# 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_spkb22682 # _entry.id spkb22682 # 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 H10 N3 O2" 156.162 HIS y HISTIDINE c1c([nH+]c[nH]1)C[C@@H](C(=O)O)N ? "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" # _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 SER 3 1 n PHE 4 1 n ILE 5 1 n SER 6 1 n LEU 7 1 n LEU 8 1 n GLY 9 1 n LEU 10 1 n SER 11 1 n PHE 12 1 n LEU 13 1 n THR 14 1 n CYS 15 1 n HIS 16 1 n ALA 17 1 n SER 18 1 n ALA 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 @ 2025-07-08 12:24:30)" _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 85.96 _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 80.35 1 1 A LYS 2 2 76.30 1 2 A SER 3 2 88.29 1 3 A PHE 4 2 83.74 1 4 A ILE 5 2 85.06 1 5 A SER 6 2 89.04 1 6 A LEU 7 2 86.91 1 7 A LEU 8 2 88.30 1 8 A GLY 9 2 92.07 1 9 A LEU 10 2 87.53 1 10 A SER 11 2 90.12 1 11 A PHE 12 2 87.94 1 12 A LEU 13 2 89.16 1 13 A THR 14 2 88.33 1 14 A CYS 15 2 90.65 1 15 A HIS 16 2 80.95 1 16 A ALA 17 2 90.91 1 17 A SER 18 2 86.16 1 18 A ALA 19 2 81.86 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 SER . 3 A 3 A 4 1 n PHE . 4 A 4 A 5 1 n ILE . 5 A 5 A 6 1 n SER . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n GLY . 9 A 9 A 10 1 n LEU . 10 A 10 A 11 1 n SER . 11 A 11 A 12 1 n PHE . 12 A 12 A 13 1 n LEU . 13 A 13 A 14 1 n THR . 14 A 14 A 15 1 n CYS . 15 A 15 A 16 1 n HIS . 16 A 16 A 17 1 n ALA . 17 A 17 A 18 1 n SER . 18 A 18 A 19 1 n ALA . 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 ? -12.052 5.646 4.994 1.00 85.95 1 A 1 ATOM 2 C CA . MET A 1 1 ? -11.831 4.187 5.088 1.00 87.69 1 A 1 ATOM 3 C C . MET A 1 1 ? -10.403 3.900 5.543 1.00 88.25 1 A 1 ATOM 4 O O . MET A 1 1 ? -9.463 4.091 4.782 1.00 84.35 1 A 1 ATOM 5 C CB . MET A 1 1 ? -12.058 3.524 3.731 1.00 82.40 1 A 1 ATOM 6 C CG . MET A 1 1 ? -13.454 3.793 3.196 1.00 78.31 1 A 1 ATOM 7 S SD . MET A 1 1 ? -13.698 3.056 1.573 1.00 72.79 1 A 1 ATOM 8 C CE . MET A 1 1 ? -14.915 4.160 0.900 1.00 63.06 1 A 1 ATOM 9 N N . LYS A 1 2 ? -10.270 3.460 6.781 1.00 84.80 2 A 1 ATOM 10 C CA . LYS A 1 2 ? -8.949 3.173 7.344 1.00 85.86 2 A 1 ATOM 11 C C . LYS A 1 2 ? -8.340 1.913 6.729 1.00 86.75 2 A 1 ATOM 12 O O . LYS A 1 2 ? -7.148 1.870 6.427 1.00 84.41 2 A 1 ATOM 13 C CB . LYS A 1 2 ? -9.073 3.014 8.857 1.00 81.74 2 A 1 ATOM 14 C CG . LYS A 1 2 ? -7.739 2.806 9.536 1.00 73.65 2 A 1 ATOM 15 C CD . LYS A 1 2 ? -7.922 2.634 11.034 1.00 70.68 2 A 1 ATOM 16 C CE . LYS A 1 2 ? -6.614 2.243 11.700 1.00 63.45 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? -5.593 3.318 11.567 1.00 55.37 2 A 1 ATOM 18 N N . SER A 1 3 ? -9.161 0.899 6.534 1.00 89.09 3 A 1 ATOM 19 C CA . SER A 1 3 ? -8.706 -0.373 5.971 1.00 91.22 3 A 1 ATOM 20 C C . SER A 1 3 ? -8.176 -0.203 4.553 1.00 92.44 3 A 1 ATOM 21 O O . SER A 1 3 ? -7.195 -0.831 4.165 1.00 90.65 3 A 1 ATOM 22 C CB . SER A 1 3 ? -9.847 -1.385 5.974 1.00 88.00 3 A 1 ATOM 23 O OG . SER A 1 3 ? -10.385 -1.527 7.270 1.00 78.33 3 A 1 ATOM 24 N N . PHE A 1 4 ? -8.827 0.652 3.795 1.00 86.98 4 A 1 ATOM 25 C CA . PHE A 1 4 ? -8.427 0.894 2.411 1.00 88.43 4 A 1 ATOM 26 C C . PHE A 1 4 ? -7.003 1.425 2.335 1.00 90.51 4 A 1 ATOM 27 O O . PHE A 1 4 ? -6.226 1.030 1.466 1.00 88.73 4 A 1 ATOM 28 C CB . PHE A 1 4 ? -9.387 1.891 1.764 1.00 87.35 4 A 1 ATOM 29 C CG . PHE A 1 4 ? -9.169 2.014 0.279 1.00 84.36 4 A 1 ATOM 30 C CD1 . PHE A 1 4 ? -9.607 1.023 -0.582 1.00 81.33 4 A 1 ATOM 31 C CD2 . PHE A 1 4 ? -8.516 3.118 -0.242 1.00 80.08 4 A 1 ATOM 32 C CE1 . PHE A 1 4 ? -9.402 1.131 -1.948 1.00 77.83 4 A 1 ATOM 33 C CE2 . PHE A 1 4 ? -8.306 3.231 -1.613 1.00 78.97 4 A 1 ATOM 34 C CZ . PHE A 1 4 ? -8.752 2.237 -2.463 1.00 76.54 4 A 1 ATOM 35 N N . ILE A 1 5 ? -6.656 2.306 3.249 1.00 88.10 5 A 1 ATOM 36 C CA . ILE A 1 5 ? -5.314 2.887 3.286 1.00 87.79 5 A 1 ATOM 37 C C . ILE A 1 5 ? -4.273 1.804 3.555 1.00 89.38 5 A 1 ATOM 38 O O . ILE A 1 5 ? -3.195 1.795 2.961 1.00 87.62 5 A 1 ATOM 39 C CB . ILE A 1 5 ? -5.224 3.978 4.364 1.00 87.00 5 A 1 ATOM 40 C CG1 . ILE A 1 5 ? -6.317 5.030 4.161 1.00 83.63 5 A 1 ATOM 41 C CG2 . ILE A 1 5 ? -3.849 4.635 4.321 1.00 82.04 5 A 1 ATOM 42 C CD1 . ILE A 1 5 ? -6.419 5.997 5.325 1.00 74.93 5 A 1 ATOM 43 N N . SER A 1 6 ? -4.609 0.899 4.449 1.00 91.29 6 A 1 ATOM 44 C CA . SER A 1 6 ? -3.708 -0.200 4.798 1.00 91.60 6 A 1 ATOM 45 C C . SER A 1 6 ? -3.474 -1.111 3.592 1.00 92.79 6 A 1 ATOM 46 O O . SER A 1 6 ? -2.343 -1.503 3.310 1.00 91.67 6 A 1 ATOM 47 C CB . SER A 1 6 ? -4.295 -1.010 5.953 1.00 89.53 6 A 1 ATOM 48 O OG . SER A 1 6 ? -3.360 -1.970 6.392 1.00 77.36 6 A 1 ATOM 49 N N . LEU A 1 7 ? -4.547 -1.432 2.892 1.00 90.20 7 A 1 ATOM 50 C CA . LEU A 1 7 ? -4.463 -2.284 1.708 1.00 90.89 7 A 1 ATOM 51 C C . LEU A 1 7 ? -3.620 -1.624 0.625 1.00 92.61 7 A 1 ATOM 52 O O . LEU A 1 7 ? -2.787 -2.266 -0.016 1.00 91.39 7 A 1 ATOM 53 C CB . LEU A 1 7 ? -5.873 -2.578 1.172 1.00 90.35 7 A 1 ATOM 54 C CG . LEU A 1 7 ? -6.497 -3.877 1.673 1.00 82.62 7 A 1 ATOM 55 C CD1 . LEU A 1 7 ? -5.730 -5.071 1.133 1.00 78.23 7 A 1 ATOM 56 C CD2 . LEU A 1 7 ? -6.533 -3.912 3.187 1.00 78.95 7 A 1 ATOM 57 N N . LEU A 1 8 ? -3.843 -0.346 0.438 1.00 92.25 8 A 1 ATOM 58 C CA . LEU A 1 8 ? -3.102 0.412 -0.566 1.00 92.07 8 A 1 ATOM 59 C C . LEU A 1 8 ? -1.616 0.455 -0.224 1.00 93.27 8 A 1 ATOM 60 O O . LEU A 1 8 ? -0.764 0.278 -1.094 1.00 92.48 8 A 1 ATOM 61 C CB . LEU A 1 8 ? -3.663 1.831 -0.649 1.00 91.29 8 A 1 ATOM 62 C CG . LEU A 1 8 ? -3.157 2.614 -1.854 1.00 84.88 8 A 1 ATOM 63 C CD1 . LEU A 1 8 ? -3.766 2.071 -3.138 1.00 79.74 8 A 1 ATOM 64 C CD2 . LEU A 1 8 ? -3.498 4.088 -1.699 1.00 80.41 8 A 1 ATOM 65 N N . GLY A 1 9 ? -1.322 0.691 1.043 1.00 90.97 9 A 1 ATOM 66 C CA . GLY A 1 9 ? 0.063 0.745 1.498 1.00 91.80 9 A 1 ATOM 67 C C . GLY A 1 9 ? 0.772 -0.583 1.314 1.00 93.28 9 A 1 ATOM 68 O O . GLY A 1 9 ? 1.914 -0.635 0.857 1.00 92.23 9 A 1 ATOM 69 N N . LEU A 1 10 ? 0.091 -1.657 1.668 1.00 91.43 10 A 1 ATOM 70 C CA . LEU A 1 10 ? 0.656 -3.000 1.528 1.00 91.39 10 A 1 ATOM 71 C C . LEU A 1 10 ? 0.936 -3.315 0.066 1.00 92.92 10 A 1 ATOM 72 O O . LEU A 1 10 ? 2.003 -3.829 -0.277 1.00 91.29 10 A 1 ATOM 73 C CB . LEU A 1 10 ? -0.317 -4.030 2.103 1.00 90.58 10 A 1 ATOM 74 C CG . LEU A 1 10 ? 0.262 -5.440 2.173 1.00 84.14 10 A 1 ATOM 75 C CD1 . LEU A 1 10 ? 1.315 -5.532 3.267 1.00 78.97 10 A 1 ATOM 76 C CD2 . LEU A 1 10 ? -0.844 -6.452 2.426 1.00 79.52 10 A 1 ATOM 77 N N . SER A 1 11 ? -0.014 -3.005 -0.785 1.00 91.74 11 A 1 ATOM 78 C CA . SER A 1 11 ? 0.122 -3.244 -2.217 1.00 91.60 11 A 1 ATOM 79 C C . SER A 1 11 ? 1.259 -2.411 -2.798 1.00 92.34 11 A 1 ATOM 80 O O . SER A 1 11 ? 2.022 -2.883 -3.637 1.00 91.37 11 A 1 ATOM 81 C CB . SER A 1 11 ? -1.186 -2.913 -2.931 1.00 90.39 11 A 1 ATOM 82 O OG . SER A 1 11 ? -1.092 -3.246 -4.296 1.00 83.30 11 A 1 ATOM 83 N N . PHE A 1 12 ? 1.373 -1.198 -2.326 1.00 92.44 12 A 1 ATOM 84 C CA . PHE A 1 12 ? 2.421 -0.296 -2.795 1.00 92.08 12 A 1 ATOM 85 C C . PHE A 1 12 ? 3.802 -0.839 -2.450 1.00 92.92 12 A 1 ATOM 86 O O . PHE A 1 12 ? 4.710 -0.836 -3.286 1.00 91.94 12 A 1 ATOM 87 C CB . PHE A 1 12 ? 2.226 1.079 -2.162 1.00 91.56 12 A 1 ATOM 88 C CG . PHE A 1 12 ? 3.189 2.104 -2.694 1.00 87.52 12 A 1 ATOM 89 C CD1 . PHE A 1 12 ? 2.985 2.682 -3.934 1.00 84.29 12 A 1 ATOM 90 C CD2 . PHE A 1 12 ? 4.294 2.478 -1.948 1.00 84.54 12 A 1 ATOM 91 C CE1 . PHE A 1 12 ? 3.868 3.626 -4.431 1.00 83.17 12 A 1 ATOM 92 C CE2 . PHE A 1 12 ? 5.189 3.422 -2.442 1.00 82.85 12 A 1 ATOM 93 C CZ . PHE A 1 12 ? 4.972 3.996 -3.682 1.00 84.01 12 A 1 ATOM 94 N N . LEU A 1 13 ? 3.954 -1.312 -1.230 1.00 93.36 13 A 1 ATOM 95 C CA . LEU A 1 13 ? 5.231 -1.855 -0.779 1.00 92.69 13 A 1 ATOM 96 C C . LEU A 1 13 ? 5.608 -3.103 -1.561 1.00 93.44 13 A 1 ATOM 97 O O . LEU A 1 13 ? 6.743 -3.242 -2.011 1.00 92.20 13 A 1 ATOM 98 C CB . LEU A 1 13 ? 5.159 -2.183 0.712 1.00 92.40 13 A 1 ATOM 99 C CG . LEU A 1 13 ? 5.189 -0.958 1.614 1.00 87.25 13 A 1 ATOM 100 C CD1 . LEU A 1 13 ? 4.857 -1.348 3.046 1.00 80.84 13 A 1 ATOM 101 C CD2 . LEU A 1 13 ? 6.556 -0.291 1.559 1.00 81.08 13 A 1 ATOM 102 N N . THR A 1 14 ? 4.662 -4.005 -1.726 1.00 92.34 14 A 1 ATOM 103 C CA . THR A 1 14 ? 4.921 -5.248 -2.444 1.00 91.32 14 A 1 ATOM 104 C C . THR A 1 14 ? 5.201 -4.979 -3.918 1.00 91.63 14 A 1 ATOM 105 O O . THR A 1 14 ? 6.040 -5.636 -4.528 1.00 89.02 14 A 1 ATOM 106 C CB . THR A 1 14 ? 3.750 -6.230 -2.280 1.00 89.66 14 A 1 ATOM 107 O OG1 . THR A 1 14 ? 4.148 -7.514 -2.779 1.00 82.81 14 A 1 ATOM 108 C CG2 . THR A 1 14 ? 2.519 -5.781 -3.033 1.00 81.55 14 A 1 ATOM 109 N N . CYS A 1 15 ? 4.509 -4.003 -4.471 1.00 93.20 15 A 1 ATOM 110 C CA . CYS A 1 15 ? 4.706 -3.636 -5.869 1.00 92.88 15 A 1 ATOM 111 C C . CYS A 1 15 ? 6.110 -3.081 -6.085 1.00 93.54 15 A 1 ATOM 112 O O . CYS A 1 15 ? 6.800 -3.447 -7.032 1.00 91.70 15 A 1 ATOM 113 C CB . CYS A 1 15 ? 3.663 -2.601 -6.288 1.00 90.28 15 A 1 ATOM 114 S SG . CYS A 1 15 ? 3.785 -2.200 -8.035 1.00 82.28 15 A 1 ATOM 115 N N . HIS A 1 16 ? 6.527 -2.213 -5.183 1.00 90.61 16 A 1 ATOM 116 C CA . HIS A 1 16 ? 7.855 -1.615 -5.272 1.00 89.76 16 A 1 ATOM 117 C C . HIS A 1 16 ? 8.940 -2.664 -5.065 1.00 90.59 16 A 1 ATOM 118 O O . HIS A 1 16 ? 9.970 -2.649 -5.738 1.00 89.47 16 A 1 ATOM 119 C CB . HIS A 1 16 ? 7.999 -0.509 -4.230 1.00 87.62 16 A 1 ATOM 120 C CG . HIS A 1 16 ? 9.183 0.374 -4.490 1.00 79.15 16 A 1 ATOM 121 N ND1 . HIS A 1 16 ? 10.422 0.159 -3.956 1.00 70.42 16 A 1 ATOM 122 C CD2 . HIS A 1 16 ? 9.282 1.483 -5.253 1.00 71.37 16 A 1 ATOM 123 C CE1 . HIS A 1 16 ? 11.240 1.117 -4.390 1.00 69.60 16 A 1 ATOM 124 N NE2 . HIS A 1 16 ? 10.580 1.935 -5.176 1.00 70.90 16 A 1 ATOM 125 N N . ALA A 1 17 ? 8.710 -3.571 -4.137 1.00 91.69 17 A 1 ATOM 126 C CA . ALA A 1 17 ? 9.664 -4.642 -3.857 1.00 91.33 17 A 1 ATOM 127 C C . ALA A 1 17 ? 9.801 -5.580 -5.049 1.00 92.28 17 A 1 ATOM 128 O O . ALA A 1 17 ? 10.885 -6.093 -5.322 1.00 90.61 17 A 1 ATOM 129 C CB . ALA A 1 17 ? 9.222 -5.423 -2.627 1.00 88.64 17 A 1 ATOM 130 N N . SER A 1 18 ? 8.705 -5.805 -5.736 1.00 90.84 18 A 1 ATOM 131 C CA . SER A 1 18 ? 8.698 -6.668 -6.915 1.00 90.25 18 A 1 ATOM 132 C C . SER A 1 18 ? 9.500 -6.059 -8.054 1.00 88.96 18 A 1 ATOM 133 O O . SER A 1 18 ? 10.156 -6.767 -8.820 1.00 84.52 18 A 1 ATOM 134 C CB . SER A 1 18 ? 7.266 -6.920 -7.376 1.00 87.05 18 A 1 ATOM 135 O OG . SER A 1 18 ? 7.251 -7.835 -8.444 1.00 75.34 18 A 1 ATOM 136 N N . ALA A 1 19 ? 9.442 -4.736 -8.158 1.00 88.47 19 A 1 ATOM 137 C CA . ALA A 1 19 ? 10.152 -4.019 -9.206 1.00 87.02 19 A 1 ATOM 138 C C . ALA A 1 19 ? 11.659 -4.003 -8.954 1.00 84.38 19 A 1 ATOM 139 O O . ALA A 1 19 ? 12.074 -4.027 -7.785 1.00 79.62 19 A 1 ATOM 140 C CB . ALA A 1 19 ? 9.618 -2.596 -9.318 1.00 80.61 19 A 1 ATOM 141 O OXT . ALA A 1 19 ? 12.424 -3.943 -9.924 1.00 71.06 19 A 1 #