# 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_spkb13829 # _entry.id spkb13829 # 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" "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" "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 GLY 2 1 n PRO 3 1 n PRO 4 1 n SER 5 1 n LEU 6 1 n VAL 7 1 n LEU 8 1 n CYS 9 1 n LEU 10 1 n LEU 11 1 n SER 12 1 n ALA 13 1 n THR 14 1 n VAL 15 1 n PHE 16 1 n SER 17 1 n LEU 18 1 n LEU 19 1 n GLY 20 1 n GLY 21 1 n SER 22 1 n SER 23 1 n ALA 24 # _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 @ 2025-07-07 16:50:07)" _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 90.62 _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 78.39 1 1 A GLY 2 2 89.48 1 2 A PRO 3 2 89.65 1 3 A PRO 4 2 93.92 1 4 A SER 5 2 94.95 1 5 A LEU 6 2 94.17 1 6 A VAL 7 2 96.89 1 7 A LEU 8 2 95.64 1 8 A CYS 9 2 96.74 1 9 A LEU 10 2 95.42 1 10 A LEU 11 2 95.75 1 11 A SER 12 2 95.15 1 12 A ALA 13 2 96.91 1 13 A THR 14 2 94.82 1 14 A VAL 15 2 96.01 1 15 A PHE 16 2 92.66 1 16 A SER 17 2 93.16 1 17 A LEU 18 2 93.55 1 18 A LEU 19 2 91.50 1 19 A GLY 20 2 89.70 1 20 A GLY 21 2 83.67 1 21 A SER 22 2 75.60 1 22 A SER 23 2 73.04 1 23 A ALA 24 2 67.95 1 24 # _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 GLY . 2 A 2 A 3 1 n PRO . 3 A 3 A 4 1 n PRO . 4 A 4 A 5 1 n SER . 5 A 5 A 6 1 n LEU . 6 A 6 A 7 1 n VAL . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n CYS . 9 A 9 A 10 1 n LEU . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n SER . 12 A 12 A 13 1 n ALA . 13 A 13 A 14 1 n THR . 14 A 14 A 15 1 n VAL . 15 A 15 A 16 1 n PHE . 16 A 16 A 17 1 n SER . 17 A 17 A 18 1 n LEU . 18 A 18 A 19 1 n LEU . 19 A 19 A 20 1 n GLY . 20 A 20 A 21 1 n GLY . 21 A 21 A 22 1 n SER . 22 A 22 A 23 1 n SER . 23 A 23 A 24 1 n ALA . 24 A 24 # _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 ? -18.498 6.499 7.303 1.00 85.86 1 A 1 ATOM 2 C CA . MET A 1 1 ? -17.906 5.414 6.504 1.00 86.49 1 A 1 ATOM 3 C C . MET A 1 1 ? -16.494 5.818 6.123 1.00 87.49 1 A 1 ATOM 4 O O . MET A 1 1 ? -16.325 6.804 5.415 1.00 81.52 1 A 1 ATOM 5 C CB . MET A 1 1 ? -18.741 5.150 5.244 1.00 80.26 1 A 1 ATOM 6 C CG . MET A 1 1 ? -19.929 4.240 5.541 1.00 74.40 1 A 1 ATOM 7 S SD . MET A 1 1 ? -21.033 4.080 4.123 1.00 69.09 1 A 1 ATOM 8 C CE . MET A 1 1 ? -21.900 2.572 4.558 1.00 61.97 1 A 1 ATOM 9 N N . GLY A 1 2 ? -15.498 5.111 6.629 1.00 87.83 2 A 1 ATOM 10 C CA . GLY A 1 2 ? -14.128 5.296 6.154 1.00 89.53 2 A 1 ATOM 11 C C . GLY A 1 2 ? -14.024 4.826 4.701 1.00 91.32 2 A 1 ATOM 12 O O . GLY A 1 2 ? -14.773 3.935 4.302 1.00 89.23 2 A 1 ATOM 13 N N . PRO A 1 3 ? -13.119 5.392 3.896 1.00 90.86 3 A 1 ATOM 14 C CA . PRO A 1 3 ? -12.956 4.997 2.501 1.00 93.55 3 A 1 ATOM 15 C C . PRO A 1 3 ? -12.286 3.615 2.411 1.00 94.93 3 A 1 ATOM 16 O O . PRO A 1 3 ? -11.074 3.516 2.624 1.00 91.95 3 A 1 ATOM 17 C CB . PRO A 1 3 ? -12.115 6.123 1.889 1.00 88.96 3 A 1 ATOM 18 C CG . PRO A 1 3 ? -11.328 6.696 3.052 1.00 81.91 3 A 1 ATOM 19 C CD . PRO A 1 3 ? -12.235 6.475 4.259 1.00 85.40 3 A 1 ATOM 20 N N . PRO A 1 4 ? -13.031 2.541 2.095 1.00 95.61 4 A 1 ATOM 21 C CA . PRO A 1 4 ? -12.464 1.194 2.002 1.00 96.21 4 A 1 ATOM 22 C C . PRO A 1 4 ? -11.467 1.077 0.850 1.00 96.84 4 A 1 ATOM 23 O O . PRO A 1 4 ? -10.494 0.331 0.937 1.00 94.83 4 A 1 ATOM 24 C CB . PRO A 1 4 ? -13.679 0.274 1.820 1.00 93.40 4 A 1 ATOM 25 C CG . PRO A 1 4 ? -14.734 1.163 1.197 1.00 88.49 4 A 1 ATOM 26 C CD . PRO A 1 4 ? -14.456 2.536 1.795 1.00 92.08 4 A 1 ATOM 27 N N . SER A 1 5 ? -11.660 1.860 -0.205 1.00 96.77 5 A 1 ATOM 28 C CA . SER A 1 5 ? -10.751 1.919 -1.353 1.00 97.27 5 A 1 ATOM 29 C C . SER A 1 5 ? -9.370 2.452 -0.970 1.00 97.74 5 A 1 ATOM 30 O O . SER A 1 5 ? -8.365 2.018 -1.524 1.00 96.87 5 A 1 ATOM 31 C CB . SER A 1 5 ? -11.353 2.811 -2.434 1.00 95.73 5 A 1 ATOM 32 O OG . SER A 1 5 ? -12.698 2.452 -2.673 1.00 85.35 5 A 1 ATOM 33 N N . LEU A 1 6 ? -9.311 3.373 0.003 1.00 96.56 6 A 1 ATOM 34 C CA . LEU A 1 6 ? -8.057 3.951 0.484 1.00 96.94 6 A 1 ATOM 35 C C . LEU A 1 6 ? -7.247 2.915 1.265 1.00 97.55 6 A 1 ATOM 36 O O . LEU A 1 6 ? -6.035 2.824 1.095 1.00 97.39 6 A 1 ATOM 37 C CB . LEU A 1 6 ? -8.381 5.201 1.313 1.00 96.44 6 A 1 ATOM 38 C CG . LEU A 1 6 ? -7.408 6.357 1.081 1.00 91.65 6 A 1 ATOM 39 C CD1 . LEU A 1 6 ? -8.051 7.679 1.486 1.00 88.88 6 A 1 ATOM 40 C CD2 . LEU A 1 6 ? -6.118 6.185 1.868 1.00 87.96 6 A 1 ATOM 41 N N . VAL A 1 7 ? -7.918 2.086 2.070 1.00 97.32 7 A 1 ATOM 42 C CA . VAL A 1 7 ? -7.282 0.972 2.795 1.00 97.55 7 A 1 ATOM 43 C C . VAL A 1 7 ? -6.698 -0.046 1.814 1.00 97.79 7 A 1 ATOM 44 O O . VAL A 1 7 ? -5.560 -0.485 1.985 1.00 97.73 7 A 1 ATOM 45 C CB . VAL A 1 7 ? -8.285 0.300 3.746 1.00 97.23 7 A 1 ATOM 46 C CG1 . VAL A 1 7 ? -7.655 -0.872 4.494 1.00 95.57 7 A 1 ATOM 47 C CG2 . VAL A 1 7 ? -8.814 1.298 4.775 1.00 95.03 7 A 1 ATOM 48 N N . LEU A 1 8 ? -7.434 -0.375 0.767 1.00 97.93 8 A 1 ATOM 49 C CA . LEU A 1 8 ? -6.980 -1.291 -0.282 1.00 97.77 8 A 1 ATOM 50 C C . LEU A 1 8 ? -5.776 -0.729 -1.045 1.00 97.94 8 A 1 ATOM 51 O O . LEU A 1 8 ? -4.803 -1.445 -1.278 1.00 97.88 8 A 1 ATOM 52 C CB . LEU A 1 8 ? -8.165 -1.584 -1.215 1.00 97.41 8 A 1 ATOM 53 C CG . LEU A 1 8 ? -8.500 -3.078 -1.291 1.00 92.80 8 A 1 ATOM 54 C CD1 . LEU A 1 8 ? -9.971 -3.267 -1.640 1.00 91.61 8 A 1 ATOM 55 C CD2 . LEU A 1 8 ? -7.643 -3.777 -2.333 1.00 91.75 8 A 1 ATOM 56 N N . CYS A 1 9 ? -5.800 0.562 -1.375 1.00 97.69 9 A 1 ATOM 57 C CA . CYS A 1 9 ? -4.668 1.250 -1.997 1.00 97.59 9 A 1 ATOM 58 C C . CYS A 1 9 ? -3.440 1.258 -1.085 1.00 97.78 9 A 1 ATOM 59 O O . CYS A 1 9 ? -2.334 1.024 -1.551 1.00 97.24 9 A 1 ATOM 60 C CB . CYS A 1 9 ? -5.064 2.685 -2.353 1.00 97.09 9 A 1 ATOM 61 S SG . CYS A 1 9 ? -5.835 2.749 -3.988 1.00 93.05 9 A 1 ATOM 62 N N . LEU A 1 10 ? -3.631 1.501 0.213 1.00 97.52 10 A 1 ATOM 63 C CA . LEU A 1 10 ? -2.545 1.513 1.192 1.00 97.54 10 A 1 ATOM 64 C C . LEU A 1 10 ? -1.909 0.130 1.330 1.00 97.79 10 A 1 ATOM 65 O O . LEU A 1 10 ? -0.687 0.006 1.361 1.00 97.72 10 A 1 ATOM 66 C CB . LEU A 1 10 ? -3.096 2.019 2.530 1.00 97.40 10 A 1 ATOM 67 C CG . LEU A 1 10 ? -1.991 2.541 3.457 1.00 92.38 10 A 1 ATOM 68 C CD1 . LEU A 1 10 ? -2.215 4.023 3.776 1.00 91.30 10 A 1 ATOM 69 C CD2 . LEU A 1 10 ? -1.959 1.763 4.769 1.00 91.73 10 A 1 ATOM 70 N N . LEU A 1 11 ? -2.729 -0.911 1.368 1.00 97.89 11 A 1 ATOM 71 C CA . LEU A 1 11 ? -2.266 -2.296 1.432 1.00 97.59 11 A 1 ATOM 72 C C . LEU A 1 11 ? -1.490 -2.671 0.167 1.00 97.66 11 A 1 ATOM 73 O O . LEU A 1 11 ? -0.394 -3.224 0.255 1.00 97.55 11 A 1 ATOM 74 C CB . LEU A 1 11 ? -3.488 -3.197 1.669 1.00 97.36 11 A 1 ATOM 75 C CG . LEU A 1 11 ? -3.184 -4.398 2.574 1.00 93.47 11 A 1 ATOM 76 C CD1 . LEU A 1 11 ? -4.411 -4.738 3.415 1.00 91.92 11 A 1 ATOM 77 C CD2 . LEU A 1 11 ? -2.784 -5.620 1.767 1.00 92.54 11 A 1 ATOM 78 N N . SER A 1 12 ? -2.001 -2.297 -0.994 1.00 97.32 12 A 1 ATOM 79 C CA . SER A 1 12 ? -1.326 -2.510 -2.275 1.00 96.84 12 A 1 ATOM 80 C C . SER A 1 12 ? 0.005 -1.757 -2.352 1.00 96.88 12 A 1 ATOM 81 O O . SER A 1 12 ? 1.014 -2.332 -2.752 1.00 96.19 12 A 1 ATOM 82 C CB . SER A 1 12 ? -2.251 -2.084 -3.414 1.00 95.86 12 A 1 ATOM 83 O OG . SER A 1 12 ? -1.721 -2.489 -4.654 1.00 87.84 12 A 1 ATOM 84 N N . ALA A 1 13 ? 0.044 -0.506 -1.898 1.00 97.34 13 A 1 ATOM 85 C CA . ALA A 1 13 ? 1.265 0.295 -1.852 1.00 97.20 13 A 1 ATOM 86 C C . ALA A 1 13 ? 2.309 -0.318 -0.911 1.00 97.26 13 A 1 ATOM 87 O O . ALA A 1 13 ? 3.492 -0.339 -1.237 1.00 96.03 13 A 1 ATOM 88 C CB . ALA A 1 13 ? 0.910 1.720 -1.424 1.00 96.73 13 A 1 ATOM 89 N N . THR A 1 14 ? 1.883 -0.865 0.229 1.00 96.68 14 A 1 ATOM 90 C CA . THR A 1 14 ? 2.769 -1.553 1.171 1.00 96.33 14 A 1 ATOM 91 C C . THR A 1 14 ? 3.379 -2.801 0.540 1.00 96.28 14 A 1 ATOM 92 O O . THR A 1 14 ? 4.588 -3.004 0.633 1.00 95.11 14 A 1 ATOM 93 C CB . THR A 1 14 ? 2.015 -1.925 2.452 1.00 95.77 14 A 1 ATOM 94 O OG1 . THR A 1 14 ? 1.454 -0.774 3.038 1.00 92.52 14 A 1 ATOM 95 C CG2 . THR A 1 14 ? 2.936 -2.536 3.502 1.00 91.06 14 A 1 ATOM 96 N N . VAL A 1 15 ? 2.578 -3.611 -0.139 1.00 97.06 15 A 1 ATOM 97 C CA . VAL A 1 15 ? 3.066 -4.796 -0.859 1.00 96.83 15 A 1 ATOM 98 C C . VAL A 1 15 ? 4.055 -4.397 -1.955 1.00 96.75 15 A 1 ATOM 99 O O . VAL A 1 15 ? 5.115 -5.008 -2.078 1.00 96.13 15 A 1 ATOM 100 C CB . VAL A 1 15 ? 1.891 -5.597 -1.442 1.00 96.28 15 A 1 ATOM 101 C CG1 . VAL A 1 15 ? 2.362 -6.742 -2.336 1.00 94.75 15 A 1 ATOM 102 C CG2 . VAL A 1 15 ? 1.044 -6.200 -0.323 1.00 94.28 15 A 1 ATOM 103 N N . PHE A 1 16 ? 3.751 -3.344 -2.706 1.00 95.94 16 A 1 ATOM 104 C CA . PHE A 1 16 ? 4.637 -2.832 -3.749 1.00 94.99 16 A 1 ATOM 105 C C . PHE A 1 16 ? 5.948 -2.298 -3.169 1.00 95.32 16 A 1 ATOM 106 O O . PHE A 1 16 ? 7.019 -2.547 -3.718 1.00 94.73 16 A 1 ATOM 107 C CB . PHE A 1 16 ? 3.895 -1.748 -4.532 1.00 94.07 16 A 1 ATOM 108 C CG . PHE A 1 16 ? 4.277 -1.730 -5.992 1.00 92.88 16 A 1 ATOM 109 C CD1 . PHE A 1 16 ? 5.355 -0.961 -6.440 1.00 90.49 16 A 1 ATOM 110 C CD2 . PHE A 1 16 ? 3.549 -2.507 -6.905 1.00 90.90 16 A 1 ATOM 111 C CE1 . PHE A 1 16 ? 5.712 -0.961 -7.790 1.00 89.98 16 A 1 ATOM 112 C CE2 . PHE A 1 16 ? 3.902 -2.508 -8.257 1.00 89.68 16 A 1 ATOM 113 C CZ . PHE A 1 16 ? 4.983 -1.738 -8.702 1.00 90.25 16 A 1 ATOM 114 N N . SER A 1 17 ? 5.887 -1.625 -2.017 1.00 95.90 17 A 1 ATOM 115 C CA . SER A 1 17 ? 7.073 -1.135 -1.313 1.00 95.35 17 A 1 ATOM 116 C C . SER A 1 17 ? 7.926 -2.284 -0.773 1.00 95.68 17 A 1 ATOM 117 O O . SER A 1 17 ? 9.149 -2.209 -0.826 1.00 93.85 17 A 1 ATOM 118 C CB . SER A 1 17 ? 6.675 -0.219 -0.158 1.00 93.62 17 A 1 ATOM 119 O OG . SER A 1 17 ? 6.023 0.935 -0.648 1.00 84.55 17 A 1 ATOM 120 N N . LEU A 1 18 ? 7.306 -3.356 -0.284 1.00 96.36 18 A 1 ATOM 121 C CA . LEU A 1 18 ? 8.025 -4.553 0.161 1.00 96.11 18 A 1 ATOM 122 C C . LEU A 1 18 ? 8.671 -5.287 -1.015 1.00 96.37 18 A 1 ATOM 123 O O . LEU A 1 18 ? 9.781 -5.805 -0.878 1.00 95.40 18 A 1 ATOM 124 C CB . LEU A 1 18 ? 7.054 -5.481 0.905 1.00 95.35 18 A 1 ATOM 125 C CG . LEU A 1 18 ? 6.686 -4.989 2.312 1.00 91.87 18 A 1 ATOM 126 C CD1 . LEU A 1 18 ? 5.494 -5.776 2.842 1.00 88.79 18 A 1 ATOM 127 C CD2 . LEU A 1 18 ? 7.851 -5.162 3.284 1.00 88.12 18 A 1 ATOM 128 N N . LEU A 1 19 ? 8.004 -5.300 -2.167 1.00 95.86 19 A 1 ATOM 129 C CA . LEU A 1 19 ? 8.517 -5.943 -3.376 1.00 95.13 19 A 1 ATOM 130 C C . LEU A 1 19 ? 9.754 -5.232 -3.930 1.00 94.77 19 A 1 ATOM 131 O O . LEU A 1 19 ? 10.709 -5.890 -4.335 1.00 93.03 19 A 1 ATOM 132 C CB . LEU A 1 19 ? 7.391 -5.976 -4.421 1.00 93.65 19 A 1 ATOM 133 C CG . LEU A 1 19 ? 7.698 -6.882 -5.619 1.00 89.81 19 A 1 ATOM 134 C CD1 . LEU A 1 19 ? 7.491 -8.351 -5.261 1.00 85.88 19 A 1 ATOM 135 C CD2 . LEU A 1 19 ? 6.785 -6.527 -6.786 1.00 83.90 19 A 1 ATOM 136 N N . GLY A 1 20 ? 9.761 -3.905 -3.935 1.00 92.87 20 A 1 ATOM 137 C CA . GLY A 1 20 ? 10.836 -3.107 -4.539 1.00 91.09 20 A 1 ATOM 138 C C . GLY A 1 20 ? 11.654 -2.275 -3.556 1.00 89.84 20 A 1 ATOM 139 O O . GLY A 1 20 ? 12.655 -1.676 -3.951 1.00 85.00 20 A 1 ATOM 140 N N . GLY A 1 21 ? 11.259 -2.207 -2.283 1.00 87.12 21 A 1 ATOM 141 C CA . GLY A 1 21 ? 11.881 -1.338 -1.278 1.00 84.17 21 A 1 ATOM 142 C C . GLY A 1 21 ? 12.959 -2.012 -0.437 1.00 83.93 21 A 1 ATOM 143 O O . GLY A 1 21 ? 13.629 -1.339 0.346 1.00 79.47 21 A 1 ATOM 144 N N . SER A 1 22 ? 13.158 -3.314 -0.580 1.00 80.05 22 A 1 ATOM 145 C CA . SER A 1 22 ? 14.137 -4.083 0.205 1.00 79.66 22 A 1 ATOM 146 C C . SER A 1 22 ? 15.507 -4.178 -0.476 1.00 79.10 22 A 1 ATOM 147 O O . SER A 1 22 ? 16.146 -5.222 -0.443 1.00 73.77 22 A 1 ATOM 148 C CB . SER A 1 22 ? 13.585 -5.469 0.545 1.00 74.96 22 A 1 ATOM 149 O OG . SER A 1 22 ? 12.488 -5.362 1.416 1.00 66.04 22 A 1 ATOM 150 N N . SER A 1 23 ? 15.985 -3.086 -1.088 1.00 78.30 23 A 1 ATOM 151 C CA . SER A 1 23 ? 17.271 -3.056 -1.815 1.00 76.80 23 A 1 ATOM 152 C C . SER A 1 23 ? 17.349 -4.092 -2.940 1.00 75.92 23 A 1 ATOM 153 O O . SER A 1 23 ? 18.239 -4.939 -2.958 1.00 70.24 23 A 1 ATOM 154 C CB . SER A 1 23 ? 18.454 -3.206 -0.849 1.00 72.18 23 A 1 ATOM 155 O OG . SER A 1 23 ? 18.406 -2.234 0.168 1.00 64.79 23 A 1 ATOM 156 N N . ALA A 1 24 ? 16.398 -4.009 -3.886 1.00 76.96 24 A 1 ATOM 157 C CA . ALA A 1 24 ? 16.407 -4.802 -5.109 1.00 73.24 24 A 1 ATOM 158 C C . ALA A 1 24 ? 16.150 -3.888 -6.299 1.00 69.33 24 A 1 ATOM 159 O O . ALA A 1 24 ? 15.174 -3.126 -6.256 1.00 62.97 24 A 1 ATOM 160 C CB . ALA A 1 24 ? 15.394 -5.937 -5.019 1.00 65.12 24 A 1 ATOM 161 O OXT . ALA A 1 24 ? 16.952 -3.914 -7.258 1.00 60.09 24 A 1 #