM C CA . ILE A 0 70 . 70 ILE A CA 564 65.15 1.0 ? 70 A 398 -1.777 -13.08 -4.261 1 ATOM C C . ILE A 0 70 . 70 ILE A C 565 31.23 1.0 ? 70 A 399 -2.846 -12.159 -3.65 1 ATOM O O . ILE A 0 70 . 70 ILE A O 566 52.42 1.0 ? 70 A 400 -3.563 -11.457 -4.364 1 ATOM C CB . ILE A 0 70 . 70 ILE A CB 567 43.11 1.0 ? 70 A 401 -0.377 -12.645 -3.752 1 ATOM C CG1 . ILE A 0 70 . 70 ILE A CG1 568 61.24 1.0 ? 70 A 402 -0.041 -11.217 -4.223 1 ATOM C CG2 . ILE A 0 70 . 70 ILE A CG2 569 30.34 1.0 ? 70 A 403 0.69 -13.64 -4.21 1 ATOM C CD1 . ILE A 0 70 . 70 ILE A CD1 570 51.11 1.0 ? 70 A 404 1.308 -10.715 -3.749 1 ATOM N N . THR A 0 71 . 71 THR A N 571 22.03 1.0 ? 71 A 405 -2.941 -12.169 -2.322 1 ATOM C CA . THR A 0 71 . 71 THR A CA 572 31.14 1.0 ? 71 A 406 -3.922 -11.35 -1.598 1 ATOM C C . THR A 0 71 . 71 THR A C 573 45.13 1.0 ? 71 A 407 -3.347 -9.971 -1.247 1 ATOM O O . THR A 0 71 . 71 THR A O 574 64.41 1.0 ? 71 A 408 -2.19 -9.862 -0.842 1 ATOM C CB . THR A 0 71 . 71 THR A CB 575 75.41 1.0 ? 71 A 409 -4.363 -12.044 -0.283 1 ATOM O OG1 . THR A 0 71 . 71 THR A OG1 576 20.14 1.0 ? 71 A 410 -4.808 -13.385 -0.549 1 ATOM C CG2 . THR A 0 71 . 71 THR A CG2 577 23.21 1.0 ? 71 A 411 -5.48 -11.267 0.409 1 ATOM N N . VAL A 0 72 . 72 VAL A N 578 71.31 1.0 ? 72 A 412 -4.156 -8.922 -1.389 1 ATOM C CA . VAL A 0 72 . 72 VAL A CA 579 21.44 1.0 ? 72 A 413 -3.735 -7.57 -1.004 1 ATOM C C . VAL A 0 72 . 72 VAL A C 580 31.25 1.0 ? 72 A 414 -4.842 -6.835 -0.227 1 ATOM O O . VAL A 0 72 . 72 VAL A O 581 73.2 1.0 ? 72 A 415 -5.987 -6.751 -0.674 1 ATOM C CB . VAL A 0 72 . 72 VAL A CB 582 14.11 1.0 ? 72 A 416 -3.311 -6.721 -2.237 1 ATOM C CG1 . VAL A 0 72 . 72 VAL A CG1 583 73.25 1.0 ? 72 A 417 -4.491 -6.474 -3.177 1 ATOM C CG2 . VAL A 0 72 . 72 VAL A CG2 584 13.24 1.0 ? 72 A 418 -2.681 -5.4 -1.796 1 ATOM N N . THR A 0 73 . 73 THR A N 585 12.25 1.0 ? 73 A 419 -4.499 -6.326 0.951 1 ATOM C CA . THR A 0 73 . 73 THR A CA 586 43.31 1.0 ? 73 A 420 -5.434 -5.524 1.752 1 ATOM C C . THR A 0 73 . 73 THR A C 587 42.41 1.0 ? 73 A 421 -4.773 -4.213 2.187 1 ATOM O O . THR A 0 73 . 73 THR A O 588 10.03 1.0 ? 73 A 422 -3.752 -4.219 2.868 1 ATOM C CB . THR A 0 73 . 73 THR A CB 589 12.11 1.0 ? 73 A 423 -5.928 -6.298 3.003 1 ATOM O OG1 . THR A 0 73 . 73 THR A OG1 590 43.11 1.0 ? 73 A 424 -4.816 -6.696 3.82 1 ATOM C CG2 . THR A 0 73 . 73 THR A CG2 591 44.12 1.0 ? 73 A 425 -6.727 -7.537 2.604 1 ATOM N N . TYR A 0 74 . 74 TYR A N 592 14.22 1.0 ? 74 A 426 -5.356 -3.087 1.796 1 ATOM C CA . TYR A 0 74 . 74 TYR A CA 593 2.41 1.0 ? 74 A 427 -4.752 -1.776 2.061 1 ATOM C C . TYR A 0 74 . 74 TYR A C 594 31.32 1.0 ? 74 A 428 -5.678 -0.872 2.888 1 ATOM O O . TYR A 0 74 . 74 TYR A O 595 24.33 1.0 ? 74 A 429 -6.778 -0.53 2.46 1 ATOM C CB . TYR A 0 74 . 74 TYR A CB 596 71.53 1.0 ? 74 A 430 -4.361 -1.093 0.735 1 ATOM C CG . TYR A 0 74 . 74 TYR A CG 597 21.1 1.0 ? 74 A 431 -5.449 -1.115 -0.33 1 ATOM C CD1 . TYR A 0 74 . 74 TYR A CD1 598 13.34 1.0 ? 74 A 432 -5.614 -2.224 -1.156 1 ATOM C CD2 . TYR A 0 74 . 74 TYR A CD2 599 21.43 1.0 ? 74 A 433 -6.311 -0.033 -0.51 1 ATOM C CE1 . TYR A 0 74 . 74 TYR A CE1 600 72.12 1.0 ? 74 A 434 -6.598 -2.255 -2.124 1 ATOM C CE2 . TYR A 0 74 . 74 TYR A CE2 601 62.24 1.0 ? 74 A 435 -7.299 -0.06 -1.477 1 ATOM C CZ . TYR A 0 74 . 74 TYR A CZ 602 75.44 1.0 ? 74 A 436 -7.439 -1.174 -2.28 1 ATOM O OH . TYR A 0 74 . 74 TYR A OH 603 4.32 1.0 ? 74 A 437 -8.427 -1.207 -3.242 1 ATOM N N . THR A 0 75 . 75 THR A N 604 74.53 1.0 ? 75 A 438 -5.227 -0.495 4.084 1 ATOM C CA . THR A 0 75 . 75 THR A CA 605 61.31 1.0 ? 75 A 439 -6.003 0.384 4.971 1 ATOM C C . THR A 0 75 . 75 THR A C 606 42.52 1.0 ? 75 A 440 -5.521 1.839 4.865 1 ATOM O O . THR A 0 75 . 75 THR A O 607 23.22 1.0 ? 75 A 441 -4.374 2.152 5.194 1 ATOM C CB . THR A 0 75 . 75 THR A CB 608 60.05 1.0 ? 75 A 442 -5.905 -0.067 6.453 1 ATOM O OG1 . THR A 0 75 . 75 THR A OG1 609 54.01 1.0 ? 75 A 443 -6.356 -1.424 6.59 1 ATOM C CG2 . THR A 0 75 . 75 THR A CG2 610 40.25 1.0 ? 75 A 444 -6.732 0.834 7.368 1 ATOM N N . ILE A 0 76 . 76 ILE A N 611 44.14 1.0 ? 76 A 445 -6.401 2.722 4.404 1 ATOM C CA . ILE A 0 76 . 76 ILE A CA 612 43.11 1.0 ? 76 A 446 -6.069 4.143 4.261 1 ATOM C C . ILE A 0 76 . 76 ILE A C 613 4.14 1.0 ? 76 A 447 -6.214 4.881 5.601 1 ATOM O O . ILE A 0 76 . 76 ILE A O 614 35.03 1.0 ? 76 A 448 -7.32 5.032 6.119 1 ATOM C CB . ILE A 0 76 . 76 ILE A CB 615 23.03 1.0 ? 76 A 449 -6.979 4.825 3.206 1 ATOM C CG1 . ILE A 0 76 . 76 ILE A CG1 616 24.4 1.0 ? 76 A 450 -6.94 4.052 1.873 1 ATOM C CG2 . ILE A 0 76 . 76 ILE A CG2 617 10.3 1.0 ? 76 A 451 -6.566 6.286 3.0 1 ATOM C CD1 . ILE A 0 76 . 76 ILE A CD1 618 40.22 1.0 ? 76 A 452 -5.559 3.955 1.253 1 ATOM N N . ARG A 0 77 . 77 ARG A N 619 44.01 1.0 ? 77 A 453 -5.098 5.336 6.166 1 ATOM C CA . ARG A 0 77 . 77 ARG A CA 620 12.33 1.0 ? 77 A 454 -5.122 6.05 7.45 1 ATOM C C . ARG A 0 77 . 77 ARG A C 621 61.12 1.0 ? 77 A 455 -5.56 7.508 7.248 1 ATOM O O . ARG A 0 77 . 77 ARG A O 622 31.51 1.0 ? 77 A 456 -4.773 8.352 6.812 1 ATOM C CB . ARG A 0 77 . 77 ARG A CB 623 61.42 1.0 ? 77 A 457 -3.741 5.986 8.122 1 ATOM C CG . ARG A 0 77 . 77 ARG A CG 624 13.31 1.0 ? 77 A 458 -3.185 4.568 8.249 1 ATOM C CD . ARG A 0 77 . 77 ARG A CD 625 44.32 1.0 ? 77 A 459 -4.126 3.645 9.018 1 ATOM N NE . ARG A 0 77 . 77 ARG A NE 626 2.14 1.0 ? 77 A 460 -4.302 4.068 10.405 1 ATOM C CZ . ARG A 0 77 . 77 ARG A CZ 627 23.42 1.0 ? 77 A 461 -5.452 4.116 11.022 1 ATOM N NH1 . ARG A 0 77 . 77 ARG A NH1 628 72.52 1.0 ? 77 A 462 -6.55 3.85 10.395 1 ATOM N NH2 . ARG A 0 77 . 77 ARG A NH2 629 4.44 1.0 +1 77 A 463 -5.497 4.453 12.264 1 ATOM N N . LEU A 0 78 . 78 LEU A N 630 50.44 1.0 ? 78 A 464 -6.821 7.795 7.559 1 ATOM C CA . LEU A 0 78 . 78 LEU A CA 631 72.22 1.0 ? 78 A 465 -7.404 9.114 7.299 1 ATOM C C . LEU A 0 78 . 78 LEU A C 632 3.21 1.0 ? 78 A 466 -7.013 10.149 8.365 1 ATOM O O . LEU A 0 78 . 78 LEU A O 633 41.33 1.0 ? 78 A 467 -7.104 9.891 9.571 1 ATOM C CB . LEU A 0 78 . 78 LEU A CB 634 71.24 1.0 ? 78 A 468 -8.934 9.003 7.217 1 ATOM C CG . LEU A 0 78 . 78 LEU A CG 635 15.42 1.0 ? 78 A 469 -9.469 8.1 6.092 1 ATOM C CD1 . LEU A 0 78 . 78 LEU A CD1 636 13.32 1.0 ? 78 A 470 -10.992 8.024 6.144 1 ATOM C CD2 . LEU A 0 78 . 78 LEU A CD2 637 63.21 1.0 ? 78 A 471 -8.999 8.601 4.727 1 ATOM N N . GLU A 0 79 . 79 GLU A N 638 75.52 1.0 ? 79 A 472 -6.577 11.319 7.905 1 ATOM C CA . GLU A 0 79 . 79 GLU A CA 639 41.24 1.0 ? 79 A 473 -6.297 12.452 8.788 1 ATOM C C . GLU A 0 79 . 79 GLU A C 640 64.14 1.0 ? 79 A 474 -7.6 12.929 9.453 1 ATOM O O . GLU A 0 79 . 79 GLU A O 641 4.01 1.0 ? 79 A 475 -8.529 13.378 8.776 1 ATOM C CB . GLU A 0 79 . 79 GLU A CB 642 75.54 1.0 ? 79 A 476 -5.647 13.588 7.981 1 ATOM C CG . GLU A 0 79 . 79 GLU A CG 643 53.25 1.0 ? 79 A 477 -5.232 14.795 8.813 1 ATOM C CD . GLU A 0 79 . 79 GLU A CD 644 2.42 1.0 ? 79 A 478 -4.597 15.889 7.967 1 ATOM O OE1 . GLU A 0 79 . 79 GLU A OE1 645 74.25 1.0 ? 79 A 479 -3.397 15.784 7.65 1 ATOM O OE2 . GLU A 0 79 . 79 GLU A OE2 646 64.31 1.0 ? 79 A 480 -5.298 16.856 7.605 1 # _cell.length_a 1.0 _cell.length_b 1.0 _cell.length_c 1.0 _cell.angle_alpha 90.0 _cell.angle_beta 90.0 _cell.angle_gamma 90.0 #