# By using this file you agree to the legally binding terms of use found at # https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md. # To request access to the AlphaFold 3 model parameters, follow the process set # out at https://github.com/google-deepmind/alphafold3. You may only use these if # received directly from Google. Use is subject to terms of use available at # https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md. data_spkb18333 # _entry.id spkb18333 # loop_ _atom_type.symbol C N O S # loop_ _audit_author.name _audit_author.pdbx_ordinal "Google DeepMind" 1 "Isomorphic Labs" 2 # _audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/master/dist/mmcif_ma.dic _audit_conform.dict_name mmcif_ma.dic _audit_conform.dict_version 1.4.5 # loop_ _chem_comp.formula _chem_comp.formula_weight _chem_comp.id _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_smiles _chem_comp.pdbx_synonyms _chem_comp.type "C3 H7 N O2 S" 121.158 CYS y CYSTEINE C([C@@H](C(=O)O)N)S ? "L-PEPTIDE LINKING" "C6 H13 N O2" 131.173 ILE y ISOLEUCINE CC[C@H](C)[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C6 H13 N O2" 131.173 LEU y LEUCINE CC(C)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C6 H15 N2 O2" 147.195 LYS y LYSINE C(CC[NH3+])C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C5 H11 N O2 S" 149.211 MET y METHIONINE CSCC[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C9 H11 N O2" 165.189 PHE y PHENYLALANINE c1ccc(cc1)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C3 H7 N O3" 105.093 SER y SERINE C([C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C4 H9 N O3" 119.119 THR y THREONINE C[C@H]([C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C5 H11 N O2" 117.146 VAL y VALINE CC(C)[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" # _citation.book_publisher ? _citation.country UK _citation.id primary _citation.journal_full Nature _citation.journal_id_ASTM NATUAS _citation.journal_id_CSD 0006 _citation.journal_id_ISSN 0028-0836 _citation.journal_volume 630 _citation.page_first 493 _citation.page_last 500 _citation.pdbx_database_id_DOI 10.1038/s41586-024-07487-w _citation.pdbx_database_id_PubMed 38718835 _citation.title "Accurate structure prediction of biomolecular interactions with AlphaFold 3" _citation.year 2024 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary "Google DeepMind" 1 primary "Isomorphic Labs" 2 # _entity.id 1 _entity.pdbx_description . _entity.type polymer # _entity_poly.entity_id 1 _entity_poly.pdbx_strand_id A _entity_poly.type polypeptide(L) # loop_ _entity_poly_seq.entity_id _entity_poly_seq.hetero _entity_poly_seq.mon_id _entity_poly_seq.num 1 n MET 1 1 n MET 2 1 n LYS 3 1 n THR 4 1 n SER 5 1 n VAL 6 1 n MET 7 1 n PHE 8 1 n MET 9 1 n LEU 10 1 n VAL 11 1 n VAL 12 1 n VAL 13 1 n ILE 14 1 n SER 15 1 n LEU 16 1 n MET 17 1 n CYS 18 1 n SER 19 1 n SER 20 # _ma_data.content_type "model coordinates" _ma_data.id 1 _ma_data.name Model # _ma_model_list.data_id 1 _ma_model_list.model_group_id 1 _ma_model_list.model_group_name "AlphaFold-beta-20231127 (3.0.0 @ 2025-07-05 11:46:17)" _ma_model_list.model_id 1 _ma_model_list.model_name "Top ranked model" _ma_model_list.model_type "Ab initio model" _ma_model_list.ordinal_id 1 # loop_ _ma_protocol_step.method_type _ma_protocol_step.ordinal_id _ma_protocol_step.protocol_id _ma_protocol_step.step_id "coevolution MSA" 1 1 1 "template search" 2 1 2 modeling 3 1 3 # loop_ _ma_qa_metric.id _ma_qa_metric.mode _ma_qa_metric.name _ma_qa_metric.software_group_id _ma_qa_metric.type 1 global pLDDT 1 pLDDT 2 local pLDDT 1 pLDDT # _ma_qa_metric_global.metric_id 1 _ma_qa_metric_global.metric_value 91.22 _ma_qa_metric_global.model_id 1 _ma_qa_metric_global.ordinal_id 1 # loop_ _ma_qa_metric_local.label_asym_id _ma_qa_metric_local.label_comp_id _ma_qa_metric_local.label_seq_id _ma_qa_metric_local.metric_id _ma_qa_metric_local.metric_value _ma_qa_metric_local.model_id _ma_qa_metric_local.ordinal_id A MET 1 2 84.71 1 1 A MET 2 2 84.10 1 2 A LYS 3 2 84.89 1 3 A THR 4 2 90.01 1 4 A SER 5 2 92.10 1 5 A VAL 6 2 93.39 1 6 A MET 7 2 87.28 1 7 A PHE 8 2 92.32 1 8 A MET 9 2 88.15 1 9 A LEU 10 2 92.44 1 10 A VAL 11 2 96.12 1 11 A VAL 12 2 96.11 1 12 A VAL 13 2 96.32 1 13 A ILE 14 2 96.38 1 14 A SER 15 2 95.38 1 15 A LEU 16 2 94.83 1 16 A MET 17 2 91.58 1 17 A CYS 18 2 94.99 1 18 A SER 19 2 91.66 1 19 A SER 20 2 85.67 1 20 # _ma_software_group.group_id 1 _ma_software_group.ordinal_id 1 _ma_software_group.software_id 1 # _ma_target_entity.data_id 1 _ma_target_entity.entity_id 1 _ma_target_entity.origin . # _ma_target_entity_instance.asym_id A _ma_target_entity_instance.details . _ma_target_entity_instance.entity_id 1 # loop_ _pdbx_data_usage.details _pdbx_data_usage.id _pdbx_data_usage.type _pdbx_data_usage.url ;Non-commercial use only, by using this file you agree to the terms of use found at https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md. To request access to the AlphaFold 3 model parameters, follow the process set out at https://github.com/google-deepmind/alphafold3. You may only use these if received directly from Google. Use is subject to terms of use available at https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md. ; 1 license https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md ;AlphaFold 3 and its output are not intended for, have not been validated for, and are not approved for clinical use. They are provided "as-is" without any warranty of any kind, whether expressed or implied. No warranty is given that use shall not infringe the rights of any third party. ; 2 disclaimer ? # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.hetero _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.seq_id A 1 1 n MET . 1 A 1 A 2 1 n MET . 2 A 2 A 3 1 n LYS . 3 A 3 A 4 1 n THR . 4 A 4 A 5 1 n SER . 5 A 5 A 6 1 n VAL . 6 A 6 A 7 1 n MET . 7 A 7 A 8 1 n PHE . 8 A 8 A 9 1 n MET . 9 A 9 A 10 1 n LEU . 10 A 10 A 11 1 n VAL . 11 A 11 A 12 1 n VAL . 12 A 12 A 13 1 n VAL . 13 A 13 A 14 1 n ILE . 14 A 14 A 15 1 n SER . 15 A 15 A 16 1 n LEU . 16 A 16 A 17 1 n MET . 17 A 17 A 18 1 n CYS . 18 A 18 A 19 1 n SER . 19 A 19 A 20 1 n SER . 20 A 20 # _software.classification other _software.date ? _software.description "Structure prediction" _software.name AlphaFold _software.pdbx_ordinal 1 _software.type package _software.version "AlphaFold-beta-20231127 (9ceee3b5f7825b611ab42eaad843248507ced2da1e745fa3b3d93c6c4ad3ca74)" # _struct_asym.entity_id 1 _struct_asym.id A # loop_ _atom_site.group_PDB _atom_site.id _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.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.auth_seq_id _atom_site.auth_asym_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . MET A 1 1 ? 1.708 13.936 5.215 1.00 92.38 1 A 1 ATOM 2 C CA . MET A 1 1 ? 1.245 13.270 3.977 1.00 94.18 1 A 1 ATOM 3 C C . MET A 1 1 ? 0.750 11.856 4.280 1.00 93.89 1 A 1 ATOM 4 O O . MET A 1 1 ? 1.336 10.883 3.842 1.00 89.84 1 A 1 ATOM 5 C CB . MET A 1 1 ? 2.363 13.240 2.933 1.00 89.42 1 A 1 ATOM 6 C CG . MET A 1 1 ? 2.619 14.605 2.314 1.00 78.80 1 A 1 ATOM 7 S SD . MET A 1 1 ? 4.013 14.560 1.182 1.00 72.13 1 A 1 ATOM 8 C CE . MET A 1 1 ? 3.854 16.142 0.380 1.00 67.06 1 A 1 ATOM 9 N N . MET A 1 2 ? -0.299 11.746 5.068 1.00 93.08 2 A 1 ATOM 10 C CA . MET A 1 2 ? -0.795 10.445 5.548 1.00 94.31 2 A 1 ATOM 11 C C . MET A 1 2 ? -1.485 9.646 4.432 1.00 94.00 2 A 1 ATOM 12 O O . MET A 1 2 ? -1.398 8.426 4.381 1.00 91.18 2 A 1 ATOM 13 C CB . MET A 1 2 ? -1.727 10.711 6.738 1.00 90.66 2 A 1 ATOM 14 C CG . MET A 1 2 ? -1.713 9.574 7.752 1.00 78.07 2 A 1 ATOM 15 S SD . MET A 1 2 ? -2.545 10.039 9.282 1.00 67.41 2 A 1 ATOM 16 C CE . MET A 1 2 ? -2.321 8.560 10.261 1.00 64.09 2 A 1 ATOM 17 N N . LYS A 1 3 ? -2.100 10.344 3.476 1.00 93.47 3 A 1 ATOM 18 C CA . LYS A 1 3 ? -2.836 9.731 2.364 1.00 95.26 3 A 1 ATOM 19 C C . LYS A 1 3 ? -1.925 8.953 1.407 1.00 95.04 3 A 1 ATOM 20 O O . LYS A 1 3 ? -2.284 7.866 0.962 1.00 93.78 3 A 1 ATOM 21 C CB . LYS A 1 3 ? -3.631 10.826 1.633 1.00 92.78 3 A 1 ATOM 22 C CG . LYS A 1 3 ? -5.088 10.421 1.429 1.00 82.01 3 A 1 ATOM 23 C CD . LYS A 1 3 ? -5.900 11.544 0.794 1.00 78.88 3 A 1 ATOM 24 C CE . LYS A 1 3 ? -7.366 11.129 0.654 1.00 70.03 3 A 1 ATOM 25 N NZ . LYS A 1 3 ? -8.205 12.190 0.051 1.00 62.79 3 A 1 ATOM 26 N N . THR A 1 4 ? -0.743 9.461 1.132 1.00 93.68 4 A 1 ATOM 27 C CA . THR A 1 4 ? 0.230 8.812 0.246 1.00 95.32 4 A 1 ATOM 28 C C . THR A 1 4 ? 0.778 7.524 0.857 1.00 95.65 4 A 1 ATOM 29 O O . THR A 1 4 ? 0.961 6.537 0.149 1.00 93.91 4 A 1 ATOM 30 C CB . THR A 1 4 ? 1.389 9.769 -0.058 1.00 93.86 4 A 1 ATOM 31 O OG1 . THR A 1 4 ? 0.914 11.093 -0.211 1.00 79.83 4 A 1 ATOM 32 C CG2 . THR A 1 4 ? 2.110 9.380 -1.339 1.00 77.85 4 A 1 ATOM 33 N N . SER A 1 5 ? 0.978 7.505 2.165 1.00 94.90 5 A 1 ATOM 34 C CA . SER A 1 5 ? 1.436 6.318 2.893 1.00 95.20 5 A 1 ATOM 35 C C . SER A 1 5 ? 0.392 5.195 2.853 1.00 95.55 5 A 1 ATOM 36 O O . SER A 1 5 ? 0.742 4.037 2.653 1.00 94.57 5 A 1 ATOM 37 C CB . SER A 1 5 ? 1.757 6.698 4.338 1.00 93.58 5 A 1 ATOM 38 O OG . SER A 1 5 ? 2.399 5.634 4.989 1.00 78.79 5 A 1 ATOM 39 N N . VAL A 1 6 ? -0.878 5.534 2.969 1.00 95.48 6 A 1 ATOM 40 C CA . VAL A 1 6 ? -1.983 4.572 2.875 1.00 95.47 6 A 1 ATOM 41 C C . VAL A 1 6 ? -2.057 3.959 1.474 1.00 95.97 6 A 1 ATOM 42 O O . VAL A 1 6 ? -2.211 2.745 1.348 1.00 95.16 6 A 1 ATOM 43 C CB . VAL A 1 6 ? -3.316 5.235 3.257 1.00 94.57 6 A 1 ATOM 44 C CG1 . VAL A 1 6 ? -4.502 4.292 3.087 1.00 88.21 6 A 1 ATOM 45 C CG2 . VAL A 1 6 ? -3.289 5.680 4.723 1.00 88.85 6 A 1 ATOM 46 N N . MET A 1 7 ? -1.892 4.767 0.429 1.00 93.48 7 A 1 ATOM 47 C CA . MET A 1 7 ? -1.869 4.271 -0.950 1.00 94.33 7 A 1 ATOM 48 C C . MET A 1 7 ? -0.709 3.302 -1.181 1.00 95.06 7 A 1 ATOM 49 O O . MET A 1 7 ? -0.888 2.261 -1.804 1.00 94.75 7 A 1 ATOM 50 C CB . MET A 1 7 ? -1.782 5.450 -1.926 1.00 93.89 7 A 1 ATOM 51 C CG . MET A 1 7 ? -3.069 6.285 -1.922 1.00 84.34 7 A 1 ATOM 52 S SD . MET A 1 7 ? -4.504 5.408 -2.576 1.00 75.68 7 A 1 ATOM 53 C CE . MET A 1 7 ? -5.784 6.635 -2.285 1.00 66.75 7 A 1 ATOM 54 N N . PHE A 1 8 ? 0.461 3.605 -0.627 1.00 95.35 8 A 1 ATOM 55 C CA . PHE A 1 8 ? 1.620 2.727 -0.715 1.00 95.86 8 A 1 ATOM 56 C C . PHE A 1 8 ? 1.379 1.401 0.015 1.00 96.39 8 A 1 ATOM 57 O O . PHE A 1 8 ? 1.645 0.339 -0.545 1.00 96.12 8 A 1 ATOM 58 C CB . PHE A 1 8 ? 2.838 3.458 -0.163 1.00 95.84 8 A 1 ATOM 59 C CG . PHE A 1 8 ? 4.114 2.680 -0.379 1.00 93.26 8 A 1 ATOM 60 C CD1 . PHE A 1 8 ? 4.656 1.905 0.657 1.00 89.21 8 A 1 ATOM 61 C CD2 . PHE A 1 8 ? 4.735 2.705 -1.635 1.00 89.90 8 A 1 ATOM 62 C CE1 . PHE A 1 8 ? 5.820 1.161 0.446 1.00 87.80 8 A 1 ATOM 63 C CE2 . PHE A 1 8 ? 5.899 1.959 -1.850 1.00 87.53 8 A 1 ATOM 64 C CZ . PHE A 1 8 ? 6.439 1.189 -0.812 1.00 88.30 8 A 1 ATOM 65 N N . MET A 1 9 ? 0.820 1.442 1.226 1.00 94.63 9 A 1 ATOM 66 C CA . MET A 1 9 ? 0.453 0.223 1.957 1.00 94.79 9 A 1 ATOM 67 C C . MET A 1 9 ? -0.540 -0.634 1.174 1.00 95.52 9 A 1 ATOM 68 O O . MET A 1 9 ? -0.381 -1.847 1.123 1.00 94.32 9 A 1 ATOM 69 C CB . MET A 1 9 ? -0.147 0.576 3.320 1.00 94.57 9 A 1 ATOM 70 C CG . MET A 1 9 ? 0.932 0.823 4.367 1.00 86.49 9 A 1 ATOM 71 S SD . MET A 1 9 ? 0.255 0.863 6.044 1.00 77.55 9 A 1 ATOM 72 C CE . MET A 1 9 ? 1.777 0.900 7.005 1.00 67.36 9 A 1 ATOM 73 N N . LEU A 1 10 ? -1.508 -0.015 0.527 1.00 96.35 10 A 1 ATOM 74 C CA . LEU A 1 10 ? -2.496 -0.716 -0.285 1.00 96.32 10 A 1 ATOM 75 C C . LEU A 1 10 ? -1.836 -1.458 -1.448 1.00 96.75 10 A 1 ATOM 76 O O . LEU A 1 10 ? -2.121 -2.633 -1.668 1.00 96.56 10 A 1 ATOM 77 C CB . LEU A 1 10 ? -3.534 0.313 -0.764 1.00 95.94 10 A 1 ATOM 78 C CG . LEU A 1 10 ? -4.971 -0.111 -0.444 1.00 87.90 10 A 1 ATOM 79 C CD1 . LEU A 1 10 ? -5.882 1.111 -0.419 1.00 83.22 10 A 1 ATOM 80 C CD2 . LEU A 1 10 ? -5.505 -1.103 -1.459 1.00 86.51 10 A 1 ATOM 81 N N . VAL A 1 11 ? -0.910 -0.818 -2.134 1.00 97.29 11 A 1 ATOM 82 C CA . VAL A 1 11 ? -0.148 -1.442 -3.224 1.00 97.25 11 A 1 ATOM 83 C C . VAL A 1 11 ? 0.692 -2.613 -2.713 1.00 97.54 11 A 1 ATOM 84 O O . VAL A 1 11 ? 0.708 -3.668 -3.340 1.00 96.91 11 A 1 ATOM 85 C CB . VAL A 1 11 ? 0.734 -0.401 -3.931 1.00 96.59 11 A 1 ATOM 86 C CG1 . VAL A 1 11 ? 1.666 -1.037 -4.959 1.00 93.63 11 A 1 ATOM 87 C CG2 . VAL A 1 11 ? -0.139 0.617 -4.663 1.00 93.65 11 A 1 ATOM 88 N N . VAL A 1 12 ? 1.345 -2.461 -1.575 1.00 97.29 12 A 1 ATOM 89 C CA . VAL A 1 12 ? 2.146 -3.532 -0.967 1.00 97.32 12 A 1 ATOM 90 C C . VAL A 1 12 ? 1.268 -4.728 -0.594 1.00 97.61 12 A 1 ATOM 91 O O . VAL A 1 12 ? 1.630 -5.862 -0.899 1.00 97.02 12 A 1 ATOM 92 C CB . VAL A 1 12 ? 2.918 -3.011 0.258 1.00 96.69 12 A 1 ATOM 93 C CG1 . VAL A 1 12 ? 3.610 -4.135 1.034 1.00 93.45 12 A 1 ATOM 94 C CG2 . VAL A 1 12 ? 4.000 -2.025 -0.181 1.00 93.39 12 A 1 ATOM 95 N N . VAL A 1 13 ? 0.117 -4.492 0.000 1.00 97.66 13 A 1 ATOM 96 C CA . VAL A 1 13 ? -0.826 -5.555 0.370 1.00 97.56 13 A 1 ATOM 97 C C . VAL A 1 13 ? -1.336 -6.288 -0.869 1.00 97.72 13 A 1 ATOM 98 O O . VAL A 1 13 ? -1.336 -7.517 -0.887 1.00 96.95 13 A 1 ATOM 99 C CB . VAL A 1 13 ? -1.987 -4.987 1.204 1.00 96.84 13 A 1 ATOM 100 C CG1 . VAL A 1 13 ? -3.096 -6.014 1.442 1.00 93.55 13 A 1 ATOM 101 C CG2 . VAL A 1 13 ? -1.484 -4.547 2.582 1.00 93.94 13 A 1 ATOM 102 N N . ILE A 1 14 ? -1.711 -5.575 -1.914 1.00 97.67 14 A 1 ATOM 103 C CA . ILE A 1 14 ? -2.154 -6.180 -3.174 1.00 97.49 14 A 1 ATOM 104 C C . ILE A 1 14 ? -1.022 -7.009 -3.789 1.00 97.69 14 A 1 ATOM 105 O O . ILE A 1 14 ? -1.255 -8.144 -4.203 1.00 97.27 14 A 1 ATOM 106 C CB . ILE A 1 14 ? -2.661 -5.094 -4.142 1.00 97.13 14 A 1 ATOM 107 C CG1 . ILE A 1 14 ? -3.977 -4.480 -3.613 1.00 95.68 14 A 1 ATOM 108 C CG2 . ILE A 1 14 ? -2.900 -5.674 -5.546 1.00 95.24 14 A 1 ATOM 109 C CD1 . ILE A 1 14 ? -4.351 -3.168 -4.288 1.00 92.89 14 A 1 ATOM 110 N N . SER A 1 15 ? 0.192 -6.492 -3.809 1.00 97.26 15 A 1 ATOM 111 C CA . SER A 1 15 ? 1.352 -7.215 -4.332 1.00 97.26 15 A 1 ATOM 112 C C . SER A 1 15 ? 1.618 -8.498 -3.543 1.00 97.42 15 A 1 ATOM 113 O O . SER A 1 15 ? 1.921 -9.525 -4.139 1.00 96.62 15 A 1 ATOM 114 C CB . SER A 1 15 ? 2.597 -6.328 -4.298 1.00 96.64 15 A 1 ATOM 115 O OG . SER A 1 15 ? 2.424 -5.189 -5.110 1.00 87.08 15 A 1 ATOM 116 N N . LEU A 1 16 ? 1.463 -8.461 -2.226 1.00 97.92 16 A 1 ATOM 117 C CA . LEU A 1 16 ? 1.609 -9.634 -1.368 1.00 97.65 16 A 1 ATOM 118 C C . LEU A 1 16 ? 0.530 -10.681 -1.666 1.00 97.68 16 A 1 ATOM 119 O O . LEU A 1 16 ? 0.840 -11.868 -1.775 1.00 96.87 16 A 1 ATOM 120 C CB . LEU A 1 16 ? 1.548 -9.175 0.099 1.00 97.11 16 A 1 ATOM 121 C CG . LEU A 1 16 ? 2.184 -10.198 1.058 1.00 92.61 16 A 1 ATOM 122 C CD1 . LEU A 1 16 ? 3.696 -9.983 1.146 1.00 88.88 16 A 1 ATOM 123 C CD2 . LEU A 1 16 ? 1.598 -10.043 2.459 1.00 89.90 16 A 1 ATOM 124 N N . MET A 1 17 ? -0.711 -10.250 -1.829 1.00 97.52 17 A 1 ATOM 125 C CA . MET A 1 17 ? -1.833 -11.132 -2.165 1.00 97.39 17 A 1 ATOM 126 C C . MET A 1 17 ? -1.688 -11.740 -3.563 1.00 97.32 17 A 1 ATOM 127 O O . MET A 1 17 ? -2.010 -12.906 -3.759 1.00 96.14 17 A 1 ATOM 128 C CB . MET A 1 17 ? -3.146 -10.340 -2.063 1.00 96.55 17 A 1 ATOM 129 C CG . MET A 1 17 ? -3.489 -9.979 -0.608 1.00 92.83 17 A 1 ATOM 130 S SD . MET A 1 17 ? -3.989 -11.395 0.391 1.00 81.54 17 A 1 ATOM 131 C CE . MET A 1 17 ? -4.059 -10.628 2.021 1.00 73.34 17 A 1 ATOM 132 N N . CYS A 1 18 ? -1.170 -10.985 -4.527 1.00 97.28 18 A 1 ATOM 133 C CA . CYS A 1 18 ? -0.920 -11.480 -5.881 1.00 97.07 18 A 1 ATOM 134 C C . CYS A 1 18 ? 0.321 -12.382 -5.979 1.00 96.86 18 A 1 ATOM 135 O O . CYS A 1 18 ? 0.444 -13.129 -6.945 1.00 95.10 18 A 1 ATOM 136 C CB . CYS A 1 18 ? -0.778 -10.287 -6.835 1.00 95.53 18 A 1 ATOM 137 S SG . CYS A 1 18 ? -2.394 -9.530 -7.168 1.00 88.08 18 A 1 ATOM 138 N N . SER A 1 19 ? 1.234 -12.298 -5.020 1.00 96.92 19 A 1 ATOM 139 C CA . SER A 1 19 ? 2.456 -13.113 -4.987 1.00 95.99 19 A 1 ATOM 140 C C . SER A 1 19 ? 2.261 -14.467 -4.295 1.00 94.57 19 A 1 ATOM 141 O O . SER A 1 19 ? 3.225 -15.228 -4.176 1.00 88.79 19 A 1 ATOM 142 C CB . SER A 1 19 ? 3.586 -12.315 -4.323 1.00 93.62 19 A 1 ATOM 143 O OG . SER A 1 19 ? 4.830 -12.953 -4.515 1.00 80.04 19 A 1 ATOM 144 N N . SER A 1 20 ? 1.079 -14.753 -3.804 1.00 94.74 20 A 1 ATOM 145 C CA . SER A 1 20 ? 0.721 -15.978 -3.091 1.00 92.66 20 A 1 ATOM 146 C C . SER A 1 20 ? -0.330 -16.795 -3.837 1.00 87.43 20 A 1 ATOM 147 O O . SER A 1 20 ? -0.939 -16.267 -4.795 1.00 79.67 20 A 1 ATOM 148 C CB . SER A 1 20 ? 0.257 -15.640 -1.671 1.00 88.13 20 A 1 ATOM 149 O OG . SER A 1 20 ? 0.293 -16.812 -0.876 1.00 77.60 20 A 1 ATOM 150 O OXT . SER A 1 20 ? -0.560 -17.937 -3.448 1.00 79.47 20 A 1 #