# 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_spkb38274 # _entry.id spkb38274 # 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" "C9 H11 N O3" 181.189 TYR y TYROSINE c1cc(ccc1C[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 TYR 3 1 n ARG 4 1 n ILE 5 1 n ALA 6 1 n LEU 7 1 n ALA 8 1 n VAL 9 1 n SER 10 1 n LEU 11 1 n PHE 12 1 n ALA 13 1 n LEU 14 1 n SER 15 1 n ALA 16 1 n GLY 17 1 n SER 18 1 n TYR 19 1 n ALA 20 # _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 17:11:10)" _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 93.55 _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 90.09 1 1 A LYS 2 2 90.36 1 2 A TYR 3 2 91.87 1 3 A ARG 4 2 87.55 1 4 A ILE 5 2 95.80 1 5 A ALA 6 2 97.81 1 6 A LEU 7 2 94.63 1 7 A ALA 8 2 97.88 1 8 A VAL 9 2 97.29 1 9 A SER 10 2 96.51 1 10 A LEU 11 2 95.49 1 11 A PHE 12 2 95.52 1 12 A ALA 13 2 98.05 1 13 A LEU 14 2 95.68 1 14 A SER 15 2 96.15 1 15 A ALA 16 2 97.65 1 16 A GLY 17 2 96.76 1 17 A SER 18 2 94.50 1 18 A TYR 19 2 89.03 1 19 A ALA 20 2 85.56 1 20 # _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 TYR . 3 A 3 A 4 1 n ARG . 4 A 4 A 5 1 n ILE . 5 A 5 A 6 1 n ALA . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n ALA . 8 A 8 A 9 1 n VAL . 9 A 9 A 10 1 n SER . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n PHE . 12 A 12 A 13 1 n ALA . 13 A 13 A 14 1 n LEU . 14 A 14 A 15 1 n SER . 15 A 15 A 16 1 n ALA . 16 A 16 A 17 1 n GLY . 17 A 17 A 18 1 n SER . 18 A 18 A 19 1 n TYR . 19 A 19 A 20 1 n ALA . 20 A 20 # _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 ? -5.333 8.272 11.277 1.00 94.59 1 A 1 ATOM 2 C CA . MET A 1 1 ? -4.928 7.081 10.499 1.00 95.85 1 A 1 ATOM 3 C C . MET A 1 1 ? -3.874 6.272 11.247 1.00 96.47 1 A 1 ATOM 4 O O . MET A 1 1 ? -2.730 6.702 11.354 1.00 94.79 1 A 1 ATOM 5 C CB . MET A 1 1 ? -4.355 7.511 9.152 1.00 92.51 1 A 1 ATOM 6 C CG . MET A 1 1 ? -5.403 8.183 8.283 1.00 88.26 1 A 1 ATOM 7 S SD . MET A 1 1 ? -4.724 8.744 6.712 1.00 84.63 1 A 1 ATOM 8 C CE . MET A 1 1 ? -4.284 10.417 7.119 1.00 73.62 1 A 1 ATOM 9 N N . LYS A 1 2 ? -4.274 5.124 11.764 1.00 96.02 2 A 1 ATOM 10 C CA . LYS A 1 2 ? -3.354 4.267 12.524 1.00 96.32 2 A 1 ATOM 11 C C . LYS A 1 2 ? -2.815 3.112 11.678 1.00 96.76 2 A 1 ATOM 12 O O . LYS A 1 2 ? -1.637 2.783 11.749 1.00 96.00 2 A 1 ATOM 13 C CB . LYS A 1 2 ? -4.077 3.706 13.747 1.00 94.89 2 A 1 ATOM 14 C CG . LYS A 1 2 ? -4.408 4.775 14.778 1.00 89.50 2 A 1 ATOM 15 C CD . LYS A 1 2 ? -5.075 4.160 15.993 1.00 87.44 2 A 1 ATOM 16 C CE . LYS A 1 2 ? -5.529 5.227 16.967 1.00 81.30 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? -4.372 5.860 17.661 1.00 75.01 2 A 1 ATOM 18 N N . TYR A 1 3 ? -3.672 2.491 10.871 1.00 96.15 3 A 1 ATOM 19 C CA . TYR A 1 3 ? -3.277 1.344 10.044 1.00 96.52 3 A 1 ATOM 20 C C . TYR A 1 3 ? -3.059 1.751 8.581 1.00 97.04 3 A 1 ATOM 21 O O . TYR A 1 3 ? -3.504 1.078 7.655 1.00 96.19 3 A 1 ATOM 22 C CB . TYR A 1 3 ? -4.357 0.265 10.130 1.00 95.53 3 A 1 ATOM 23 C CG . TYR A 1 3 ? -4.597 -0.202 11.546 1.00 92.72 3 A 1 ATOM 24 C CD1 . TYR A 1 3 ? -3.665 -1.004 12.193 1.00 90.12 3 A 1 ATOM 25 C CD2 . TYR A 1 3 ? -5.752 0.165 12.225 1.00 89.25 3 A 1 ATOM 26 C CE1 . TYR A 1 3 ? -3.882 -1.436 13.494 1.00 87.64 3 A 1 ATOM 27 C CE2 . TYR A 1 3 ? -5.978 -0.261 13.529 1.00 87.63 3 A 1 ATOM 28 C CZ . TYR A 1 3 ? -5.038 -1.064 14.156 1.00 87.70 3 A 1 ATOM 29 O OH . TYR A 1 3 ? -5.260 -1.487 15.442 1.00 85.92 3 A 1 ATOM 30 N N . ARG A 1 4 ? -2.380 2.846 8.372 1.00 97.22 4 A 1 ATOM 31 C CA . ARG A 1 4 ? -2.117 3.347 7.018 1.00 97.44 4 A 1 ATOM 32 C C . ARG A 1 4 ? -0.977 2.582 6.352 1.00 97.88 4 A 1 ATOM 33 O O . ARG A 1 4 ? -0.852 2.581 5.130 1.00 97.14 4 A 1 ATOM 34 C CB . ARG A 1 4 ? -1.769 4.840 7.119 1.00 96.60 4 A 1 ATOM 35 C CG . ARG A 1 4 ? -1.928 5.541 5.791 1.00 91.99 4 A 1 ATOM 36 C CD . ARG A 1 4 ? -3.396 5.761 5.460 1.00 86.91 4 A 1 ATOM 37 N NE . ARG A 1 4 ? -3.642 5.326 4.095 1.00 80.24 4 A 1 ATOM 38 C CZ . ARG A 1 4 ? -4.809 5.409 3.480 1.00 76.99 4 A 1 ATOM 39 N NH1 . ARG A 1 4 ? -5.862 5.934 4.066 1.00 71.03 4 A 1 ATOM 40 N NH2 . ARG A 1 4 ? -4.905 4.941 2.261 1.00 69.65 4 A 1 ATOM 41 N N . ILE A 1 5 ? -0.152 1.932 7.148 1.00 97.61 5 A 1 ATOM 42 C CA . ILE A 1 5 ? 0.999 1.177 6.639 1.00 97.39 5 A 1 ATOM 43 C C . ILE A 1 5 ? 0.549 -0.030 5.817 1.00 97.46 5 A 1 ATOM 44 O O . ILE A 1 5 ? 1.114 -0.319 4.761 1.00 97.24 5 A 1 ATOM 45 C CB . ILE A 1 5 ? 1.883 0.709 7.806 1.00 97.17 5 A 1 ATOM 46 C CG1 . ILE A 1 5 ? 2.296 1.892 8.681 1.00 94.87 5 A 1 ATOM 47 C CG2 . ILE A 1 5 ? 3.129 0.006 7.258 1.00 94.34 5 A 1 ATOM 48 C CD1 . ILE A 1 5 ? 2.709 1.457 10.077 1.00 90.32 5 A 1 ATOM 49 N N . ALA A 1 6 ? -0.459 -0.742 6.292 1.00 98.08 6 A 1 ATOM 50 C CA . ALA A 1 6 ? -0.958 -1.933 5.598 1.00 97.90 6 A 1 ATOM 51 C C . ALA A 1 6 ? -1.464 -1.591 4.196 1.00 97.93 6 A 1 ATOM 52 O O . ALA A 1 6 ? -1.172 -2.292 3.230 1.00 97.52 6 A 1 ATOM 53 C CB . ALA A 1 6 ? -2.077 -2.562 6.423 1.00 97.60 6 A 1 ATOM 54 N N . LEU A 1 7 ? -2.208 -0.511 4.073 1.00 97.66 7 A 1 ATOM 55 C CA . LEU A 1 7 ? -2.744 -0.078 2.780 1.00 97.41 7 A 1 ATOM 56 C C . LEU A 1 7 ? -1.622 0.333 1.831 1.00 97.73 7 A 1 ATOM 57 O O . LEU A 1 7 ? -1.637 -0.008 0.653 1.00 97.66 7 A 1 ATOM 58 C CB . LEU A 1 7 ? -3.711 1.087 2.984 1.00 97.01 7 A 1 ATOM 59 C CG . LEU A 1 7 ? -5.160 0.639 3.142 1.00 91.08 7 A 1 ATOM 60 C CD1 . LEU A 1 7 ? -5.381 0.019 4.511 1.00 88.88 7 A 1 ATOM 61 C CD2 . LEU A 1 7 ? -6.099 1.821 2.940 1.00 89.63 7 A 1 ATOM 62 N N . ALA A 1 8 ? -0.665 1.049 2.336 1.00 97.74 8 A 1 ATOM 63 C CA . ALA A 1 8 ? 0.463 1.512 1.522 1.00 97.93 8 A 1 ATOM 64 C C . ALA A 1 8 ? 1.300 0.339 1.018 1.00 98.10 8 A 1 ATOM 65 O O . ALA A 1 8 ? 1.678 0.292 -0.151 1.00 97.86 8 A 1 ATOM 66 C CB . ALA A 1 8 ? 1.323 2.456 2.352 1.00 97.78 8 A 1 ATOM 67 N N . VAL A 1 9 ? 1.586 -0.611 1.882 1.00 98.03 9 A 1 ATOM 68 C CA . VAL A 1 9 ? 2.391 -1.786 1.520 1.00 97.85 9 A 1 ATOM 69 C C . VAL A 1 9 ? 1.647 -2.661 0.514 1.00 97.84 9 A 1 ATOM 70 O O . VAL A 1 9 ? 2.243 -3.172 -0.436 1.00 97.65 9 A 1 ATOM 71 C CB . VAL A 1 9 ? 2.731 -2.604 2.781 1.00 97.54 9 A 1 ATOM 72 C CG1 . VAL A 1 9 ? 3.431 -3.905 2.412 1.00 96.16 9 A 1 ATOM 73 C CG2 . VAL A 1 9 ? 3.621 -1.787 3.708 1.00 95.99 9 A 1 ATOM 74 N N . SER A 1 10 ? 0.362 -2.831 0.703 1.00 98.05 10 A 1 ATOM 75 C CA . SER A 1 10 ? -0.460 -3.653 -0.189 1.00 97.85 10 A 1 ATOM 76 C C . SER A 1 10 ? -0.465 -3.081 -1.607 1.00 98.09 10 A 1 ATOM 77 O O . SER A 1 10 ? -0.287 -3.808 -2.582 1.00 97.86 10 A 1 ATOM 78 C CB . SER A 1 10 ? -1.889 -3.724 0.349 1.00 97.43 10 A 1 ATOM 79 O OG . SER A 1 10 ? -2.624 -4.682 -0.370 1.00 89.80 10 A 1 ATOM 80 N N . LEU A 1 11 ? -0.657 -1.794 -1.729 1.00 97.28 11 A 1 ATOM 81 C CA . LEU A 1 11 ? -0.668 -1.131 -3.038 1.00 97.32 11 A 1 ATOM 82 C C . LEU A 1 11 ? 0.716 -1.158 -3.678 1.00 97.75 11 A 1 ATOM 83 O O . LEU A 1 11 ? 0.847 -1.351 -4.885 1.00 97.80 11 A 1 ATOM 84 C CB . LEU A 1 11 ? -1.134 0.315 -2.859 1.00 97.18 11 A 1 ATOM 85 C CG . LEU A 1 11 ? -2.652 0.435 -2.738 1.00 94.19 11 A 1 ATOM 86 C CD1 . LEU A 1 11 ? -3.033 1.744 -2.074 1.00 90.76 11 A 1 ATOM 87 C CD2 . LEU A 1 11 ? -3.283 0.355 -4.127 1.00 91.61 11 A 1 ATOM 88 N N . PHE A 1 12 ? 1.732 -0.970 -2.884 1.00 97.80 12 A 1 ATOM 89 C CA . PHE A 1 12 ? 3.109 -0.983 -3.378 1.00 97.74 12 A 1 ATOM 90 C C . PHE A 1 12 ? 3.466 -2.347 -3.956 1.00 98.13 12 A 1 ATOM 91 O O . PHE A 1 12 ? 4.050 -2.440 -5.035 1.00 97.93 12 A 1 ATOM 92 C CB . PHE A 1 12 ? 4.056 -0.636 -2.231 1.00 97.44 12 A 1 ATOM 93 C CG . PHE A 1 12 ? 5.494 -0.617 -2.673 1.00 95.88 12 A 1 ATOM 94 C CD1 . PHE A 1 12 ? 5.993 0.466 -3.384 1.00 93.25 12 A 1 ATOM 95 C CD2 . PHE A 1 12 ? 6.335 -1.682 -2.373 1.00 93.95 12 A 1 ATOM 96 C CE1 . PHE A 1 12 ? 7.317 0.489 -3.798 1.00 92.82 12 A 1 ATOM 97 C CE2 . PHE A 1 12 ? 7.663 -1.668 -2.790 1.00 92.60 12 A 1 ATOM 98 C CZ . PHE A 1 12 ? 8.152 -0.582 -3.504 1.00 93.19 12 A 1 ATOM 99 N N . ALA A 1 13 ? 3.117 -3.409 -3.249 1.00 98.20 13 A 1 ATOM 100 C CA . ALA A 1 13 ? 3.415 -4.772 -3.699 1.00 98.15 13 A 1 ATOM 101 C C . ALA A 1 13 ? 2.662 -5.109 -4.986 1.00 98.30 13 A 1 ATOM 102 O O . ALA A 1 13 ? 3.209 -5.745 -5.884 1.00 97.83 13 A 1 ATOM 103 C CB . ALA A 1 13 ? 3.045 -5.759 -2.597 1.00 97.79 13 A 1 ATOM 104 N N . LEU A 1 14 ? 1.421 -4.683 -5.088 1.00 98.12 14 A 1 ATOM 105 C CA . LEU A 1 14 ? 0.603 -4.943 -6.278 1.00 97.88 14 A 1 ATOM 106 C C . LEU A 1 14 ? 1.165 -4.227 -7.500 1.00 98.19 14 A 1 ATOM 107 O O . LEU A 1 14 ? 1.296 -4.817 -8.572 1.00 97.83 14 A 1 ATOM 108 C CB . LEU A 1 14 ? -0.831 -4.482 -6.006 1.00 97.54 14 A 1 ATOM 109 C CG . LEU A 1 14 ? -1.737 -5.621 -5.541 1.00 94.39 14 A 1 ATOM 110 C CD1 . LEU A 1 14 ? -2.913 -5.075 -4.751 1.00 90.29 14 A 1 ATOM 111 C CD2 . LEU A 1 14 ? -2.231 -6.413 -6.740 1.00 91.22 14 A 1 ATOM 112 N N . SER A 1 15 ? 1.493 -2.977 -7.361 1.00 98.23 15 A 1 ATOM 113 C CA . SER A 1 15 ? 2.039 -2.180 -8.462 1.00 98.04 15 A 1 ATOM 114 C C . SER A 1 15 ? 3.464 -2.599 -8.809 1.00 98.12 15 A 1 ATOM 115 O O . SER A 1 15 ? 3.921 -2.391 -9.931 1.00 97.42 15 A 1 ATOM 116 C CB . SER A 1 15 ? 2.012 -0.701 -8.087 1.00 97.28 15 A 1 ATOM 117 O OG . SER A 1 15 ? 2.393 0.087 -9.185 1.00 87.81 15 A 1 ATOM 118 N N . ALA A 1 16 ? 4.159 -3.195 -7.871 1.00 98.12 16 A 1 ATOM 119 C CA . ALA A 1 16 ? 5.555 -3.595 -8.071 1.00 97.92 16 A 1 ATOM 120 C C . ALA A 1 16 ? 5.688 -4.808 -8.987 1.00 97.99 16 A 1 ATOM 121 O O . ALA A 1 16 ? 6.578 -4.854 -9.830 1.00 97.02 16 A 1 ATOM 122 C CB . ALA A 1 16 ? 6.199 -3.889 -6.721 1.00 97.19 16 A 1 ATOM 123 N N . GLY A 1 17 ? 4.822 -5.804 -8.839 1.00 97.52 17 A 1 ATOM 124 C CA . GLY A 1 17 ? 4.928 -7.020 -9.647 1.00 96.88 17 A 1 ATOM 125 C C . GLY A 1 17 ? 3.638 -7.470 -10.314 1.00 96.99 17 A 1 ATOM 126 O O . GLY A 1 17 ? 3.675 -8.163 -11.320 1.00 95.66 17 A 1 ATOM 127 N N . SER A 1 18 ? 2.499 -7.105 -9.786 1.00 97.10 18 A 1 ATOM 128 C CA . SER A 1 18 ? 1.203 -7.514 -10.342 1.00 96.68 18 A 1 ATOM 129 C C . SER A 1 18 ? 0.716 -6.557 -11.426 1.00 96.79 18 A 1 ATOM 130 O O . SER A 1 18 ? 0.133 -6.969 -12.423 1.00 95.04 18 A 1 ATOM 131 C CB . SER A 1 18 ? 0.165 -7.610 -9.230 1.00 95.29 18 A 1 ATOM 132 O OG . SER A 1 18 ? -0.947 -8.353 -9.669 1.00 86.13 18 A 1 ATOM 133 N N . TYR A 1 19 ? 0.956 -5.280 -11.239 1.00 94.63 19 A 1 ATOM 134 C CA . TYR A 1 19 ? 0.514 -4.259 -12.195 1.00 94.11 19 A 1 ATOM 135 C C . TYR A 1 19 ? 1.558 -4.049 -13.292 1.00 94.39 19 A 1 ATOM 136 O O . TYR A 1 19 ? 2.399 -3.159 -13.199 1.00 91.82 19 A 1 ATOM 137 C CB . TYR A 1 19 ? 0.256 -2.945 -11.450 1.00 92.14 19 A 1 ATOM 138 C CG . TYR A 1 19 ? -1.115 -2.377 -11.761 1.00 88.78 19 A 1 ATOM 139 C CD1 . TYR A 1 19 ? -1.322 -1.602 -12.894 1.00 87.00 19 A 1 ATOM 140 C CD2 . TYR A 1 19 ? -2.182 -2.624 -10.912 1.00 86.61 19 A 1 ATOM 141 C CE1 . TYR A 1 19 ? -2.573 -1.083 -13.177 1.00 84.62 19 A 1 ATOM 142 C CE2 . TYR A 1 19 ? -3.444 -2.109 -11.187 1.00 85.11 19 A 1 ATOM 143 C CZ . TYR A 1 19 ? -3.632 -1.335 -12.319 1.00 85.07 19 A 1 ATOM 144 O OH . TYR A 1 19 ? -4.875 -0.821 -12.594 1.00 84.07 19 A 1 ATOM 145 N N . ALA A 1 20 ? 1.501 -4.884 -14.361 1.00 91.92 20 A 1 ATOM 146 C CA . ALA A 1 20 ? 2.443 -4.760 -15.476 1.00 89.89 20 A 1 ATOM 147 C C . ALA A 1 20 ? 1.817 -5.266 -16.770 1.00 86.75 20 A 1 ATOM 148 O O . ALA A 1 20 ? 1.785 -4.506 -17.755 1.00 81.45 20 A 1 ATOM 149 C CB . ALA A 1 20 ? 3.720 -5.525 -15.168 1.00 85.92 20 A 1 ATOM 150 O OXT . ALA A 1 20 ? 1.371 -6.412 -16.799 1.00 77.41 20 A 1 #