# 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_spkb36914 # _entry.id spkb36914 # 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 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" "C3 H7 N O3" 105.093 SER y SERINE C([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" "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 MET 3 1 n VAL 4 1 n ILE 5 1 n VAL 6 1 n LEU 7 1 n VAL 8 1 n VAL 9 1 n TRP 10 1 n LEU 11 1 n ALA 12 1 n LEU 13 1 n SER 14 1 n ALA 15 1 n ALA 16 1 n SER 17 1 n ALA 18 1 n SER 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 @ 2025-07-10 00:26:48)" _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 95.51 _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 91.75 1 1 A LYS 2 2 92.59 1 2 A MET 3 2 94.24 1 3 A VAL 4 2 98.28 1 4 A ILE 5 2 97.52 1 5 A VAL 6 2 98.53 1 6 A LEU 7 2 96.67 1 7 A VAL 8 2 98.48 1 8 A VAL 9 2 98.41 1 9 A TRP 10 2 94.50 1 10 A LEU 11 2 95.94 1 11 A ALA 12 2 98.62 1 12 A LEU 13 2 96.35 1 13 A SER 14 2 96.50 1 14 A ALA 15 2 98.44 1 15 A ALA 16 2 98.21 1 16 A SER 17 2 93.37 1 17 A ALA 18 2 94.65 1 18 A SER 19 2 85.74 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 MET . 3 A 3 A 4 1 n VAL . 4 A 4 A 5 1 n ILE . 5 A 5 A 6 1 n VAL . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n VAL . 8 A 8 A 9 1 n VAL . 9 A 9 A 10 1 n TRP . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n ALA . 12 A 12 A 13 1 n LEU . 13 A 13 A 14 1 n SER . 14 A 14 A 15 1 n ALA . 15 A 15 A 16 1 n ALA . 16 A 16 A 17 1 n SER . 17 A 17 A 18 1 n ALA . 18 A 18 A 19 1 n SER . 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 ? -14.025 -0.489 2.719 1.00 97.01 1 A 1 ATOM 2 C CA . MET A 1 1 ? -12.636 -0.509 3.186 1.00 97.42 1 A 1 ATOM 3 C C . MET A 1 1 ? -11.691 -0.051 2.082 1.00 97.55 1 A 1 ATOM 4 O O . MET A 1 1 ? -11.120 -0.865 1.359 1.00 96.11 1 A 1 ATOM 5 C CB . MET A 1 1 ? -12.237 -1.914 3.624 1.00 95.58 1 A 1 ATOM 6 C CG . MET A 1 1 ? -12.926 -2.347 4.897 1.00 90.31 1 A 1 ATOM 7 S SD . MET A 1 1 ? -12.445 -4.004 5.386 1.00 85.61 1 A 1 ATOM 8 C CE . MET A 1 1 ? -13.257 -4.115 6.964 1.00 74.39 1 A 1 ATOM 9 N N . LYS A 1 2 ? -11.556 1.240 1.962 1.00 98.07 2 A 1 ATOM 10 C CA . LYS A 1 2 ? -10.683 1.813 0.941 1.00 98.25 2 A 1 ATOM 11 C C . LYS A 1 2 ? -9.350 2.243 1.549 1.00 98.34 2 A 1 ATOM 12 O O . LYS A 1 2 ? -8.319 2.236 0.881 1.00 98.02 2 A 1 ATOM 13 C CB . LYS A 1 2 ? -11.376 3.009 0.286 1.00 97.79 2 A 1 ATOM 14 C CG . LYS A 1 2 ? -10.706 3.445 -0.990 1.00 93.75 2 A 1 ATOM 15 C CD . LYS A 1 2 ? -11.369 4.678 -1.559 1.00 89.03 2 A 1 ATOM 16 C CE . LYS A 1 2 ? -10.757 5.053 -2.895 1.00 82.96 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? -11.125 4.084 -3.948 1.00 77.14 2 A 1 ATOM 18 N N . MET A 1 3 ? -9.394 2.605 2.818 1.00 98.49 3 A 1 ATOM 19 C CA . MET A 1 3 ? -8.193 3.044 3.525 1.00 98.61 3 A 1 ATOM 20 C C . MET A 1 3 ? -7.149 1.936 3.603 1.00 98.75 3 A 1 ATOM 21 O O . MET A 1 3 ? -5.948 2.203 3.590 1.00 98.45 3 A 1 ATOM 22 C CB . MET A 1 3 ? -8.555 3.511 4.935 1.00 98.18 3 A 1 ATOM 23 C CG . MET A 1 3 ? -9.133 4.918 4.933 1.00 95.03 3 A 1 ATOM 24 S SD . MET A 1 3 ? -7.869 6.108 4.530 1.00 87.97 3 A 1 ATOM 25 C CE . MET A 1 3 ? -8.831 7.613 4.555 1.00 78.46 3 A 1 ATOM 26 N N . VAL A 1 4 ? -7.616 0.706 3.684 1.00 98.70 4 A 1 ATOM 27 C CA . VAL A 1 4 ? -6.711 -0.442 3.753 1.00 98.78 4 A 1 ATOM 28 C C . VAL A 1 4 ? -5.779 -0.464 2.546 1.00 98.84 4 A 1 ATOM 29 O O . VAL A 1 4 ? -4.566 -0.638 2.679 1.00 98.70 4 A 1 ATOM 30 C CB . VAL A 1 4 ? -7.494 -1.759 3.821 1.00 98.60 4 A 1 ATOM 31 C CG1 . VAL A 1 4 ? -6.540 -2.946 3.826 1.00 97.30 4 A 1 ATOM 32 C CG2 . VAL A 1 4 ? -8.371 -1.779 5.060 1.00 97.01 4 A 1 ATOM 33 N N . ILE A 1 5 ? -6.359 -0.292 1.370 1.00 98.73 5 A 1 ATOM 34 C CA . ILE A 1 5 ? -5.581 -0.297 0.135 1.00 98.73 5 A 1 ATOM 35 C C . ILE A 1 5 ? -4.589 0.858 0.128 1.00 98.78 5 A 1 ATOM 36 O O . ILE A 1 5 ? -3.420 0.699 -0.235 1.00 98.69 5 A 1 ATOM 37 C CB . ILE A 1 5 ? -6.499 -0.198 -1.090 1.00 98.64 5 A 1 ATOM 38 C CG1 . ILE A 1 5 ? -7.542 -1.317 -1.071 1.00 97.27 5 A 1 ATOM 39 C CG2 . ILE A 1 5 ? -5.667 -0.263 -2.369 1.00 96.67 5 A 1 ATOM 40 C CD1 . ILE A 1 5 ? -6.914 -2.702 -1.060 1.00 92.64 5 A 1 ATOM 41 N N . VAL A 1 6 ? -5.057 2.009 0.525 1.00 98.82 6 A 1 ATOM 42 C CA . VAL A 1 6 ? -4.218 3.203 0.560 1.00 98.83 6 A 1 ATOM 43 C C . VAL A 1 6 ? -3.050 3.022 1.524 1.00 98.85 6 A 1 ATOM 44 O O . VAL A 1 6 ? -1.906 3.354 1.201 1.00 98.77 6 A 1 ATOM 45 C CB . VAL A 1 6 ? -5.035 4.436 0.966 1.00 98.70 6 A 1 ATOM 46 C CG1 . VAL A 1 6 ? -4.138 5.665 1.067 1.00 98.01 6 A 1 ATOM 47 C CG2 . VAL A 1 6 ? -6.151 4.672 -0.035 1.00 97.76 6 A 1 ATOM 48 N N . LEU A 1 7 ? -3.340 2.495 2.696 1.00 98.62 7 A 1 ATOM 49 C CA . LEU A 1 7 ? -2.310 2.287 3.710 1.00 98.62 7 A 1 ATOM 50 C C . LEU A 1 7 ? -1.270 1.277 3.245 1.00 98.72 7 A 1 ATOM 51 O O . LEU A 1 7 ? -0.067 1.485 3.413 1.00 98.67 7 A 1 ATOM 52 C CB . LEU A 1 7 ? -2.959 1.799 5.004 1.00 98.52 7 A 1 ATOM 53 C CG . LEU A 1 7 ? -3.776 2.866 5.725 1.00 94.86 7 A 1 ATOM 54 C CD1 . LEU A 1 7 ? -4.559 2.248 6.875 1.00 92.20 7 A 1 ATOM 55 C CD2 . LEU A 1 7 ? -2.871 3.972 6.245 1.00 93.19 7 A 1 ATOM 56 N N . VAL A 1 8 ? -1.732 0.185 2.676 1.00 98.77 8 A 1 ATOM 57 C CA . VAL A 1 8 ? -0.829 -0.859 2.197 1.00 98.78 8 A 1 ATOM 58 C C . VAL A 1 8 ? 0.067 -0.329 1.084 1.00 98.80 8 A 1 ATOM 59 O O . VAL A 1 8 ? 1.290 -0.498 1.115 1.00 98.72 8 A 1 ATOM 60 C CB . VAL A 1 8 ? -1.616 -2.081 1.695 1.00 98.67 8 A 1 ATOM 61 C CG1 . VAL A 1 8 ? -0.678 -3.098 1.055 1.00 97.94 8 A 1 ATOM 62 C CG2 . VAL A 1 8 ? -2.370 -2.721 2.848 1.00 97.70 8 A 1 ATOM 63 N N . VAL A 1 9 ? -0.545 0.297 0.103 1.00 98.73 9 A 1 ATOM 64 C CA . VAL A 1 9 ? 0.202 0.840 -1.029 1.00 98.71 9 A 1 ATOM 65 C C . VAL A 1 9 ? 1.168 1.924 -0.559 1.00 98.75 9 A 1 ATOM 66 O O . VAL A 1 9 ? 2.332 1.959 -0.974 1.00 98.69 9 A 1 ATOM 67 C CB . VAL A 1 9 ? -0.749 1.414 -2.089 1.00 98.58 9 A 1 ATOM 68 C CG1 . VAL A 1 9 ? 0.036 2.111 -3.197 1.00 97.80 9 A 1 ATOM 69 C CG2 . VAL A 1 9 ? -1.609 0.307 -2.676 1.00 97.61 9 A 1 ATOM 70 N N . TRP A 1 10 ? 0.686 2.786 0.307 1.00 98.39 10 A 1 ATOM 71 C CA . TRP A 1 10 ? 1.512 3.867 0.844 1.00 98.34 10 A 1 ATOM 72 C C . TRP A 1 10 ? 2.718 3.313 1.591 1.00 98.46 10 A 1 ATOM 73 O O . TRP A 1 10 ? 3.844 3.779 1.408 1.00 98.35 10 A 1 ATOM 74 C CB . TRP A 1 10 ? 0.688 4.745 1.784 1.00 98.17 10 A 1 ATOM 75 C CG . TRP A 1 10 ? 1.527 5.682 2.592 1.00 96.65 10 A 1 ATOM 76 C CD1 . TRP A 1 10 ? 2.027 6.878 2.177 1.00 92.83 10 A 1 ATOM 77 C CD2 . TRP A 1 10 ? 1.989 5.500 3.938 1.00 94.55 10 A 1 ATOM 78 N NE1 . TRP A 1 10 ? 2.768 7.451 3.183 1.00 90.95 10 A 1 ATOM 79 C CE2 . TRP A 1 10 ? 2.767 6.633 4.283 1.00 94.27 10 A 1 ATOM 80 C CE3 . TRP A 1 10 ? 1.825 4.484 4.888 1.00 91.27 10 A 1 ATOM 81 C CZ2 . TRP A 1 10 ? 3.368 6.765 5.537 1.00 92.95 10 A 1 ATOM 82 C CZ3 . TRP A 1 10 ? 2.425 4.620 6.139 1.00 88.56 10 A 1 ATOM 83 C CH2 . TRP A 1 10 ? 3.189 5.752 6.451 1.00 89.19 10 A 1 ATOM 84 N N . LEU A 1 11 ? 2.489 2.331 2.432 1.00 98.63 11 A 1 ATOM 85 C CA . LEU A 1 11 ? 3.570 1.728 3.203 1.00 98.52 11 A 1 ATOM 86 C C . LEU A 1 11 ? 4.581 1.056 2.287 1.00 98.60 11 A 1 ATOM 87 O O . LEU A 1 11 ? 5.791 1.177 2.484 1.00 98.49 11 A 1 ATOM 88 C CB . LEU A 1 11 ? 3.003 0.703 4.183 1.00 98.30 11 A 1 ATOM 89 C CG . LEU A 1 11 ? 4.050 0.101 5.123 1.00 92.73 11 A 1 ATOM 90 C CD1 . LEU A 1 11 ? 4.683 1.173 5.988 1.00 90.72 11 A 1 ATOM 91 C CD2 . LEU A 1 11 ? 3.413 -0.975 5.993 1.00 91.55 11 A 1 ATOM 92 N N . ALA A 1 12 ? 4.090 0.340 1.293 1.00 98.72 12 A 1 ATOM 93 C CA . ALA A 1 12 ? 4.955 -0.351 0.345 1.00 98.69 12 A 1 ATOM 94 C C . ALA A 1 12 ? 5.831 0.639 -0.414 1.00 98.70 12 A 1 ATOM 95 O O . ALA A 1 12 ? 7.042 0.448 -0.530 1.00 98.45 12 A 1 ATOM 96 C CB . ALA A 1 12 ? 4.115 -1.164 -0.632 1.00 98.55 12 A 1 ATOM 97 N N . LEU A 1 13 ? 5.222 1.688 -0.921 1.00 98.78 13 A 1 ATOM 98 C CA . LEU A 1 13 ? 5.951 2.702 -1.672 1.00 98.66 13 A 1 ATOM 99 C C . LEU A 1 13 ? 6.916 3.455 -0.770 1.00 98.64 13 A 1 ATOM 100 O O . LEU A 1 13 ? 8.047 3.750 -1.167 1.00 98.29 13 A 1 ATOM 101 C CB . LEU A 1 13 ? 4.971 3.680 -2.314 1.00 98.40 13 A 1 ATOM 102 C CG . LEU A 1 13 ? 4.116 3.079 -3.426 1.00 94.39 13 A 1 ATOM 103 C CD1 . LEU A 1 13 ? 3.049 4.065 -3.861 1.00 91.49 13 A 1 ATOM 104 C CD2 . LEU A 1 13 ? 4.983 2.669 -4.604 1.00 92.12 13 A 1 ATOM 105 N N . SER A 1 14 ? 6.486 3.748 0.439 1.00 98.68 14 A 1 ATOM 106 C CA . SER A 1 14 ? 7.312 4.458 1.404 1.00 98.53 14 A 1 ATOM 107 C C . SER A 1 14 ? 8.555 3.651 1.753 1.00 98.53 14 A 1 ATOM 108 O O . SER A 1 14 ? 9.663 4.183 1.802 1.00 97.82 14 A 1 ATOM 109 C CB . SER A 1 14 ? 6.516 4.749 2.674 1.00 97.97 14 A 1 ATOM 110 O OG . SER A 1 14 ? 7.294 5.486 3.580 1.00 87.48 14 A 1 ATOM 111 N N . ALA A 1 15 ? 8.371 2.360 1.986 1.00 98.74 15 A 1 ATOM 112 C CA . ALA A 1 15 ? 9.479 1.475 2.324 1.00 98.62 15 A 1 ATOM 113 C C . ALA A 1 15 ? 10.454 1.348 1.164 1.00 98.59 15 A 1 ATOM 114 O O . ALA A 1 15 ? 11.669 1.346 1.356 1.00 98.00 15 A 1 ATOM 115 C CB . ALA A 1 15 ? 8.954 0.100 2.709 1.00 98.27 15 A 1 ATOM 116 N N . ALA A 1 16 ? 9.917 1.226 -0.039 1.00 98.68 16 A 1 ATOM 117 C CA . ALA A 1 16 ? 10.748 1.100 -1.228 1.00 98.50 16 A 1 ATOM 118 C C . ALA A 1 16 ? 11.442 2.412 -1.567 1.00 98.40 16 A 1 ATOM 119 O O . ALA A 1 16 ? 12.602 2.421 -1.983 1.00 97.42 16 A 1 ATOM 120 C CB . ALA A 1 16 ? 9.907 0.634 -2.408 1.00 98.03 16 A 1 ATOM 121 N N . SER A 1 17 ? 10.735 3.507 -1.391 1.00 97.94 17 A 1 ATOM 122 C CA . SER A 1 17 ? 11.265 4.830 -1.693 1.00 97.21 17 A 1 ATOM 123 C C . SER A 1 17 ? 12.310 5.259 -0.672 1.00 95.87 17 A 1 ATOM 124 O O . SER A 1 17 ? 13.494 5.372 -0.983 1.00 91.11 17 A 1 ATOM 125 C CB . SER A 1 17 ? 10.139 5.858 -1.745 1.00 95.81 17 A 1 ATOM 126 O OG . SER A 1 17 ? 10.651 7.133 -2.072 1.00 82.27 17 A 1 ATOM 127 N N . ALA A 1 18 ? 11.859 5.504 0.557 1.00 97.38 18 A 1 ATOM 128 C CA . ALA A 1 18 ? 12.752 5.944 1.625 1.00 96.26 18 A 1 ATOM 129 C C . ALA A 1 18 ? 12.798 4.925 2.756 1.00 95.10 18 A 1 ATOM 130 O O . ALA A 1 18 ? 11.835 4.775 3.507 1.00 89.76 18 A 1 ATOM 131 C CB . ALA A 1 18 ? 12.294 7.289 2.165 1.00 94.74 18 A 1 ATOM 132 N N . SER A 1 19 ? 13.926 4.245 2.874 1.00 94.25 19 A 1 ATOM 133 C CA . SER A 1 19 ? 14.103 3.239 3.917 1.00 91.94 19 A 1 ATOM 134 C C . SER A 1 19 ? 15.373 3.523 4.711 1.00 87.66 19 A 1 ATOM 135 O O . SER A 1 19 ? 16.467 3.213 4.228 1.00 79.82 19 A 1 ATOM 136 C CB . SER A 1 19 ? 14.169 1.844 3.313 1.00 88.18 19 A 1 ATOM 137 O OG . SER A 1 19 ? 12.972 1.530 2.642 1.00 79.78 19 A 1 ATOM 138 O OXT . SER A 1 19 ? 15.276 4.064 5.831 1.00 78.56 19 A 1 #