# 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_spkb09524 # _entry.id spkb09524 # 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" "C5 H10 N2 O3" 146.144 GLN y GLUTAMINE C(CC(=O)N)[C@@H](C(=O)O)N ? "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" "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" "C11 H12 N2 O2" 204.225 TRP y TRYPTOPHAN c1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C9 H11 N O3" 181.189 TYR y TYROSINE c1cc(ccc1C[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 LEU 2 1 n LEU 3 1 n ALA 4 1 n VAL 5 1 n LEU 6 1 n TYR 7 1 n CYS 8 1 n LEU 9 1 n LEU 10 1 n TRP 11 1 n SER 12 1 n PHE 13 1 n GLN 14 1 n THR 15 1 n SER 16 1 n ALA 17 1 n GLY 18 # _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 @ 2025-07-06 22:41:55)" _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 94.36 _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 86.11 1 1 A LEU 2 2 94.02 1 2 A LEU 3 2 96.34 1 3 A ALA 4 2 98.41 1 4 A VAL 5 2 98.19 1 5 A LEU 6 2 96.12 1 6 A TYR 7 2 96.08 1 7 A CYS 8 2 97.52 1 8 A LEU 9 2 96.51 1 9 A LEU 10 2 96.19 1 10 A TRP 11 2 94.84 1 11 A SER 12 2 97.09 1 12 A PHE 13 2 95.55 1 13 A GLN 14 2 91.05 1 14 A THR 15 2 93.65 1 15 A SER 16 2 91.84 1 16 A ALA 17 2 92.29 1 17 A GLY 18 2 83.27 1 18 # _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 LEU . 2 A 2 A 3 1 n LEU . 3 A 3 A 4 1 n ALA . 4 A 4 A 5 1 n VAL . 5 A 5 A 6 1 n LEU . 6 A 6 A 7 1 n TYR . 7 A 7 A 8 1 n CYS . 8 A 8 A 9 1 n LEU . 9 A 9 A 10 1 n LEU . 10 A 10 A 11 1 n TRP . 11 A 11 A 12 1 n SER . 12 A 12 A 13 1 n PHE . 13 A 13 A 14 1 n GLN . 14 A 14 A 15 1 n THR . 15 A 15 A 16 1 n SER . 16 A 16 A 17 1 n ALA . 17 A 17 A 18 1 n GLY . 18 A 18 # _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 ? -11.126 -2.549 5.392 1.00 93.91 1 A 1 ATOM 2 C CA . MET A 1 1 ? -9.829 -2.828 6.045 1.00 93.88 1 A 1 ATOM 3 C C . MET A 1 1 ? -8.746 -3.160 5.022 1.00 93.88 1 A 1 ATOM 4 O O . MET A 1 1 ? -7.600 -2.755 5.186 1.00 90.83 1 A 1 ATOM 5 C CB . MET A 1 1 ? -9.976 -3.991 7.037 1.00 88.39 1 A 1 ATOM 6 C CG . MET A 1 1 ? -10.367 -3.503 8.425 1.00 81.08 1 A 1 ATOM 7 S SD . MET A 1 1 ? -10.403 -4.834 9.623 1.00 78.13 1 A 1 ATOM 8 C CE . MET A 1 1 ? -10.397 -3.887 11.144 1.00 68.81 1 A 1 ATOM 9 N N . LEU A 1 2 ? -9.113 -3.880 3.978 1.00 96.41 2 A 1 ATOM 10 C CA . LEU A 1 2 ? -8.140 -4.245 2.944 1.00 97.40 2 A 1 ATOM 11 C C . LEU A 1 2 ? -7.562 -3.012 2.254 1.00 98.09 2 A 1 ATOM 12 O O . LEU A 1 2 ? -6.344 -2.895 2.093 1.00 97.93 2 A 1 ATOM 13 C CB . LEU A 1 2 ? -8.808 -5.168 1.919 1.00 96.79 2 A 1 ATOM 14 C CG . LEU A 1 2 ? -8.792 -6.635 2.328 1.00 90.88 2 A 1 ATOM 15 C CD1 . LEU A 1 2 ? -10.021 -7.352 1.793 1.00 87.65 2 A 1 ATOM 16 C CD2 . LEU A 1 2 ? -7.527 -7.302 1.810 1.00 87.00 2 A 1 ATOM 17 N N . LEU A 1 3 ? -8.423 -2.089 1.859 1.00 98.23 3 A 1 ATOM 18 C CA . LEU A 1 3 ? -7.971 -0.867 1.190 1.00 98.30 3 A 1 ATOM 19 C C . LEU A 1 3 ? -7.098 -0.021 2.110 1.00 98.44 3 A 1 ATOM 20 O O . LEU A 1 3 ? -6.071 0.513 1.687 1.00 98.30 3 A 1 ATOM 21 C CB . LEU A 1 3 ? -9.189 -0.057 0.718 1.00 98.02 3 A 1 ATOM 22 C CG . LEU A 1 3 ? -9.531 -0.277 -0.752 1.00 94.56 3 A 1 ATOM 23 C CD1 . LEU A 1 3 ? -10.986 0.084 -1.014 1.00 92.45 3 A 1 ATOM 24 C CD2 . LEU A 1 3 ? -8.616 0.558 -1.637 1.00 92.43 3 A 1 ATOM 25 N N . ALA A 1 4 ? -7.496 0.101 3.362 1.00 98.32 4 A 1 ATOM 26 C CA . ALA A 1 4 ? -6.740 0.886 4.343 1.00 98.49 4 A 1 ATOM 27 C C . ALA A 1 4 ? -5.348 0.293 4.567 1.00 98.62 4 A 1 ATOM 28 O O . ALA A 1 4 ? -4.355 1.020 4.623 1.00 98.38 4 A 1 ATOM 29 C CB . ALA A 1 4 ? -7.516 0.945 5.659 1.00 98.22 4 A 1 ATOM 30 N N . VAL A 1 5 ? -5.277 -1.016 4.673 1.00 98.66 5 A 1 ATOM 31 C CA . VAL A 1 5 ? -3.998 -1.710 4.879 1.00 98.65 5 A 1 ATOM 32 C C . VAL A 1 5 ? -3.098 -1.526 3.659 1.00 98.70 5 A 1 ATOM 33 O O . VAL A 1 5 ? -1.899 -1.254 3.790 1.00 98.51 5 A 1 ATOM 34 C CB . VAL A 1 5 ? -4.230 -3.209 5.159 1.00 98.44 5 A 1 ATOM 35 C CG1 . VAL A 1 5 ? -2.903 -3.959 5.234 1.00 97.34 5 A 1 ATOM 36 C CG2 . VAL A 1 5 ? -4.995 -3.395 6.462 1.00 97.05 5 A 1 ATOM 37 N N . LEU A 1 6 ? -3.674 -1.674 2.477 1.00 98.41 6 A 1 ATOM 38 C CA . LEU A 1 6 ? -2.924 -1.507 1.233 1.00 98.44 6 A 1 ATOM 39 C C . LEU A 1 6 ? -2.408 -0.077 1.100 1.00 98.49 6 A 1 ATOM 40 O O . LEU A 1 6 ? -1.267 0.146 0.695 1.00 98.42 6 A 1 ATOM 41 C CB . LEU A 1 6 ? -3.817 -1.864 0.040 1.00 98.36 6 A 1 ATOM 42 C CG . LEU A 1 6 ? -3.046 -2.414 -1.158 1.00 93.92 6 A 1 ATOM 43 C CD1 . LEU A 1 6 ? -2.661 -3.874 -0.923 1.00 90.78 6 A 1 ATOM 44 C CD2 . LEU A 1 6 ? -3.877 -2.294 -2.422 1.00 92.18 6 A 1 ATOM 45 N N . TYR A 1 7 ? -3.242 0.883 1.438 1.00 98.35 7 A 1 ATOM 46 C CA . TYR A 1 7 ? -2.871 2.297 1.366 1.00 98.22 7 A 1 ATOM 47 C C . TYR A 1 7 ? -1.711 2.602 2.316 1.00 98.27 7 A 1 ATOM 48 O O . TYR A 1 7 ? -0.767 3.306 1.956 1.00 98.15 7 A 1 ATOM 49 C CB . TYR A 1 7 ? -4.088 3.158 1.723 1.00 98.05 7 A 1 ATOM 50 C CG . TYR A 1 7 ? -4.286 4.307 0.753 1.00 96.60 7 A 1 ATOM 51 C CD1 . TYR A 1 7 ? -3.552 5.483 0.887 1.00 94.41 7 A 1 ATOM 52 C CD2 . TYR A 1 7 ? -5.208 4.198 -0.287 1.00 94.92 7 A 1 ATOM 53 C CE1 . TYR A 1 7 ? -3.731 6.534 -0.004 1.00 94.04 7 A 1 ATOM 54 C CE2 . TYR A 1 7 ? -5.392 5.249 -1.182 1.00 93.97 7 A 1 ATOM 55 C CZ . TYR A 1 7 ? -4.652 6.415 -1.038 1.00 94.50 7 A 1 ATOM 56 O OH . TYR A 1 7 ? -4.831 7.458 -1.914 1.00 93.52 7 A 1 ATOM 57 N N . CYS A 1 8 ? -1.780 2.067 3.514 1.00 98.43 8 A 1 ATOM 58 C CA . CYS A 1 8 ? -0.720 2.272 4.503 1.00 98.45 8 A 1 ATOM 59 C C . CYS A 1 8 ? 0.599 1.646 4.041 1.00 98.52 8 A 1 ATOM 60 O O . CYS A 1 8 ? 1.666 2.236 4.197 1.00 98.14 8 A 1 ATOM 61 C CB . CYS A 1 8 ? -1.143 1.668 5.846 1.00 98.25 8 A 1 ATOM 62 S SG . CYS A 1 8 ? -1.791 2.913 6.985 1.00 93.31 8 A 1 ATOM 63 N N . LEU A 1 9 ? 0.505 0.453 3.473 1.00 98.36 9 A 1 ATOM 64 C CA . LEU A 1 9 ? 1.696 -0.255 3.003 1.00 98.32 9 A 1 ATOM 65 C C . LEU A 1 9 ? 2.348 0.469 1.831 1.00 98.35 9 A 1 ATOM 66 O O . LEU A 1 9 ? 3.560 0.699 1.837 1.00 98.19 9 A 1 ATOM 67 C CB . LEU A 1 9 ? 1.312 -1.684 2.594 1.00 98.26 9 A 1 ATOM 68 C CG . LEU A 1 9 ? 1.240 -2.667 3.760 1.00 94.77 9 A 1 ATOM 69 C CD1 . LEU A 1 9 ? 0.361 -3.859 3.405 1.00 92.53 9 A 1 ATOM 70 C CD2 . LEU A 1 9 ? 2.637 -3.149 4.135 1.00 93.33 9 A 1 ATOM 71 N N . LEU A 1 10 ? 1.553 0.824 0.822 1.00 98.40 10 A 1 ATOM 72 C CA . LEU A 1 10 ? 2.091 1.505 -0.358 1.00 98.25 10 A 1 ATOM 73 C C . LEU A 1 10 ? 2.596 2.902 -0.001 1.00 98.12 10 A 1 ATOM 74 O O . LEU A 1 10 ? 3.609 3.357 -0.542 1.00 97.87 10 A 1 ATOM 75 C CB . LEU A 1 10 ? 1.025 1.569 -1.466 1.00 98.14 10 A 1 ATOM 76 C CG . LEU A 1 10 ? -0.140 2.522 -1.227 1.00 94.63 10 A 1 ATOM 77 C CD1 . LEU A 1 10 ? 0.103 3.855 -1.941 1.00 91.57 10 A 1 ATOM 78 C CD2 . LEU A 1 10 ? -1.426 1.895 -1.746 1.00 92.53 10 A 1 ATOM 79 N N . TRP A 1 11 ? 1.921 3.578 0.905 1.00 98.30 11 A 1 ATOM 80 C CA . TRP A 1 11 ? 2.332 4.923 1.328 1.00 98.05 11 A 1 ATOM 81 C C . TRP A 1 11 ? 3.655 4.846 2.085 1.00 98.17 11 A 1 ATOM 82 O O . TRP A 1 11 ? 4.575 5.625 1.828 1.00 97.85 11 A 1 ATOM 83 C CB . TRP A 1 11 ? 1.254 5.546 2.217 1.00 97.81 11 A 1 ATOM 84 C CG . TRP A 1 11 ? 1.449 7.022 2.427 1.00 96.82 11 A 1 ATOM 85 C CD1 . TRP A 1 11 ? 2.570 7.648 2.869 1.00 93.47 11 A 1 ATOM 86 C CD2 . TRP A 1 11 ? 0.486 8.074 2.202 1.00 94.90 11 A 1 ATOM 87 N NE1 . TRP A 1 11 ? 2.383 9.010 2.926 1.00 92.75 11 A 1 ATOM 88 C CE2 . TRP A 1 11 ? 1.104 9.307 2.525 1.00 94.68 11 A 1 ATOM 89 C CE3 . TRP A 1 11 ? -0.839 8.093 1.754 1.00 92.52 11 A 1 ATOM 90 C CZ2 . TRP A 1 11 ? 0.437 10.531 2.411 1.00 93.71 11 A 1 ATOM 91 C CZ3 . TRP A 1 11 ? -1.507 9.312 1.647 1.00 88.96 11 A 1 ATOM 92 C CH2 . TRP A 1 11 ? -0.868 10.522 1.969 1.00 89.81 11 A 1 ATOM 93 N N . SER A 1 12 ? 3.757 3.909 3.001 1.00 98.27 12 A 1 ATOM 94 C CA . SER A 1 12 ? 4.981 3.727 3.780 1.00 98.21 12 A 1 ATOM 95 C C . SER A 1 12 ? 6.154 3.371 2.868 1.00 98.36 12 A 1 ATOM 96 O O . SER A 1 12 ? 7.264 3.875 3.038 1.00 98.05 12 A 1 ATOM 97 C CB . SER A 1 12 ? 4.772 2.631 4.821 1.00 97.85 12 A 1 ATOM 98 O OG . SER A 1 12 ? 5.772 2.685 5.809 1.00 91.80 12 A 1 ATOM 99 N N . PHE A 1 13 ? 5.903 2.511 1.892 1.00 98.22 13 A 1 ATOM 100 C CA . PHE A 1 13 ? 6.930 2.093 0.941 1.00 98.13 13 A 1 ATOM 101 C C . PHE A 1 13 ? 7.357 3.264 0.056 1.00 98.14 13 A 1 ATOM 102 O O . PHE A 1 13 ? 8.547 3.460 -0.197 1.00 97.70 13 A 1 ATOM 103 C CB . PHE A 1 13 ? 6.390 0.947 0.082 1.00 97.94 13 A 1 ATOM 104 C CG . PHE A 1 13 ? 7.481 0.230 -0.677 1.00 96.24 13 A 1 ATOM 105 C CD1 . PHE A 1 13 ? 8.391 -0.577 -0.010 1.00 93.15 13 A 1 ATOM 106 C CD2 . PHE A 1 13 ? 7.587 0.371 -2.054 1.00 93.52 13 A 1 ATOM 107 C CE1 . PHE A 1 13 ? 9.396 -1.238 -0.700 1.00 92.57 13 A 1 ATOM 108 C CE2 . PHE A 1 13 ? 8.594 -0.285 -2.752 1.00 93.02 13 A 1 ATOM 109 C CZ . PHE A 1 13 ? 9.499 -1.089 -2.076 1.00 92.42 13 A 1 ATOM 110 N N . GLN A 1 14 ? 6.389 4.035 -0.418 1.00 97.97 14 A 1 ATOM 111 C CA . GLN A 1 14 ? 6.667 5.180 -1.289 1.00 97.78 14 A 1 ATOM 112 C C . GLN A 1 14 ? 7.389 6.288 -0.529 1.00 97.63 14 A 1 ATOM 113 O O . GLN A 1 14 ? 8.325 6.895 -1.046 1.00 96.15 14 A 1 ATOM 114 C CB . GLN A 1 14 ? 5.347 5.707 -1.881 1.00 96.88 14 A 1 ATOM 115 C CG . GLN A 1 14 ? 4.882 4.886 -3.069 1.00 90.68 14 A 1 ATOM 116 C CD . GLN A 1 14 ? 5.354 5.501 -4.386 1.00 86.05 14 A 1 ATOM 117 O OE1 . GLN A 1 14 ? 4.640 6.277 -4.999 1.00 79.19 14 A 1 ATOM 118 N NE2 . GLN A 1 14 ? 6.552 5.176 -4.817 1.00 77.14 14 A 1 ATOM 119 N N . THR A 1 15 ? 6.964 6.561 0.687 1.00 97.69 15 A 1 ATOM 120 C CA . THR A 1 15 ? 7.587 7.608 1.499 1.00 96.98 15 A 1 ATOM 121 C C . THR A 1 15 ? 8.988 7.205 1.952 1.00 96.12 15 A 1 ATOM 122 O O . THR A 1 15 ? 9.881 8.053 2.035 1.00 93.08 15 A 1 ATOM 123 C CB . THR A 1 15 ? 6.720 7.926 2.725 1.00 95.32 15 A 1 ATOM 124 O OG1 . THR A 1 15 ? 6.262 6.731 3.331 1.00 89.08 15 A 1 ATOM 125 C CG2 . THR A 1 15 ? 5.532 8.786 2.336 1.00 87.27 15 A 1 ATOM 126 N N . SER A 1 16 ? 9.180 5.929 2.232 1.00 97.00 16 A 1 ATOM 127 C CA . SER A 1 16 ? 10.485 5.428 2.673 1.00 96.06 16 A 1 ATOM 128 C C . SER A 1 16 ? 11.468 5.325 1.511 1.00 93.96 16 A 1 ATOM 129 O O . SER A 1 16 ? 12.653 5.631 1.661 1.00 88.80 16 A 1 ATOM 130 C CB . SER A 1 16 ? 10.332 4.062 3.343 1.00 94.65 16 A 1 ATOM 131 O OG . SER A 1 16 ? 9.872 4.205 4.673 1.00 80.58 16 A 1 ATOM 132 N N . ALA A 1 17 ? 10.969 4.884 0.356 1.00 95.19 17 A 1 ATOM 133 C CA . ALA A 1 17 ? 11.806 4.713 -0.835 1.00 93.61 17 A 1 ATOM 134 C C . ALA A 1 17 ? 11.953 6.013 -1.632 1.00 92.47 17 A 1 ATOM 135 O O . ALA A 1 17 ? 13.018 6.289 -2.187 1.00 88.36 17 A 1 ATOM 136 C CB . ALA A 1 17 ? 11.224 3.609 -1.722 1.00 91.83 17 A 1 ATOM 137 N N . GLY A 1 18 ? 10.876 6.796 -1.706 1.00 92.91 18 A 1 ATOM 138 C CA . GLY A 1 18 ? 10.863 8.052 -2.473 1.00 87.49 18 A 1 ATOM 139 C C . GLY A 1 18 ? 11.474 9.203 -1.688 1.00 82.11 18 A 1 ATOM 140 O O . GLY A 1 18 ? 10.731 10.103 -1.282 1.00 73.56 18 A 1 ATOM 141 O OXT . GLY A 1 18 ? 12.705 9.231 -1.572 1.00 80.30 18 A 1 #