# 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_spkb16843 # _entry.id spkb16843 # 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" "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" "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" "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 LYS 2 1 n LEU 3 1 n SER 4 1 n LEU 5 1 n ALA 6 1 n ALA 7 1 n ALA 8 1 n LEU 9 1 n LEU 10 1 n GLY 11 1 n ALA 12 1 n LEU 13 1 n ALA 14 1 n VAL 15 1 n SER 16 1 n ALA 17 1 n GLN 18 1 n THR 19 1 n SER 20 1 n THR 21 # _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 @ 2025-07-05 11:57:54)" _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 89.00 _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 83.12 1 1 A LYS 2 2 85.88 1 2 A LEU 3 2 90.64 1 3 A SER 4 2 93.26 1 4 A LEU 5 2 92.33 1 5 A ALA 6 2 96.02 1 6 A ALA 7 2 96.65 1 7 A ALA 8 2 97.07 1 8 A LEU 9 2 93.68 1 9 A LEU 10 2 93.07 1 10 A GLY 11 2 94.23 1 11 A ALA 12 2 94.63 1 12 A LEU 13 2 91.36 1 13 A ALA 14 2 93.14 1 14 A VAL 15 2 91.89 1 15 A SER 16 2 88.80 1 16 A ALA 17 2 90.52 1 17 A GLN 18 2 81.77 1 18 A THR 19 2 79.89 1 19 A SER 20 2 77.52 1 20 A THR 21 2 77.58 1 21 # _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 LEU . 3 A 3 A 4 1 n SER . 4 A 4 A 5 1 n LEU . 5 A 5 A 6 1 n ALA . 6 A 6 A 7 1 n ALA . 7 A 7 A 8 1 n ALA . 8 A 8 A 9 1 n LEU . 9 A 9 A 10 1 n LEU . 10 A 10 A 11 1 n GLY . 11 A 11 A 12 1 n ALA . 12 A 12 A 13 1 n LEU . 13 A 13 A 14 1 n ALA . 14 A 14 A 15 1 n VAL . 15 A 15 A 16 1 n SER . 16 A 16 A 17 1 n ALA . 17 A 17 A 18 1 n GLN . 18 A 18 A 19 1 n THR . 19 A 19 A 20 1 n SER . 20 A 20 A 21 1 n THR . 21 A 21 # _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 ? -8.317 16.438 9.655 1.00 89.47 1 A 1 ATOM 2 C CA . MET A 1 1 ? -7.215 15.468 9.547 1.00 90.26 1 A 1 ATOM 3 C C . MET A 1 1 ? -7.388 14.581 8.322 1.00 91.39 1 A 1 ATOM 4 O O . MET A 1 1 ? -8.458 14.012 8.121 1.00 87.85 1 A 1 ATOM 5 C CB . MET A 1 1 ? -7.160 14.589 10.795 1.00 84.46 1 A 1 ATOM 6 C CG . MET A 1 1 ? -6.413 15.253 11.937 1.00 80.57 1 A 1 ATOM 7 S SD . MET A 1 1 ? -6.185 14.135 13.317 1.00 76.28 1 A 1 ATOM 8 C CE . MET A 1 1 ? -5.185 15.146 14.384 1.00 64.69 1 A 1 ATOM 9 N N . LYS A 1 2 ? -6.354 14.466 7.530 1.00 91.82 2 A 1 ATOM 10 C CA . LYS A 1 2 ? -6.391 13.645 6.326 1.00 93.20 2 A 1 ATOM 11 C C . LYS A 1 2 ? -5.544 12.392 6.531 1.00 93.02 2 A 1 ATOM 12 O O . LYS A 1 2 ? -4.330 12.407 6.313 1.00 92.61 2 A 1 ATOM 13 C CB . LYS A 1 2 ? -5.899 14.451 5.125 1.00 90.96 2 A 1 ATOM 14 C CG . LYS A 1 2 ? -4.486 14.994 5.275 1.00 84.47 2 A 1 ATOM 15 C CD . LYS A 1 2 ? -4.463 16.501 5.084 1.00 82.08 2 A 1 ATOM 16 C CE . LYS A 1 2 ? -3.045 17.024 5.056 1.00 75.31 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? -2.893 18.201 5.908 1.00 69.49 2 A 1 ATOM 18 N N . LEU A 1 3 ? -6.176 11.324 6.950 1.00 92.82 3 A 1 ATOM 19 C CA . LEU A 1 3 ? -5.484 10.061 7.183 1.00 94.82 3 A 1 ATOM 20 C C . LEU A 1 3 ? -5.808 9.043 6.102 1.00 96.29 3 A 1 ATOM 21 O O . LEU A 1 3 ? -5.011 8.153 5.819 1.00 94.55 3 A 1 ATOM 22 C CB . LEU A 1 3 ? -5.865 9.517 8.559 1.00 93.72 3 A 1 ATOM 23 C CG . LEU A 1 3 ? -4.684 9.396 9.509 1.00 88.03 3 A 1 ATOM 24 C CD1 . LEU A 1 3 ? -5.060 9.881 10.901 1.00 83.89 3 A 1 ATOM 25 C CD2 . LEU A 1 3 ? -4.205 7.961 9.561 1.00 80.98 3 A 1 ATOM 26 N N . SER A 1 4 ? -6.984 9.196 5.507 1.00 95.40 4 A 1 ATOM 27 C CA . SER A 1 4 ? -7.424 8.293 4.446 1.00 95.72 4 A 1 ATOM 28 C C . SER A 1 4 ? -6.450 8.308 3.271 1.00 96.49 4 A 1 ATOM 29 O O . SER A 1 4 ? -6.025 7.261 2.785 1.00 95.70 4 A 1 ATOM 30 C CB . SER A 1 4 ? -8.822 8.688 3.977 1.00 94.39 4 A 1 ATOM 31 O OG . SER A 1 4 ? -9.522 7.572 3.501 1.00 81.86 4 A 1 ATOM 32 N N . LEU A 1 5 ? -6.098 9.500 2.824 1.00 95.35 5 A 1 ATOM 33 C CA . LEU A 1 5 ? -5.164 9.648 1.711 1.00 95.75 5 A 1 ATOM 34 C C . LEU A 1 5 ? -3.762 9.205 2.107 1.00 96.72 5 A 1 ATOM 35 O O . LEU A 1 5 ? -3.090 8.498 1.357 1.00 96.19 5 A 1 ATOM 36 C CB . LEU A 1 5 ? -5.142 11.108 1.255 1.00 95.13 5 A 1 ATOM 37 C CG . LEU A 1 5 ? -6.289 11.470 0.317 1.00 88.81 5 A 1 ATOM 38 C CD1 . LEU A 1 5 ? -6.733 12.901 0.521 1.00 85.36 5 A 1 ATOM 39 C CD2 . LEU A 1 5 ? -5.856 11.249 -1.126 1.00 85.30 5 A 1 ATOM 40 N N . ALA A 1 6 ? -3.333 9.626 3.282 1.00 95.87 6 A 1 ATOM 41 C CA . ALA A 1 6 ? -2.009 9.266 3.777 1.00 96.17 6 A 1 ATOM 42 C C . ALA A 1 6 ? -1.905 7.764 4.010 1.00 96.85 6 A 1 ATOM 43 O O . ALA A 1 6 ? -0.893 7.145 3.687 1.00 95.88 6 A 1 ATOM 44 C CB . ALA A 1 6 ? -1.715 10.028 5.063 1.00 95.33 6 A 1 ATOM 45 N N . ALA A 1 7 ? -2.953 7.182 4.560 1.00 96.93 7 A 1 ATOM 46 C CA . ALA A 1 7 ? -2.984 5.749 4.831 1.00 96.94 7 A 1 ATOM 47 C C . ALA A 1 7 ? -2.952 4.948 3.537 1.00 97.32 7 A 1 ATOM 48 O O . ALA A 1 7 ? -2.286 3.919 3.454 1.00 96.13 7 A 1 ATOM 49 C CB . ALA A 1 7 ? -4.233 5.404 5.630 1.00 95.93 7 A 1 ATOM 50 N N . ALA A 1 8 ? -3.675 5.424 2.532 1.00 97.39 8 A 1 ATOM 51 C CA . ALA A 1 8 ? -3.715 4.757 1.236 1.00 97.26 8 A 1 ATOM 52 C C . ALA A 1 8 ? -2.333 4.751 0.588 1.00 97.66 8 A 1 ATOM 53 O O . ALA A 1 8 ? -1.898 3.733 0.047 1.00 96.43 8 A 1 ATOM 54 C CB . ALA A 1 8 ? -4.720 5.454 0.329 1.00 96.60 8 A 1 ATOM 55 N N . LEU A 1 9 ? -1.657 5.880 0.658 1.00 96.41 9 A 1 ATOM 56 C CA . LEU A 1 9 ? -0.321 6.004 0.085 1.00 96.08 9 A 1 ATOM 57 C C . LEU A 1 9 ? 0.671 5.120 0.826 1.00 96.60 9 A 1 ATOM 58 O O . LEU A 1 9 ? 1.483 4.431 0.207 1.00 95.90 9 A 1 ATOM 59 C CB . LEU A 1 9 ? 0.127 7.467 0.144 1.00 95.75 9 A 1 ATOM 60 C CG . LEU A 1 9 ? -0.412 8.324 -1.002 1.00 90.83 9 A 1 ATOM 61 C CD1 . LEU A 1 9 ? -0.563 9.775 -0.577 1.00 89.06 9 A 1 ATOM 62 C CD2 . LEU A 1 9 ? 0.521 8.226 -2.201 1.00 88.83 9 A 1 ATOM 63 N N . LEU A 1 10 ? 0.591 5.146 2.139 1.00 96.11 10 A 1 ATOM 64 C CA . LEU A 1 10 ? 1.478 4.331 2.965 1.00 95.69 10 A 1 ATOM 65 C C . LEU A 1 10 ? 1.214 2.851 2.745 1.00 96.21 10 A 1 ATOM 66 O O . LEU A 1 10 ? 2.144 2.048 2.666 1.00 95.44 10 A 1 ATOM 67 C CB . LEU A 1 10 ? 1.283 4.695 4.437 1.00 94.90 10 A 1 ATOM 68 C CG . LEU A 1 10 ? 2.442 5.499 5.025 1.00 89.97 10 A 1 ATOM 69 C CD1 . LEU A 1 10 ? 1.941 6.733 5.756 1.00 88.36 10 A 1 ATOM 70 C CD2 . LEU A 1 10 ? 3.251 4.626 5.965 1.00 87.85 10 A 1 ATOM 71 N N . GLY A 1 11 ? -0.053 2.503 2.640 1.00 94.34 11 A 1 ATOM 72 C CA . GLY A 1 11 ? -0.429 1.113 2.411 1.00 93.74 11 A 1 ATOM 73 C C . GLY A 1 11 ? 0.104 0.603 1.090 1.00 94.72 11 A 1 ATOM 74 O O . GLY A 1 11 ? 0.647 -0.497 1.009 1.00 94.14 11 A 1 ATOM 75 N N . ALA A 1 12 ? -0.051 1.402 0.050 1.00 95.11 12 A 1 ATOM 76 C CA . ALA A 1 12 ? 0.436 1.039 -1.277 1.00 94.84 12 A 1 ATOM 77 C C . ALA A 1 12 ? 1.953 0.882 -1.271 1.00 95.61 12 A 1 ATOM 78 O O . ALA A 1 12 ? 2.493 -0.027 -1.901 1.00 93.68 12 A 1 ATOM 79 C CB . ALA A 1 12 ? 0.020 2.102 -2.286 1.00 93.92 12 A 1 ATOM 80 N N . LEU A 1 13 ? 2.623 1.757 -0.554 1.00 95.16 13 A 1 ATOM 81 C CA . LEU A 1 13 ? 4.081 1.713 -0.459 1.00 94.41 13 A 1 ATOM 82 C C . LEU A 1 13 ? 4.533 0.476 0.297 1.00 94.85 13 A 1 ATOM 83 O O . LEU A 1 13 ? 5.531 -0.151 -0.063 1.00 93.65 13 A 1 ATOM 84 C CB . LEU A 1 13 ? 4.592 2.975 0.237 1.00 93.51 13 A 1 ATOM 85 C CG . LEU A 1 13 ? 5.959 3.428 -0.256 1.00 87.58 13 A 1 ATOM 86 C CD1 . LEU A 1 13 ? 5.951 4.918 -0.558 1.00 85.94 13 A 1 ATOM 87 C CD2 . LEU A 1 13 ? 7.036 3.102 0.755 1.00 85.80 13 A 1 ATOM 88 N N . ALA A 1 14 ? 3.796 0.123 1.330 1.00 94.07 14 A 1 ATOM 89 C CA . ALA A 1 14 ? 4.114 -1.054 2.132 1.00 93.53 14 A 1 ATOM 90 C C . ALA A 1 14 ? 4.032 -2.319 1.289 1.00 93.88 14 A 1 ATOM 91 O O . ALA A 1 14 ? 4.896 -3.190 1.373 1.00 92.02 14 A 1 ATOM 92 C CB . ALA A 1 14 ? 3.162 -1.143 3.316 1.00 92.21 14 A 1 ATOM 93 N N . VAL A 1 15 ? 3.002 -2.418 0.470 1.00 94.26 15 A 1 ATOM 94 C CA . VAL A 1 15 ? 2.814 -3.573 -0.408 1.00 93.27 15 A 1 ATOM 95 C C . VAL A 1 15 ? 3.912 -3.613 -1.463 1.00 93.61 15 A 1 ATOM 96 O O . VAL A 1 15 ? 4.446 -4.680 -1.776 1.00 92.70 15 A 1 ATOM 97 C CB . VAL A 1 15 ? 1.436 -3.528 -1.080 1.00 91.80 15 A 1 ATOM 98 C CG1 . VAL A 1 15 ? 1.259 -4.702 -2.031 1.00 88.30 15 A 1 ATOM 99 C CG2 . VAL A 1 15 ? 0.332 -3.538 -0.040 1.00 89.28 15 A 1 ATOM 100 N N . SER A 1 16 ? 4.241 -2.458 -2.002 1.00 92.70 16 A 1 ATOM 101 C CA . SER A 1 16 ? 5.286 -2.349 -3.015 1.00 91.53 16 A 1 ATOM 102 C C . SER A 1 16 ? 6.641 -2.741 -2.440 1.00 91.48 16 A 1 ATOM 103 O O . SER A 1 16 ? 7.431 -3.422 -3.091 1.00 90.11 16 A 1 ATOM 104 C CB . SER A 1 16 ? 5.349 -0.926 -3.560 1.00 89.68 16 A 1 ATOM 105 O OG . SER A 1 16 ? 4.519 -0.779 -4.688 1.00 77.27 16 A 1 ATOM 106 N N . ALA A 1 17 ? 6.904 -2.305 -1.216 1.00 91.96 17 A 1 ATOM 107 C CA . ALA A 1 17 ? 8.160 -2.616 -0.538 1.00 90.86 17 A 1 ATOM 108 C C . ALA A 1 17 ? 8.290 -4.114 -0.310 1.00 91.40 17 A 1 ATOM 109 O O . ALA A 1 17 ? 9.362 -4.693 -0.475 1.00 89.65 17 A 1 ATOM 110 C CB . ALA A 1 17 ? 8.233 -1.871 0.785 1.00 88.74 17 A 1 ATOM 111 N N . GLN A 1 18 ? 7.187 -4.749 0.058 1.00 91.46 18 A 1 ATOM 112 C CA . GLN A 1 18 ? 7.176 -6.186 0.303 1.00 90.46 18 A 1 ATOM 113 C C . GLN A 1 18 ? 6.703 -6.926 -0.939 1.00 89.70 18 A 1 ATOM 114 O O . GLN A 1 18 ? 5.567 -7.390 -1.020 1.00 85.74 18 A 1 ATOM 115 C CB . GLN A 1 18 ? 6.277 -6.495 1.490 1.00 87.45 18 A 1 ATOM 116 C CG . GLN A 1 18 ? 6.519 -7.871 2.059 1.00 79.11 18 A 1 ATOM 117 C CD . GLN A 1 18 ? 5.780 -8.087 3.366 1.00 74.31 18 A 1 ATOM 118 O OE1 . GLN A 1 18 ? 4.559 -8.164 3.398 1.00 70.30 18 A 1 ATOM 119 N NE2 . GLN A 1 18 ? 6.505 -8.177 4.462 1.00 67.43 18 A 1 ATOM 120 N N . THR A 1 19 ? 7.580 -7.040 -1.900 1.00 87.08 19 A 1 ATOM 121 C CA . THR A 1 19 ? 7.266 -7.724 -3.151 1.00 84.28 19 A 1 ATOM 122 C C . THR A 1 19 ? 7.580 -9.209 -3.026 1.00 83.20 19 A 1 ATOM 123 O O . THR A 1 19 ? 8.596 -9.694 -3.533 1.00 78.54 19 A 1 ATOM 124 C CB . THR A 1 19 ? 8.053 -7.120 -4.319 1.00 80.56 19 A 1 ATOM 125 O OG1 . THR A 1 19 ? 8.231 -5.724 -4.119 1.00 73.89 19 A 1 ATOM 126 C CG2 . THR A 1 19 ? 7.317 -7.335 -5.629 1.00 71.71 19 A 1 ATOM 127 N N . SER A 1 20 ? 6.710 -9.925 -2.346 1.00 84.79 20 A 1 ATOM 128 C CA . SER A 1 20 ? 6.882 -11.360 -2.152 1.00 81.22 20 A 1 ATOM 129 C C . SER A 1 20 ? 6.358 -12.116 -3.363 1.00 79.59 20 A 1 ATOM 130 O O . SER A 1 20 ? 5.231 -11.897 -3.802 1.00 74.12 20 A 1 ATOM 131 C CB . SER A 1 20 ? 6.159 -11.816 -0.889 1.00 77.53 20 A 1 ATOM 132 O OG . SER A 1 20 ? 6.713 -13.018 -0.389 1.00 67.85 20 A 1 ATOM 133 N N . THR A 1 21 ? 7.172 -12.989 -3.894 1.00 86.14 21 A 1 ATOM 134 C CA . THR A 1 21 ? 6.798 -13.773 -5.069 1.00 84.34 21 A 1 ATOM 135 C C . THR A 1 21 ? 5.781 -14.850 -4.706 1.00 81.21 21 A 1 ATOM 136 O O . THR A 1 21 ? 4.704 -14.885 -5.306 1.00 75.44 21 A 1 ATOM 137 C CB . THR A 1 21 ? 8.034 -14.432 -5.698 1.00 76.69 21 A 1 ATOM 138 O OG1 . THR A 1 21 ? 8.813 -15.060 -4.675 1.00 70.83 21 A 1 ATOM 139 C CG2 . THR A 1 21 ? 8.891 -13.418 -6.415 1.00 72.81 21 A 1 ATOM 140 O OXT . THR A 1 21 ? 6.076 -15.664 -3.839 1.00 73.18 21 A 1 #