# 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_324 # _entry.id 324 # 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" "C5 H9 N O2" 115.130 PRO y PROLINE C1C[C@H](NC1)C(=O)O ? "L-PEPTIDE LINKING" "C3 H7 N O3" 105.093 SER y SERINE C([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 ALA 2 1 n SER 3 1 n PRO 4 1 n PHE 5 1 n ALA 6 1 n LEU 7 1 n LEU 8 1 n MET 9 1 n VAL 10 1 n LEU 11 1 n VAL 12 1 n VAL 13 1 n LEU 14 1 n SER 15 1 n CYS 16 1 n LYS 17 1 n SER 18 1 n SER 19 1 n CYS 20 1 n SER 21 1 n LEU 22 1 n GLY 23 # _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 @ 2025-05-31 02:41:39)" _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 91.43 _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 80.77 1 1 A ALA 2 2 87.62 1 2 A SER 3 2 90.83 1 3 A PRO 4 2 94.19 1 4 A PHE 5 2 93.81 1 5 A ALA 6 2 97.27 1 6 A LEU 7 2 93.97 1 7 A LEU 8 2 95.07 1 8 A MET 9 2 92.98 1 9 A VAL 10 2 96.54 1 10 A LEU 11 2 94.34 1 11 A VAL 12 2 96.43 1 12 A VAL 13 2 96.24 1 13 A LEU 14 2 94.73 1 14 A SER 15 2 95.07 1 15 A CYS 16 2 94.50 1 16 A LYS 17 2 88.59 1 17 A SER 18 2 93.28 1 18 A SER 19 2 93.31 1 19 A CYS 20 2 89.92 1 20 A SER 21 2 89.29 1 21 A LEU 22 2 78.84 1 22 A GLY 23 2 72.16 1 23 # _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 ALA . 2 A 2 A 3 1 n SER . 3 A 3 A 4 1 n PRO . 4 A 4 A 5 1 n PHE . 5 A 5 A 6 1 n ALA . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n MET . 9 A 9 A 10 1 n VAL . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n VAL . 12 A 12 A 13 1 n VAL . 13 A 13 A 14 1 n LEU . 14 A 14 A 15 1 n SER . 15 A 15 A 16 1 n CYS . 16 A 16 A 17 1 n LYS . 17 A 17 A 18 1 n SER . 18 A 18 A 19 1 n SER . 19 A 19 A 20 1 n CYS . 20 A 20 A 21 1 n SER . 21 A 21 A 22 1 n LEU . 22 A 22 A 23 1 n GLY . 23 A 23 # _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 ? -4.260 -7.662 19.540 1.00 88.46 1 A 1 ATOM 2 C CA . MET A 1 1 ? -4.773 -6.481 18.826 1.00 89.12 1 A 1 ATOM 3 C C . MET A 1 1 ? -3.778 -6.095 17.737 1.00 88.59 1 A 1 ATOM 4 O O . MET A 1 1 ? -2.595 -5.946 18.026 1.00 85.39 1 A 1 ATOM 5 C CB . MET A 1 1 ? -4.980 -5.313 19.796 1.00 84.04 1 A 1 ATOM 6 C CG . MET A 1 1 ? -6.123 -5.581 20.773 1.00 77.34 1 A 1 ATOM 7 S SD . MET A 1 1 ? -6.280 -4.316 22.041 1.00 70.12 1 A 1 ATOM 8 C CE . MET A 1 1 ? -7.791 -4.856 22.838 1.00 63.13 1 A 1 ATOM 9 N N . ALA A 1 2 ? -4.236 -5.965 16.499 1.00 86.52 2 A 1 ATOM 10 C CA . ALA A 1 2 ? -3.366 -5.548 15.405 1.00 89.23 2 A 1 ATOM 11 C C . ALA A 1 2 ? -3.041 -4.058 15.534 1.00 91.00 2 A 1 ATOM 12 O O . ALA A 1 2 ? -3.919 -3.258 15.863 1.00 87.47 2 A 1 ATOM 13 C CB . ALA A 1 2 ? -4.041 -5.842 14.071 1.00 83.87 2 A 1 ATOM 14 N N . SER A 1 3 ? -1.800 -3.676 15.281 1.00 92.98 3 A 1 ATOM 15 C CA . SER A 1 3 ? -1.388 -2.278 15.342 1.00 94.09 3 A 1 ATOM 16 C C . SER A 1 3 ? -2.004 -1.503 14.171 1.00 94.84 3 A 1 ATOM 17 O O . SER A 1 3 ? -1.861 -1.931 13.020 1.00 94.12 3 A 1 ATOM 18 C CB . SER A 1 3 ? 0.135 -2.171 15.308 1.00 90.68 3 A 1 ATOM 19 O OG . SER A 1 3 ? 0.532 -0.811 15.317 1.00 78.26 3 A 1 ATOM 20 N N . PRO A 1 4 ? -2.678 -0.355 14.421 1.00 95.06 4 A 1 ATOM 21 C CA . PRO A 1 4 ? -3.236 0.476 13.350 1.00 95.80 4 A 1 ATOM 22 C C . PRO A 1 4 ? -2.144 1.009 12.420 1.00 96.42 4 A 1 ATOM 23 O O . PRO A 1 4 ? -2.384 1.226 11.232 1.00 94.81 4 A 1 ATOM 24 C CB . PRO A 1 4 ? -3.964 1.609 14.089 1.00 93.46 4 A 1 ATOM 25 C CG . PRO A 1 4 ? -3.294 1.687 15.435 1.00 90.45 4 A 1 ATOM 26 C CD . PRO A 1 4 ? -2.897 0.261 15.739 1.00 93.32 4 A 1 ATOM 27 N N . PHE A 1 5 ? -0.931 1.176 12.943 1.00 96.87 5 A 1 ATOM 28 C CA . PHE A 1 5 ? 0.226 1.610 12.169 1.00 96.87 5 A 1 ATOM 29 C C . PHE A 1 5 ? 0.594 0.593 11.087 1.00 97.29 5 A 1 ATOM 30 O O . PHE A 1 5 ? 0.892 0.969 9.953 1.00 96.72 5 A 1 ATOM 31 C CB . PHE A 1 5 ? 1.398 1.841 13.124 1.00 96.00 5 A 1 ATOM 32 C CG . PHE A 1 5 ? 2.618 2.389 12.437 1.00 94.15 5 A 1 ATOM 33 C CD1 . PHE A 1 5 ? 2.701 3.748 12.129 1.00 92.30 5 A 1 ATOM 34 C CD2 . PHE A 1 5 ? 3.678 1.547 12.114 1.00 91.63 5 A 1 ATOM 35 C CE1 . PHE A 1 5 ? 3.837 4.267 11.513 1.00 90.05 5 A 1 ATOM 36 C CE2 . PHE A 1 5 ? 4.822 2.060 11.492 1.00 89.91 5 A 1 ATOM 37 C CZ . PHE A 1 5 ? 4.898 3.421 11.196 1.00 90.17 5 A 1 ATOM 38 N N . ALA A 1 6 ? 0.541 -0.709 11.421 1.00 97.37 6 A 1 ATOM 39 C CA . ALA A 1 6 ? 0.823 -1.771 10.457 1.00 97.32 6 A 1 ATOM 40 C C . ALA A 1 6 ? -0.200 -1.757 9.312 1.00 97.76 6 A 1 ATOM 41 O O . ALA A 1 6 ? 0.167 -1.924 8.150 1.00 97.21 6 A 1 ATOM 42 C CB . ALA A 1 6 ? 0.832 -3.123 11.176 1.00 96.70 6 A 1 ATOM 43 N N . LEU A 1 7 ? -1.473 -1.515 9.624 1.00 96.86 7 A 1 ATOM 44 C CA . LEU A 1 7 ? -2.527 -1.413 8.616 1.00 96.73 7 A 1 ATOM 45 C C . LEU A 1 7 ? -2.281 -0.230 7.674 1.00 97.18 7 A 1 ATOM 46 O O . LEU A 1 7 ? -2.442 -0.356 6.458 1.00 96.83 7 A 1 ATOM 47 C CB . LEU A 1 7 ? -3.888 -1.289 9.311 1.00 96.35 7 A 1 ATOM 48 C CG . LEU A 1 7 ? -5.082 -1.291 8.355 1.00 90.15 7 A 1 ATOM 49 C CD1 . LEU A 1 7 ? -5.211 -2.618 7.618 1.00 88.85 7 A 1 ATOM 50 C CD2 . LEU A 1 7 ? -6.365 -1.003 9.123 1.00 88.82 7 A 1 ATOM 51 N N . LEU A 1 8 ? -1.862 0.913 8.217 1.00 96.86 8 A 1 ATOM 52 C CA . LEU A 1 8 ? -1.538 2.097 7.421 1.00 96.84 8 A 1 ATOM 53 C C . LEU A 1 8 ? -0.363 1.829 6.479 1.00 97.32 8 A 1 ATOM 54 O O . LEU A 1 8 ? -0.402 2.227 5.313 1.00 97.26 8 A 1 ATOM 55 C CB . LEU A 1 8 ? -1.220 3.281 8.349 1.00 96.53 8 A 1 ATOM 56 C CG . LEU A 1 8 ? -2.435 3.857 9.087 1.00 92.96 8 A 1 ATOM 57 C CD1 . LEU A 1 8 ? -1.977 4.897 10.105 1.00 91.26 8 A 1 ATOM 58 C CD2 . LEU A 1 8 ? -3.426 4.508 8.122 1.00 91.55 8 A 1 ATOM 59 N N . MET A 1 9 ? 0.664 1.126 6.955 1.00 96.55 9 A 1 ATOM 60 C CA . MET A 1 9 ? 1.815 0.771 6.122 1.00 96.74 9 A 1 ATOM 61 C C . MET A 1 9 ? 1.405 -0.141 4.964 1.00 97.11 9 A 1 ATOM 62 O O . MET A 1 9 ? 1.816 0.075 3.827 1.00 96.58 9 A 1 ATOM 63 C CB . MET A 1 9 ? 2.906 0.113 6.979 1.00 96.24 9 A 1 ATOM 64 C CG . MET A 1 9 ? 3.627 1.149 7.854 1.00 93.38 9 A 1 ATOM 65 S SD . MET A 1 9 ? 4.570 2.334 6.872 1.00 87.99 9 A 1 ATOM 66 C CE . MET A 1 9 ? 4.939 3.576 8.113 1.00 79.22 9 A 1 ATOM 67 N N . VAL A 1 10 ? 0.555 -1.135 5.233 1.00 97.38 10 A 1 ATOM 68 C CA . VAL A 1 10 ? 0.036 -2.019 4.182 1.00 97.32 10 A 1 ATOM 69 C C . VAL A 1 10 ? -0.771 -1.219 3.152 1.00 97.57 10 A 1 ATOM 70 O O . VAL A 1 10 ? -0.624 -1.434 1.946 1.00 97.00 10 A 1 ATOM 71 C CB . VAL A 1 10 ? -0.814 -3.154 4.797 1.00 96.86 10 A 1 ATOM 72 C CG1 . VAL A 1 10 ? -1.539 -3.971 3.726 1.00 94.81 10 A 1 ATOM 73 C CG2 . VAL A 1 10 ? 0.075 -4.096 5.612 1.00 94.82 10 A 1 ATOM 74 N N . LEU A 1 11 ? -1.585 -0.276 3.607 1.00 97.23 11 A 1 ATOM 75 C CA . LEU A 1 11 ? -2.383 0.575 2.725 1.00 97.04 11 A 1 ATOM 76 C C . LEU A 1 11 ? -1.497 1.432 1.813 1.00 97.35 11 A 1 ATOM 77 O O . LEU A 1 11 ? -1.758 1.533 0.610 1.00 96.88 11 A 1 ATOM 78 C CB . LEU A 1 11 ? -3.311 1.455 3.576 1.00 96.71 11 A 1 ATOM 79 C CG . LEU A 1 11 ? -4.269 2.340 2.767 1.00 91.13 11 A 1 ATOM 80 C CD1 . LEU A 1 11 ? -5.251 1.504 1.946 1.00 88.73 11 A 1 ATOM 81 C CD2 . LEU A 1 11 ? -5.045 3.257 3.702 1.00 89.62 11 A 1 ATOM 82 N N . VAL A 1 12 ? -0.437 2.026 2.357 1.00 97.56 12 A 1 ATOM 83 C CA . VAL A 1 12 ? 0.512 2.837 1.585 1.00 97.39 12 A 1 ATOM 84 C C . VAL A 1 12 ? 1.221 1.983 0.531 1.00 97.48 12 A 1 ATOM 85 O O . VAL A 1 12 ? 1.329 2.389 -0.631 1.00 96.75 12 A 1 ATOM 86 C CB . VAL A 1 12 ? 1.531 3.527 2.517 1.00 96.86 12 A 1 ATOM 87 C CG1 . VAL A 1 12 ? 2.665 4.190 1.735 1.00 94.36 12 A 1 ATOM 88 C CG2 . VAL A 1 12 ? 0.836 4.589 3.366 1.00 94.58 12 A 1 ATOM 89 N N . VAL A 1 13 ? 1.678 0.791 0.914 1.00 97.59 13 A 1 ATOM 90 C CA . VAL A 1 13 ? 2.344 -0.127 -0.017 1.00 97.25 13 A 1 ATOM 91 C C . VAL A 1 13 ? 1.384 -0.555 -1.131 1.00 97.07 13 A 1 ATOM 92 O O . VAL A 1 13 ? 1.765 -0.581 -2.304 1.00 95.93 13 A 1 ATOM 93 C CB . VAL A 1 13 ? 2.907 -1.351 0.736 1.00 96.71 13 A 1 ATOM 94 C CG1 . VAL A 1 13 ? 3.418 -2.423 -0.226 1.00 94.31 13 A 1 ATOM 95 C CG2 . VAL A 1 13 ? 4.061 -0.925 1.647 1.00 94.79 13 A 1 ATOM 96 N N . LEU A 1 14 ? 0.139 -0.858 -0.788 1.00 97.57 14 A 1 ATOM 97 C CA . LEU A 1 14 ? -0.878 -1.245 -1.766 1.00 97.12 14 A 1 ATOM 98 C C . LEU A 1 14 ? -1.173 -0.105 -2.741 1.00 97.15 14 A 1 ATOM 99 O O . LEU A 1 14 ? -1.253 -0.329 -3.953 1.00 96.49 14 A 1 ATOM 100 C CB . LEU A 1 14 ? -2.151 -1.679 -1.021 1.00 96.83 14 A 1 ATOM 101 C CG . LEU A 1 14 ? -3.280 -2.196 -1.928 1.00 92.08 14 A 1 ATOM 102 C CD1 . LEU A 1 14 ? -2.866 -3.469 -2.663 1.00 89.72 14 A 1 ATOM 103 C CD2 . LEU A 1 14 ? -4.525 -2.475 -1.097 1.00 90.90 14 A 1 ATOM 104 N N . SER A 1 15 ? -1.299 1.119 -2.242 1.00 97.23 15 A 1 ATOM 105 C CA . SER A 1 15 ? -1.538 2.306 -3.066 1.00 96.85 15 A 1 ATOM 106 C C . SER A 1 15 ? -0.362 2.565 -4.015 1.00 96.79 15 A 1 ATOM 107 O O . SER A 1 15 ? -0.563 2.796 -5.209 1.00 95.43 15 A 1 ATOM 108 C CB . SER A 1 15 ? -1.773 3.517 -2.156 1.00 96.04 15 A 1 ATOM 109 O OG . SER A 1 15 ? -2.090 4.656 -2.926 1.00 88.06 15 A 1 ATOM 110 N N . CYS A 1 16 ? 0.867 2.466 -3.507 1.00 96.57 16 A 1 ATOM 111 C CA . CYS A 1 16 ? 2.070 2.637 -4.317 1.00 96.26 16 A 1 ATOM 112 C C . CYS A 1 16 ? 2.153 1.565 -5.406 1.00 95.99 16 A 1 ATOM 113 O O . CYS A 1 16 ? 2.423 1.874 -6.564 1.00 93.52 16 A 1 ATOM 114 C CB . CYS A 1 16 ? 3.302 2.602 -3.405 1.00 95.39 16 A 1 ATOM 115 S SG . CYS A 1 16 ? 4.822 2.895 -4.325 1.00 89.28 16 A 1 ATOM 116 N N . LYS A 1 17 ? 1.876 0.315 -5.050 1.00 96.04 17 A 1 ATOM 117 C CA . LYS A 1 17 ? 1.876 -0.794 -6.003 1.00 95.40 17 A 1 ATOM 118 C C . LYS A 1 17 ? 0.863 -0.561 -7.125 1.00 95.40 17 A 1 ATOM 119 O O . LYS A 1 17 ? 1.189 -0.769 -8.294 1.00 94.40 17 A 1 ATOM 120 C CB . LYS A 1 17 ? 1.587 -2.110 -5.274 1.00 94.12 17 A 1 ATOM 121 C CG . LYS A 1 17 ? 1.623 -3.321 -6.198 1.00 87.65 17 A 1 ATOM 122 C CD . LYS A 1 17 ? 1.487 -4.631 -5.421 1.00 84.23 17 A 1 ATOM 123 C CE . LYS A 1 17 ? 1.508 -5.839 -6.361 1.00 79.48 17 A 1 ATOM 124 N NZ . LYS A 1 17 ? 0.238 -5.975 -7.123 1.00 70.62 17 A 1 ATOM 125 N N . SER A 1 18 ? -0.340 -0.117 -6.783 1.00 96.42 18 A 1 ATOM 126 C CA . SER A 1 18 ? -1.371 0.179 -7.774 1.00 96.18 18 A 1 ATOM 127 C C . SER A 1 18 ? -0.931 1.305 -8.715 1.00 96.36 18 A 1 ATOM 128 O O . SER A 1 18 ? -1.018 1.168 -9.936 1.00 94.63 18 A 1 ATOM 129 C CB . SER A 1 18 ? -2.677 0.544 -7.063 1.00 94.65 18 A 1 ATOM 130 O OG . SER A 1 18 ? -3.716 0.705 -8.005 1.00 81.44 18 A 1 ATOM 131 N N . SER A 1 19 ? -0.399 2.392 -8.172 1.00 96.57 19 A 1 ATOM 132 C CA . SER A 1 19 ? 0.025 3.550 -8.959 1.00 96.40 19 A 1 ATOM 133 C C . SER A 1 19 ? 1.266 3.266 -9.808 1.00 96.36 19 A 1 ATOM 134 O O . SER A 1 19 ? 1.378 3.757 -10.931 1.00 93.46 19 A 1 ATOM 135 C CB . SER A 1 19 ? 0.295 4.735 -8.034 1.00 94.91 19 A 1 ATOM 136 O OG . SER A 1 19 ? -0.866 5.065 -7.293 1.00 82.18 19 A 1 ATOM 137 N N . CYS A 1 20 ? 2.208 2.462 -9.288 1.00 93.40 20 A 1 ATOM 138 C CA . CYS A 1 20 ? 3.468 2.188 -9.973 1.00 92.94 20 A 1 ATOM 139 C C . CYS A 1 20 ? 3.380 1.020 -10.957 1.00 93.32 20 A 1 ATOM 140 O O . CYS A 1 20 ? 4.189 0.938 -11.877 1.00 88.93 20 A 1 ATOM 141 C CB . CYS A 1 20 ? 4.573 1.932 -8.937 1.00 89.51 20 A 1 ATOM 142 S SG . CYS A 1 20 ? 4.902 3.386 -7.907 1.00 81.39 20 A 1 ATOM 143 N N . SER A 1 21 ? 2.416 0.101 -10.761 1.00 92.34 21 A 1 ATOM 144 C CA . SER A 1 21 ? 2.287 -1.088 -11.607 1.00 92.99 21 A 1 ATOM 145 C C . SER A 1 21 ? 1.224 -0.944 -12.697 1.00 93.17 21 A 1 ATOM 146 O O . SER A 1 21 ? 1.301 -1.626 -13.718 1.00 89.77 21 A 1 ATOM 147 C CB . SER A 1 21 ? 1.967 -2.331 -10.760 1.00 89.83 21 A 1 ATOM 148 O OG . SER A 1 21 ? 2.932 -2.529 -9.742 1.00 77.62 21 A 1 ATOM 149 N N . LEU A 1 22 ? 0.227 -0.077 -12.484 1.00 86.42 22 A 1 ATOM 150 C CA . LEU A 1 22 ? -0.894 0.104 -13.411 1.00 84.55 22 A 1 ATOM 151 C C . LEU A 1 22 ? -0.879 1.475 -14.097 1.00 86.81 22 A 1 ATOM 152 O O . LEU A 1 22 ? -1.740 1.751 -14.933 1.00 82.03 22 A 1 ATOM 153 C CB . LEU A 1 22 ? -2.229 -0.119 -12.668 1.00 81.12 22 A 1 ATOM 154 C CG . LEU A 1 22 ? -2.402 -1.508 -12.028 1.00 74.89 22 A 1 ATOM 155 C CD1 . LEU A 1 22 ? -3.684 -1.543 -11.197 1.00 68.38 22 A 1 ATOM 156 C CD2 . LEU A 1 22 ? -2.471 -2.598 -13.096 1.00 66.54 22 A 1 ATOM 157 N N . GLY A 1 23 ? 0.083 2.335 -13.749 1.00 82.34 23 A 1 ATOM 158 C CA . GLY A 1 23 ? 0.225 3.656 -14.338 1.00 76.24 23 A 1 ATOM 159 C C . GLY A 1 23 ? 1.255 3.688 -15.452 1.00 70.58 23 A 1 ATOM 160 O O . GLY A 1 23 ? 2.113 2.790 -15.518 1.00 63.92 23 A 1 ATOM 161 O OXT . GLY A 1 23 ? 1.229 4.653 -16.273 1.00 67.70 23 A 1 #