# 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_spkb26833 # _entry.id spkb26833 # 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" "C6 H15 N4 O2" 175.209 ARG y ARGININE C(C[C@@H](C(=O)O)N)CNC(=[NH2+])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 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" "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 ARG 3 1 n VAL 4 1 n SER 5 1 n LEU 6 1 n LEU 7 1 n GLY 8 1 n SER 9 1 n ALA 10 1 n ALA 11 1 n ILE 12 1 n PHE 13 1 n ALA 14 1 n LEU 15 1 n VAL 16 1 n PHE 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 @ 2025-07-03 01:21:49)" _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 90.05 _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 76.99 1 1 A LYS 2 2 79.23 1 2 A ARG 3 2 79.80 1 3 A VAL 4 2 87.30 1 4 A SER 5 2 91.50 1 5 A LEU 6 2 90.73 1 6 A LEU 7 2 92.12 1 7 A GLY 8 2 95.38 1 8 A SER 9 2 94.20 1 9 A ALA 10 2 96.38 1 10 A ALA 11 2 96.20 1 11 A ILE 12 2 93.89 1 12 A PHE 13 2 93.68 1 13 A ALA 14 2 96.65 1 14 A LEU 15 2 93.51 1 15 A VAL 16 2 95.49 1 16 A PHE 17 2 91.33 1 17 A SER 18 2 94.05 1 18 A ALA 19 2 87.99 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 ARG . 3 A 3 A 4 1 n VAL . 4 A 4 A 5 1 n SER . 5 A 5 A 6 1 n LEU . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n GLY . 8 A 8 A 9 1 n SER . 9 A 9 A 10 1 n ALA . 10 A 10 A 11 1 n ALA . 11 A 11 A 12 1 n ILE . 12 A 12 A 13 1 n PHE . 13 A 13 A 14 1 n ALA . 14 A 14 A 15 1 n LEU . 15 A 15 A 16 1 n VAL . 16 A 16 A 17 1 n PHE . 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 ? -14.114 7.040 6.200 1.00 81.22 1 A 1 ATOM 2 C CA . MET A 1 1 ? -12.861 6.491 5.639 1.00 84.74 1 A 1 ATOM 3 C C . MET A 1 1 ? -11.926 7.609 5.202 1.00 85.75 1 A 1 ATOM 4 O O . MET A 1 1 ? -12.207 8.310 4.237 1.00 79.64 1 A 1 ATOM 5 C CB . MET A 1 1 ? -13.176 5.631 4.426 1.00 77.32 1 A 1 ATOM 6 C CG . MET A 1 1 ? -14.030 4.434 4.787 1.00 76.24 1 A 1 ATOM 7 S SD . MET A 1 1 ? -14.359 3.403 3.353 1.00 70.72 1 A 1 ATOM 8 C CE . MET A 1 1 ? -15.808 2.535 3.920 1.00 60.31 1 A 1 ATOM 9 N N . LYS A 1 2 ? -10.848 7.767 5.897 1.00 86.92 2 A 1 ATOM 10 C CA . LYS A 1 2 ? -9.876 8.810 5.558 1.00 87.68 2 A 1 ATOM 11 C C . LYS A 1 2 ? -8.479 8.225 5.372 1.00 88.54 2 A 1 ATOM 12 O O . LYS A 1 2 ? -7.686 8.734 4.594 1.00 85.45 2 A 1 ATOM 13 C CB . LYS A 1 2 ? -9.854 9.848 6.678 1.00 84.00 2 A 1 ATOM 14 C CG . LYS A 1 2 ? -11.151 10.629 6.773 1.00 77.11 2 A 1 ATOM 15 C CD . LYS A 1 2 ? -11.077 11.650 7.887 1.00 75.47 2 A 1 ATOM 16 C CE . LYS A 1 2 ? -12.426 12.271 8.147 1.00 66.99 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? -12.605 12.538 9.589 1.00 60.87 2 A 1 ATOM 18 N N . ARG A 1 3 ? -8.184 7.172 6.095 1.00 87.44 3 A 1 ATOM 19 C CA . ARG A 1 3 ? -6.856 6.560 6.023 1.00 90.84 3 A 1 ATOM 20 C C . ARG A 1 3 ? -6.931 5.075 5.672 1.00 92.78 3 A 1 ATOM 21 O O . ARG A 1 3 ? -5.945 4.357 5.788 1.00 89.27 3 A 1 ATOM 22 C CB . ARG A 1 3 ? -6.163 6.739 7.374 1.00 87.52 3 A 1 ATOM 23 C CG . ARG A 1 3 ? -5.981 8.204 7.723 1.00 81.60 3 A 1 ATOM 24 C CD . ARG A 1 3 ? -4.594 8.664 7.364 1.00 79.74 3 A 1 ATOM 25 N NE . ARG A 1 3 ? -4.382 10.082 7.627 1.00 72.01 3 A 1 ATOM 26 C CZ . ARG A 1 3 ? -4.269 10.582 8.846 1.00 69.51 3 A 1 ATOM 27 N NH1 . ARG A 1 3 ? -4.422 9.828 9.918 1.00 64.51 3 A 1 ATOM 28 N NH2 . ARG A 1 3 ? -4.015 11.866 8.993 1.00 62.55 3 A 1 ATOM 29 N N . VAL A 1 4 ? -8.091 4.629 5.243 1.00 87.45 4 A 1 ATOM 30 C CA . VAL A 1 4 ? -8.273 3.222 4.887 1.00 89.00 4 A 1 ATOM 31 C C . VAL A 1 4 ? -7.432 2.867 3.666 1.00 91.60 4 A 1 ATOM 32 O O . VAL A 1 4 ? -6.799 1.815 3.613 1.00 88.89 4 A 1 ATOM 33 C CB . VAL A 1 4 ? -9.747 2.923 4.602 1.00 87.19 4 A 1 ATOM 34 C CG1 . VAL A 1 4 ? -9.922 1.469 4.206 1.00 82.55 4 A 1 ATOM 35 C CG2 . VAL A 1 4 ? -10.588 3.239 5.822 1.00 84.45 4 A 1 ATOM 36 N N . SER A 1 5 ? -7.434 3.741 2.694 1.00 93.01 5 A 1 ATOM 37 C CA . SER A 1 5 ? -6.667 3.520 1.470 1.00 93.88 5 A 1 ATOM 38 C C . SER A 1 5 ? -5.175 3.659 1.736 1.00 95.04 5 A 1 ATOM 39 O O . SER A 1 5 ? -4.356 2.970 1.137 1.00 94.31 5 A 1 ATOM 40 C CB . SER A 1 5 ? -7.092 4.520 0.402 1.00 92.42 5 A 1 ATOM 41 O OG . SER A 1 5 ? -8.382 4.212 -0.070 1.00 80.31 5 A 1 ATOM 42 N N . LEU A 1 6 ? -4.836 4.539 2.634 1.00 92.17 6 A 1 ATOM 43 C CA . LEU A 1 6 ? -3.436 4.769 2.984 1.00 93.86 6 A 1 ATOM 44 C C . LEU A 1 6 ? -2.838 3.538 3.656 1.00 95.40 6 A 1 ATOM 45 O O . LEU A 1 6 ? -1.678 3.205 3.432 1.00 94.36 6 A 1 ATOM 46 C CB . LEU A 1 6 ? -3.335 5.970 3.921 1.00 93.29 6 A 1 ATOM 47 C CG . LEU A 1 6 ? -1.998 6.677 3.798 1.00 88.72 6 A 1 ATOM 48 C CD1 . LEU A 1 6 ? -2.046 7.684 2.657 1.00 84.68 6 A 1 ATOM 49 C CD2 . LEU A 1 6 ? -1.650 7.373 5.103 1.00 83.34 6 A 1 ATOM 50 N N . LEU A 1 7 ? -3.634 2.876 4.463 1.00 95.06 7 A 1 ATOM 51 C CA . LEU A 1 7 ? -3.174 1.676 5.163 1.00 95.11 7 A 1 ATOM 52 C C . LEU A 1 7 ? -2.914 0.544 4.184 1.00 95.77 7 A 1 ATOM 53 O O . LEU A 1 7 ? -1.935 -0.190 4.310 1.00 94.49 7 A 1 ATOM 54 C CB . LEU A 1 7 ? -4.228 1.264 6.189 1.00 94.68 7 A 1 ATOM 55 C CG . LEU A 1 7 ? -3.818 1.607 7.614 1.00 90.69 7 A 1 ATOM 56 C CD1 . LEU A 1 7 ? -4.981 2.210 8.382 1.00 86.45 7 A 1 ATOM 57 C CD2 . LEU A 1 7 ? -3.322 0.353 8.314 1.00 84.71 7 A 1 ATOM 58 N N . GLY A 1 8 ? -3.800 0.403 3.218 1.00 94.80 8 A 1 ATOM 59 C CA . GLY A 1 8 ? -3.646 -0.643 2.210 1.00 94.74 8 A 1 ATOM 60 C C . GLY A 1 8 ? -2.536 -0.324 1.230 1.00 95.99 8 A 1 ATOM 61 O O . GLY A 1 8 ? -1.729 -1.184 0.884 1.00 96.01 8 A 1 ATOM 62 N N . SER A 1 9 ? -2.491 0.902 0.782 1.00 95.76 9 A 1 ATOM 63 C CA . SER A 1 9 ? -1.479 1.340 -0.179 1.00 96.05 9 A 1 ATOM 64 C C . SER A 1 9 ? -0.091 1.374 0.452 1.00 96.78 9 A 1 ATOM 65 O O . SER A 1 9 ? 0.918 1.261 -0.239 1.00 96.07 9 A 1 ATOM 66 C CB . SER A 1 9 ? -1.836 2.724 -0.707 1.00 94.75 9 A 1 ATOM 67 O OG . SER A 1 9 ? -1.047 3.021 -1.826 1.00 85.77 9 A 1 ATOM 68 N N . ALA A 1 10 ? -0.046 1.522 1.751 1.00 96.05 10 A 1 ATOM 69 C CA . ALA A 1 10 ? 1.229 1.583 2.469 1.00 96.52 10 A 1 ATOM 70 C C . ALA A 1 10 ? 2.048 0.320 2.230 1.00 97.20 10 A 1 ATOM 71 O O . ALA A 1 10 ? 3.270 0.370 2.127 1.00 96.36 10 A 1 ATOM 72 C CB . ALA A 1 10 ? 0.963 1.756 3.958 1.00 95.79 10 A 1 ATOM 73 N N . ALA A 1 11 ? 1.371 -0.816 2.134 1.00 96.02 11 A 1 ATOM 74 C CA . ALA A 1 11 ? 2.049 -2.091 1.902 1.00 96.33 11 A 1 ATOM 75 C C . ALA A 1 11 ? 2.786 -2.082 0.568 1.00 97.04 11 A 1 ATOM 76 O O . ALA A 1 11 ? 3.905 -2.580 0.460 1.00 96.00 11 A 1 ATOM 77 C CB . ALA A 1 11 ? 1.026 -3.218 1.930 1.00 95.60 11 A 1 ATOM 78 N N . ILE A 1 12 ? 2.147 -1.537 -0.437 1.00 95.62 12 A 1 ATOM 79 C CA . ILE A 1 12 ? 2.742 -1.455 -1.770 1.00 95.62 12 A 1 ATOM 80 C C . ILE A 1 12 ? 3.964 -0.548 -1.747 1.00 96.12 12 A 1 ATOM 81 O O . ILE A 1 12 ? 4.996 -0.847 -2.351 1.00 95.28 12 A 1 ATOM 82 C CB . ILE A 1 12 ? 1.715 -0.931 -2.780 1.00 95.28 12 A 1 ATOM 83 C CG1 . ILE A 1 12 ? 0.503 -1.866 -2.841 1.00 93.34 12 A 1 ATOM 84 C CG2 . ILE A 1 12 ? 2.353 -0.797 -4.165 1.00 92.26 12 A 1 ATOM 85 C CD1 . ILE A 1 12 ? 0.872 -3.264 -3.305 1.00 87.63 12 A 1 ATOM 86 N N . PHE A 1 13 ? 3.823 0.545 -1.054 1.00 96.26 13 A 1 ATOM 87 C CA . PHE A 1 13 ? 4.915 1.510 -0.960 1.00 95.98 13 A 1 ATOM 88 C C . PHE A 1 13 ? 6.109 0.895 -0.237 1.00 96.59 13 A 1 ATOM 89 O O . PHE A 1 13 ? 7.260 1.138 -0.588 1.00 96.26 13 A 1 ATOM 90 C CB . PHE A 1 13 ? 4.430 2.747 -0.210 1.00 95.47 13 A 1 ATOM 91 C CG . PHE A 1 13 ? 4.862 4.018 -0.887 1.00 94.03 13 A 1 ATOM 92 C CD1 . PHE A 1 13 ? 6.194 4.390 -0.905 1.00 91.36 13 A 1 ATOM 93 C CD2 . PHE A 1 13 ? 3.927 4.833 -1.511 1.00 92.04 13 A 1 ATOM 94 C CE1 . PHE A 1 13 ? 6.596 5.557 -1.535 1.00 90.75 13 A 1 ATOM 95 C CE2 . PHE A 1 13 ? 4.322 6.005 -2.141 1.00 90.60 13 A 1 ATOM 96 C CZ . PHE A 1 13 ? 5.659 6.367 -2.155 1.00 91.18 13 A 1 ATOM 97 N N . ALA A 1 14 ? 5.826 0.103 0.757 1.00 96.85 14 A 1 ATOM 98 C CA . ALA A 1 14 ? 6.883 -0.555 1.527 1.00 96.79 14 A 1 ATOM 99 C C . ALA A 1 14 ? 7.649 -1.546 0.658 1.00 97.26 14 A 1 ATOM 100 O O . ALA A 1 14 ? 8.872 -1.635 0.729 1.00 96.10 14 A 1 ATOM 101 C CB . ALA A 1 14 ? 6.266 -1.271 2.720 1.00 96.23 14 A 1 ATOM 102 N N . LEU A 1 15 ? 6.923 -2.296 -0.158 1.00 96.45 15 A 1 ATOM 103 C CA . LEU A 1 15 ? 7.540 -3.275 -1.049 1.00 96.27 15 A 1 ATOM 104 C C . LEU A 1 15 ? 8.382 -2.583 -2.113 1.00 96.73 15 A 1 ATOM 105 O O . LEU A 1 15 ? 9.497 -3.006 -2.416 1.00 95.81 15 A 1 ATOM 106 C CB . LEU A 1 15 ? 6.445 -4.111 -1.712 1.00 95.92 15 A 1 ATOM 107 C CG . LEU A 1 15 ? 6.990 -5.324 -2.454 1.00 91.20 15 A 1 ATOM 108 C CD1 . LEU A 1 15 ? 7.316 -6.433 -1.455 1.00 87.48 15 A 1 ATOM 109 C CD2 . LEU A 1 15 ? 5.981 -5.827 -3.472 1.00 88.24 15 A 1 ATOM 110 N N . VAL A 1 16 ? 7.837 -1.539 -2.682 1.00 97.07 16 A 1 ATOM 111 C CA . VAL A 1 16 ? 8.540 -0.778 -3.716 1.00 96.92 16 A 1 ATOM 112 C C . VAL A 1 16 ? 9.776 -0.096 -3.137 1.00 96.94 16 A 1 ATOM 113 O O . VAL A 1 16 ? 10.820 -0.010 -3.788 1.00 95.98 16 A 1 ATOM 114 C CB . VAL A 1 16 ? 7.596 0.270 -4.328 1.00 96.16 16 A 1 ATOM 115 C CG1 . VAL A 1 16 ? 8.340 1.138 -5.327 1.00 92.70 16 A 1 ATOM 116 C CG2 . VAL A 1 16 ? 6.424 -0.420 -5.014 1.00 92.63 16 A 1 ATOM 117 N N . PHE A 1 17 ? 9.641 0.370 -1.928 1.00 94.48 17 A 1 ATOM 118 C CA . PHE A 1 17 ? 10.750 1.055 -1.259 1.00 94.67 17 A 1 ATOM 119 C C . PHE A 1 17 ? 11.836 0.069 -0.846 1.00 95.56 17 A 1 ATOM 120 O O . PHE A 1 17 ? 13.012 0.416 -0.773 1.00 94.26 17 A 1 ATOM 121 C CB . PHE A 1 17 ? 10.214 1.780 -0.028 1.00 93.78 17 A 1 ATOM 122 C CG . PHE A 1 17 ? 11.076 2.949 0.351 1.00 91.83 17 A 1 ATOM 123 C CD1 . PHE A 1 17 ? 11.072 4.101 -0.418 1.00 87.87 17 A 1 ATOM 124 C CD2 . PHE A 1 17 ? 11.888 2.887 1.469 1.00 88.90 17 A 1 ATOM 125 C CE1 . PHE A 1 17 ? 11.868 5.183 -0.072 1.00 87.77 17 A 1 ATOM 126 C CE2 . PHE A 1 17 ? 12.692 3.968 1.825 1.00 87.68 17 A 1 ATOM 127 C CZ . PHE A 1 17 ? 12.678 5.117 1.050 1.00 87.81 17 A 1 ATOM 128 N N . SER A 1 18 ? 11.438 -1.154 -0.585 1.00 96.36 18 A 1 ATOM 129 C CA . SER A 1 18 ? 12.379 -2.197 -0.171 1.00 96.23 18 A 1 ATOM 130 C C . SER A 1 18 ? 13.163 -2.742 -1.359 1.00 96.33 18 A 1 ATOM 131 O O . SER A 1 18 ? 14.175 -3.421 -1.185 1.00 94.15 18 A 1 ATOM 132 C CB . SER A 1 18 ? 11.620 -3.334 0.506 1.00 94.73 18 A 1 ATOM 133 O OG . SER A 1 18 ? 12.519 -4.292 1.008 1.00 86.50 18 A 1 ATOM 134 N N . ALA A 1 19 ? 12.704 -2.449 -2.555 1.00 93.99 19 A 1 ATOM 135 C CA . ALA A 1 19 ? 13.342 -2.920 -3.786 1.00 91.80 19 A 1 ATOM 136 C C . ALA A 1 19 ? 14.853 -2.706 -3.715 1.00 89.22 19 A 1 ATOM 137 O O . ALA A 1 19 ? 15.601 -3.608 -4.126 1.00 86.16 19 A 1 ATOM 138 C CB . ALA A 1 19 ? 12.754 -2.191 -4.987 1.00 87.98 19 A 1 ATOM 139 O OXT . ALA A 1 19 ? 15.277 -1.658 -3.252 1.00 78.81 19 A 1 #