# 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_spkb33366 # _entry.id spkb33366 # 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" 89.093 ALA y ALANINE C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C3 H7 N O2 S" 121.158 CYS y CYSTEINE C([C@@H](C(=O)O)N)S ? "L-PEPTIDE LINKING" "C2 H5 N O2" 75.067 GLY y GLYCINE C(C(=O)O)N ? "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" "C4 H9 N O3" 119.119 THR y THREONINE C[C@H]([C@@H](C(=O)O)N)O ? "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 LYS 2 1 n PHE 3 1 n LEU 4 1 n LEU 5 1 n PHE 6 1 n CYS 7 1 n CYS 8 1 n LEU 9 1 n PHE 10 1 n GLY 11 1 n THR 12 1 n PHE 13 1 n LEU 14 1 n ALA 15 1 n THR 16 1 n GLY 17 1 n MET 18 1 n CYS 19 # _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 @ 2025-07-02 12:44:18)" _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 82.50 _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 73.38 1 1 A LYS 2 2 77.36 1 2 A PHE 3 2 76.44 1 3 A LEU 4 2 78.39 1 4 A LEU 5 2 79.88 1 5 A PHE 6 2 86.21 1 6 A CYS 7 2 88.86 1 7 A CYS 8 2 89.69 1 8 A LEU 9 2 87.10 1 9 A PHE 10 2 86.61 1 10 A GLY 11 2 90.99 1 11 A THR 12 2 87.74 1 12 A PHE 13 2 86.86 1 13 A LEU 14 2 87.11 1 14 A ALA 15 2 88.91 1 15 A THR 16 2 82.48 1 16 A GLY 17 2 83.91 1 17 A MET 18 2 71.38 1 18 A CYS 19 2 72.61 1 19 # _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 LYS . 2 A 2 A 3 1 n PHE . 3 A 3 A 4 1 n LEU . 4 A 4 A 5 1 n LEU . 5 A 5 A 6 1 n PHE . 6 A 6 A 7 1 n CYS . 7 A 7 A 8 1 n CYS . 8 A 8 A 9 1 n LEU . 9 A 9 A 10 1 n PHE . 10 A 10 A 11 1 n GLY . 11 A 11 A 12 1 n THR . 12 A 12 A 13 1 n PHE . 13 A 13 A 14 1 n LEU . 14 A 14 A 15 1 n ALA . 15 A 15 A 16 1 n THR . 16 A 16 A 17 1 n GLY . 17 A 17 A 18 1 n MET . 18 A 18 A 19 1 n CYS . 19 A 19 # _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 ? -8.459 10.228 8.971 1.00 78.78 1 A 1 ATOM 2 C CA . MET A 1 1 ? -7.023 10.544 8.739 1.00 80.61 1 A 1 ATOM 3 C C . MET A 1 1 ? -6.613 10.141 7.320 1.00 82.37 1 A 1 ATOM 4 O O . MET A 1 1 ? -7.314 9.387 6.662 1.00 78.12 1 A 1 ATOM 5 C CB . MET A 1 1 ? -6.181 9.789 9.754 1.00 74.40 1 A 1 ATOM 6 C CG . MET A 1 1 ? -6.697 10.096 11.161 1.00 70.33 1 A 1 ATOM 7 S SD . MET A 1 1 ? -5.422 10.005 12.398 1.00 64.81 1 A 1 ATOM 8 C CE . MET A 1 1 ? -6.197 10.978 13.677 1.00 57.58 1 A 1 ATOM 9 N N . LYS A 1 2 ? -5.493 10.657 6.866 1.00 84.85 2 A 1 ATOM 10 C CA . LYS A 1 2 ? -5.032 10.368 5.503 1.00 84.82 2 A 1 ATOM 11 C C . LYS A 1 2 ? -3.998 9.238 5.470 1.00 85.66 2 A 1 ATOM 12 O O . LYS A 1 2 ? -3.734 8.668 4.423 1.00 85.63 2 A 1 ATOM 13 C CB . LYS A 1 2 ? -4.431 11.642 4.910 1.00 82.35 2 A 1 ATOM 14 C CG . LYS A 1 2 ? -4.934 11.873 3.501 1.00 75.41 2 A 1 ATOM 15 C CD . LYS A 1 2 ? -3.943 12.702 2.713 1.00 71.66 2 A 1 ATOM 16 C CE . LYS A 1 2 ? -4.200 12.576 1.227 1.00 66.32 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? -3.369 13.558 0.486 1.00 59.57 2 A 1 ATOM 18 N N . PHE A 1 3 ? -3.437 8.935 6.603 1.00 78.43 3 A 1 ATOM 19 C CA . PHE A 1 3 ? -2.429 7.869 6.670 1.00 80.38 3 A 1 ATOM 20 C C . PHE A 1 3 ? -3.025 6.525 6.279 1.00 84.00 3 A 1 ATOM 21 O O . PHE A 1 3 ? -2.311 5.599 5.909 1.00 82.10 3 A 1 ATOM 22 C CB . PHE A 1 3 ? -1.870 7.790 8.087 1.00 79.26 3 A 1 ATOM 23 C CG . PHE A 1 3 ? -0.609 8.610 8.221 1.00 75.33 3 A 1 ATOM 24 C CD1 . PHE A 1 3 ? 0.430 8.448 7.318 1.00 73.03 3 A 1 ATOM 25 C CD2 . PHE A 1 3 ? -0.478 9.529 9.253 1.00 73.68 3 A 1 ATOM 26 C CE1 . PHE A 1 3 ? 1.592 9.195 7.441 1.00 71.39 3 A 1 ATOM 27 C CE2 . PHE A 1 3 ? 0.682 10.278 9.386 1.00 72.88 3 A 1 ATOM 28 C CZ . PHE A 1 3 ? 1.719 10.111 8.479 1.00 70.37 3 A 1 ATOM 29 N N . LEU A 1 4 ? -4.338 6.428 6.356 1.00 80.56 4 A 1 ATOM 30 C CA . LEU A 1 4 ? -5.016 5.187 5.987 1.00 81.31 4 A 1 ATOM 31 C C . LEU A 1 4 ? -4.778 4.886 4.512 1.00 83.70 4 A 1 ATOM 32 O O . LEU A 1 4 ? -4.834 3.735 4.083 1.00 83.89 4 A 1 ATOM 33 C CB . LEU A 1 4 ? -6.517 5.330 6.268 1.00 81.11 4 A 1 ATOM 34 C CG . LEU A 1 4 ? -6.945 4.642 7.565 1.00 74.82 4 A 1 ATOM 35 C CD1 . LEU A 1 4 ? -6.733 3.141 7.450 1.00 71.09 4 A 1 ATOM 36 C CD2 . LEU A 1 4 ? -6.155 5.184 8.743 1.00 70.66 4 A 1 ATOM 37 N N . LEU A 1 5 ? -4.518 5.936 3.753 1.00 82.92 5 A 1 ATOM 38 C CA . LEU A 1 5 ? -4.265 5.782 2.316 1.00 83.35 5 A 1 ATOM 39 C C . LEU A 1 5 ? -2.971 5.007 2.091 1.00 85.14 5 A 1 ATOM 40 O O . LEU A 1 5 ? -2.912 4.082 1.283 1.00 84.16 5 A 1 ATOM 41 C CB . LEU A 1 5 ? -4.164 7.174 1.685 1.00 83.30 5 A 1 ATOM 42 C CG . LEU A 1 5 ? -5.099 7.338 0.490 1.00 75.08 5 A 1 ATOM 43 C CD1 . LEU A 1 5 ? -5.225 8.817 0.140 1.00 71.90 5 A 1 ATOM 44 C CD2 . LEU A 1 5 ? -4.559 6.573 -0.709 1.00 73.17 5 A 1 ATOM 45 N N . PHE A 1 6 ? -1.941 5.396 2.815 1.00 89.17 6 A 1 ATOM 46 C CA . PHE A 1 6 ? -0.646 4.714 2.695 1.00 88.77 6 A 1 ATOM 47 C C . PHE A 1 6 ? -0.752 3.301 3.245 1.00 90.06 6 A 1 ATOM 48 O O . PHE A 1 6 ? -0.176 2.363 2.703 1.00 88.17 6 A 1 ATOM 49 C CB . PHE A 1 6 ? 0.402 5.498 3.483 1.00 88.62 6 A 1 ATOM 50 C CG . PHE A 1 6 ? 1.564 5.897 2.608 1.00 87.40 6 A 1 ATOM 51 C CD1 . PHE A 1 6 ? 1.440 6.951 1.716 1.00 84.11 6 A 1 ATOM 52 C CD2 . PHE A 1 6 ? 2.769 5.206 2.689 1.00 83.84 6 A 1 ATOM 53 C CE1 . PHE A 1 6 ? 2.515 7.317 0.913 1.00 83.13 6 A 1 ATOM 54 C CE2 . PHE A 1 6 ? 3.848 5.573 1.887 1.00 83.11 6 A 1 ATOM 55 C CZ . PHE A 1 6 ? 3.722 6.630 0.998 1.00 81.96 6 A 1 ATOM 56 N N . CYS A 1 7 ? -1.499 3.165 4.317 1.00 90.57 7 A 1 ATOM 57 C CA . CYS A 1 7 ? -1.683 1.847 4.931 1.00 90.23 7 A 1 ATOM 58 C C . CYS A 1 7 ? -2.458 0.945 3.977 1.00 91.38 7 A 1 ATOM 59 O O . CYS A 1 7 ? -2.172 -0.241 3.858 1.00 89.65 7 A 1 ATOM 60 C CB . CYS A 1 7 ? -2.440 2.009 6.245 1.00 88.09 7 A 1 ATOM 61 S SG . CYS A 1 7 ? -1.773 0.915 7.512 1.00 83.24 7 A 1 ATOM 62 N N . CYS A 1 8 ? -3.443 1.523 3.313 1.00 90.44 8 A 1 ATOM 63 C CA . CYS A 1 8 ? -4.251 0.762 2.358 1.00 90.98 8 A 1 ATOM 64 C C . CYS A 1 8 ? -3.403 0.409 1.140 1.00 92.16 8 A 1 ATOM 65 O O . CYS A 1 8 ? -3.444 -0.711 0.638 1.00 90.38 8 A 1 ATOM 66 C CB . CYS A 1 8 ? -5.453 1.605 1.937 1.00 89.07 8 A 1 ATOM 67 S SG . CYS A 1 8 ? -6.919 0.578 1.684 1.00 85.12 8 A 1 ATOM 68 N N . LEU A 1 9 ? -2.646 1.383 0.677 1.00 89.56 9 A 1 ATOM 69 C CA . LEU A 1 9 ? -1.766 1.167 -0.481 1.00 89.97 9 A 1 ATOM 70 C C . LEU A 1 9 ? -0.714 0.113 -0.150 1.00 91.55 9 A 1 ATOM 71 O O . LEU A 1 9 ? -0.484 -0.821 -0.914 1.00 91.04 9 A 1 ATOM 72 C CB . LEU A 1 9 ? -1.077 2.490 -0.828 1.00 89.50 9 A 1 ATOM 73 C CG . LEU A 1 9 ? -0.295 2.397 -2.138 1.00 84.55 9 A 1 ATOM 74 C CD1 . LEU A 1 9 ? -1.096 3.034 -3.268 1.00 79.96 9 A 1 ATOM 75 C CD2 . LEU A 1 9 ? 1.035 3.114 -1.987 1.00 80.69 9 A 1 ATOM 76 N N . PHE A 1 10 ? -0.083 0.271 0.990 1.00 88.86 10 A 1 ATOM 77 C CA . PHE A 1 10 ? 0.942 -0.680 1.425 1.00 88.87 10 A 1 ATOM 78 C C . PHE A 1 10 ? 0.294 -1.999 1.822 1.00 91.16 10 A 1 ATOM 79 O O . PHE A 1 10 ? 0.867 -3.065 1.640 1.00 90.51 10 A 1 ATOM 80 C CB . PHE A 1 10 ? 1.689 -0.083 2.615 1.00 88.26 10 A 1 ATOM 81 C CG . PHE A 1 10 ? 3.179 -0.141 2.411 1.00 86.58 10 A 1 ATOM 82 C CD1 . PHE A 1 10 ? 3.782 0.578 1.389 1.00 83.98 10 A 1 ATOM 83 C CD2 . PHE A 1 10 ? 3.967 -0.916 3.254 1.00 84.48 10 A 1 ATOM 84 C CE1 . PHE A 1 10 ? 5.159 0.524 1.209 1.00 83.13 10 A 1 ATOM 85 C CE2 . PHE A 1 10 ? 5.347 -0.971 3.081 1.00 83.66 10 A 1 ATOM 86 C CZ . PHE A 1 10 ? 5.944 -0.248 2.056 1.00 83.26 10 A 1 ATOM 87 N N . GLY A 1 11 ? -0.899 -1.897 2.360 1.00 90.34 11 A 1 ATOM 88 C CA . GLY A 1 11 ? -1.632 -3.093 2.769 1.00 90.75 11 A 1 ATOM 89 C C . GLY A 1 11 ? -1.906 -3.988 1.579 1.00 92.30 11 A 1 ATOM 90 O O . GLY A 1 11 ? -1.845 -5.212 1.675 1.00 90.57 11 A 1 ATOM 91 N N . THR A 1 12 ? -2.205 -3.389 0.459 1.00 90.24 12 A 1 ATOM 92 C CA . THR A 1 12 ? -2.479 -4.149 -0.767 1.00 90.02 12 A 1 ATOM 93 C C . THR A 1 12 ? -1.217 -4.890 -1.197 1.00 90.99 12 A 1 ATOM 94 O O . THR A 1 12 ? -1.269 -6.029 -1.653 1.00 88.40 12 A 1 ATOM 95 C CB . THR A 1 12 ? -2.903 -3.190 -1.882 1.00 88.51 12 A 1 ATOM 96 O OG1 . THR A 1 12 ? -3.705 -2.157 -1.341 1.00 83.80 12 A 1 ATOM 97 C CG2 . THR A 1 12 ? -3.714 -3.946 -2.922 1.00 82.21 12 A 1 ATOM 98 N N . PHE A 1 13 ? -0.096 -4.236 -1.049 1.00 89.91 13 A 1 ATOM 99 C CA . PHE A 1 13 ? 1.192 -4.836 -1.404 1.00 89.33 13 A 1 ATOM 100 C C . PHE A 1 13 ? 1.488 -6.011 -0.472 1.00 91.02 13 A 1 ATOM 101 O O . PHE A 1 13 ? 2.024 -7.030 -0.886 1.00 89.54 13 A 1 ATOM 102 C CB . PHE A 1 13 ? 2.275 -3.766 -1.259 1.00 88.94 13 A 1 ATOM 103 C CG . PHE A 1 13 ? 3.572 -4.205 -1.888 1.00 86.90 13 A 1 ATOM 104 C CD1 . PHE A 1 13 ? 3.636 -4.493 -3.244 1.00 83.77 13 A 1 ATOM 105 C CD2 . PHE A 1 13 ? 4.718 -4.318 -1.116 1.00 84.79 13 A 1 ATOM 106 C CE1 . PHE A 1 13 ? 4.834 -4.894 -3.822 1.00 83.24 13 A 1 ATOM 107 C CE2 . PHE A 1 13 ? 5.923 -4.716 -1.691 1.00 83.64 13 A 1 ATOM 108 C CZ . PHE A 1 13 ? 5.980 -5.004 -3.043 1.00 84.42 13 A 1 ATOM 109 N N . LEU A 1 14 ? 1.133 -5.843 0.776 1.00 90.44 14 A 1 ATOM 110 C CA . LEU A 1 14 ? 1.355 -6.896 1.768 1.00 89.69 14 A 1 ATOM 111 C C . LEU A 1 14 ? 0.386 -8.049 1.536 1.00 90.63 14 A 1 ATOM 112 O O . LEU A 1 14 ? 0.712 -9.207 1.772 1.00 90.06 14 A 1 ATOM 113 C CB . LEU A 1 14 ? 1.160 -6.307 3.172 1.00 89.06 14 A 1 ATOM 114 C CG . LEU A 1 14 ? 2.475 -6.083 3.916 1.00 85.47 14 A 1 ATOM 115 C CD1 . LEU A 1 14 ? 3.165 -7.407 4.164 1.00 81.01 14 A 1 ATOM 116 C CD2 . LEU A 1 14 ? 3.376 -5.162 3.109 1.00 80.53 14 A 1 ATOM 117 N N . ALA A 1 15 ? -0.811 -7.714 1.089 1.00 89.30 15 A 1 ATOM 118 C CA . ALA A 1 15 ? -1.840 -8.728 0.839 1.00 89.70 15 A 1 ATOM 119 C C . ALA A 1 15 ? -1.372 -9.702 -0.241 1.00 90.24 15 A 1 ATOM 120 O O . ALA A 1 15 ? -1.710 -10.882 -0.206 1.00 87.21 15 A 1 ATOM 121 C CB . ALA A 1 15 ? -3.128 -8.044 0.405 1.00 88.09 15 A 1 ATOM 122 N N . THR A 1 16 ? -0.606 -9.207 -1.182 1.00 88.16 16 A 1 ATOM 123 C CA . THR A 1 16 ? -0.102 -10.063 -2.263 1.00 85.60 16 A 1 ATOM 124 C C . THR A 1 16 ? 1.153 -10.804 -1.825 1.00 85.74 16 A 1 ATOM 125 O O . THR A 1 16 ? 1.575 -11.754 -2.469 1.00 81.11 16 A 1 ATOM 126 C CB . THR A 1 16 ? 0.216 -9.205 -3.491 1.00 83.55 16 A 1 ATOM 127 O OG1 . THR A 1 16 ? 1.364 -8.421 -3.229 1.00 77.44 16 A 1 ATOM 128 C CG2 . THR A 1 16 ? -0.945 -8.292 -3.823 1.00 75.74 16 A 1 ATOM 129 N N . GLY A 1 17 ? 1.738 -10.367 -0.732 1.00 86.39 17 A 1 ATOM 130 C CA . GLY A 1 17 ? 2.953 -11.008 -0.228 1.00 83.02 17 A 1 ATOM 131 C C . GLY A 1 17 ? 4.098 -10.884 -1.218 1.00 83.73 17 A 1 ATOM 132 O O . GLY A 1 17 ? 4.825 -11.841 -1.455 1.00 82.52 17 A 1 ATOM 133 N N . MET A 1 18 ? 4.224 -9.712 -1.797 1.00 77.54 18 A 1 ATOM 134 C CA . MET A 1 18 ? 5.301 -9.467 -2.773 1.00 75.21 18 A 1 ATOM 135 C C . MET A 1 18 ? 6.466 -8.729 -2.131 1.00 76.26 18 A 1 ATOM 136 O O . MET A 1 18 ? 7.555 -8.703 -2.678 1.00 72.30 18 A 1 ATOM 137 C CB . MET A 1 18 ? 4.751 -8.639 -3.936 1.00 73.06 18 A 1 ATOM 138 C CG . MET A 1 18 ? 4.453 -9.530 -5.122 1.00 73.03 18 A 1 ATOM 139 S SD . MET A 1 18 ? 4.625 -8.646 -6.671 1.00 64.33 18 A 1 ATOM 140 C CE . MET A 1 18 ? 2.926 -8.165 -6.933 1.00 59.27 18 A 1 ATOM 141 N N . CYS A 1 19 ? 6.214 -8.141 -0.985 1.00 80.01 19 A 1 ATOM 142 C CA . CYS A 1 19 ? 7.264 -7.394 -0.283 1.00 78.42 19 A 1 ATOM 143 C C . CYS A 1 19 ? 8.527 -8.250 -0.195 1.00 73.07 19 A 1 ATOM 144 O O . CYS A 1 19 ? 9.599 -7.767 -0.584 1.00 68.89 19 A 1 ATOM 145 C CB . CYS A 1 19 ? 6.774 -7.022 1.115 1.00 73.08 19 A 1 ATOM 146 S SG . CYS A 1 19 ? 7.855 -5.777 1.856 1.00 67.60 19 A 1 ATOM 147 O OXT . CYS A 1 19 ? 8.424 -9.415 0.250 1.00 67.23 19 A 1 #