# 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_spkb33825 # _entry.id spkb33825 # 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 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" "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" "C4 H9 N O3" 119.119 THR y THREONINE C[C@H]([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" # _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 TYR 2 1 n ILE 3 1 n GLN 4 1 n THR 5 1 n GLN 6 1 n PHE 7 1 n ALA 8 1 n SER 9 1 n LEU 10 1 n LEU 11 1 n LEU 12 1 n LEU 13 1 n ALA 14 1 n GLY 15 1 n THR 16 1 n SER 17 1 n LEU 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 @ 2025-07-12 15:06:27)" _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 93.60 _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 86.75 1 1 A TYR 2 2 92.02 1 2 A ILE 3 2 93.96 1 3 A GLN 4 2 90.55 1 4 A THR 5 2 95.77 1 5 A GLN 6 2 92.50 1 6 A PHE 7 2 94.48 1 7 A ALA 8 2 97.74 1 8 A SER 9 2 96.47 1 9 A LEU 10 2 96.12 1 10 A LEU 11 2 96.18 1 11 A LEU 12 2 96.24 1 12 A LEU 13 2 95.97 1 13 A ALA 14 2 96.77 1 14 A GLY 15 2 96.59 1 15 A THR 16 2 94.87 1 16 A SER 17 2 92.98 1 17 A LEU 18 2 90.26 1 18 A ALA 19 2 86.61 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 TYR . 2 A 2 A 3 1 n ILE . 3 A 3 A 4 1 n GLN . 4 A 4 A 5 1 n THR . 5 A 5 A 6 1 n GLN . 6 A 6 A 7 1 n PHE . 7 A 7 A 8 1 n ALA . 8 A 8 A 9 1 n SER . 9 A 9 A 10 1 n LEU . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n LEU . 12 A 12 A 13 1 n LEU . 13 A 13 A 14 1 n ALA . 14 A 14 A 15 1 n GLY . 15 A 15 A 16 1 n THR . 16 A 16 A 17 1 n SER . 17 A 17 A 18 1 n LEU . 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 ? -13.437 -4.694 0.652 1.00 89.54 1 A 1 ATOM 2 C CA . MET A 1 1 ? -11.970 -4.628 0.579 1.00 93.11 1 A 1 ATOM 3 C C . MET A 1 1 ? -11.509 -3.293 -0.009 1.00 94.58 1 A 1 ATOM 4 O O . MET A 1 1 ? -11.282 -3.175 -1.212 1.00 92.81 1 A 1 ATOM 5 C CB . MET A 1 1 ? -11.458 -5.773 -0.308 1.00 88.04 1 A 1 ATOM 6 C CG . MET A 1 1 ? -11.283 -7.056 0.481 1.00 82.47 1 A 1 ATOM 7 S SD . MET A 1 1 ? -11.409 -8.494 -0.589 1.00 81.30 1 A 1 ATOM 8 C CE . MET A 1 1 ? -11.066 -9.789 0.597 1.00 72.16 1 A 1 ATOM 9 N N . TYR A 1 2 ? -11.412 -2.297 0.841 1.00 93.78 2 A 1 ATOM 10 C CA . TYR A 1 2 ? -10.985 -0.964 0.409 1.00 96.17 2 A 1 ATOM 11 C C . TYR A 1 2 ? -9.979 -0.361 1.391 1.00 97.41 2 A 1 ATOM 12 O O . TYR A 1 2 ? -9.160 0.466 1.018 1.00 97.09 2 A 1 ATOM 13 C CB . TYR A 1 2 ? -12.221 -0.057 0.307 1.00 94.95 2 A 1 ATOM 14 C CG . TYR A 1 2 ? -12.546 0.283 -1.136 1.00 92.21 2 A 1 ATOM 15 C CD1 . TYR A 1 2 ? -11.763 1.201 -1.830 1.00 91.13 2 A 1 ATOM 16 C CD2 . TYR A 1 2 ? -13.629 -0.307 -1.782 1.00 89.71 2 A 1 ATOM 17 C CE1 . TYR A 1 2 ? -12.058 1.520 -3.156 1.00 88.61 2 A 1 ATOM 18 C CE2 . TYR A 1 2 ? -13.933 0.007 -3.107 1.00 88.23 2 A 1 ATOM 19 C CZ . TYR A 1 2 ? -13.147 0.924 -3.788 1.00 88.56 2 A 1 ATOM 20 O OH . TYR A 1 2 ? -13.442 1.248 -5.095 1.00 86.42 2 A 1 ATOM 21 N N . ILE A 1 3 ? -10.047 -0.785 2.642 1.00 96.28 3 A 1 ATOM 22 C CA . ILE A 1 3 ? -9.140 -0.276 3.670 1.00 96.98 3 A 1 ATOM 23 C C . ILE A 1 3 ? -7.787 -0.984 3.618 1.00 97.62 3 A 1 ATOM 24 O O . ILE A 1 3 ? -6.737 -0.351 3.719 1.00 97.30 3 A 1 ATOM 25 C CB . ILE A 1 3 ? -9.771 -0.442 5.064 1.00 96.24 3 A 1 ATOM 26 C CG1 . ILE A 1 3 ? -11.185 0.130 5.097 1.00 92.22 3 A 1 ATOM 27 C CG2 . ILE A 1 3 ? -8.887 0.253 6.114 1.00 90.85 3 A 1 ATOM 28 C CD1 . ILE A 1 3 ? -12.227 -0.959 5.292 1.00 84.18 3 A 1 ATOM 29 N N . GLN A 1 4 ? -7.812 -2.272 3.478 1.00 97.01 4 A 1 ATOM 30 C CA . GLN A 1 4 ? -6.580 -3.064 3.422 1.00 97.13 4 A 1 ATOM 31 C C . GLN A 1 4 ? -6.057 -3.196 1.995 1.00 97.62 4 A 1 ATOM 32 O O . GLN A 1 4 ? -4.911 -3.592 1.785 1.00 97.26 4 A 1 ATOM 33 C CB . GLN A 1 4 ? -6.839 -4.447 4.035 1.00 96.18 4 A 1 ATOM 34 C CG . GLN A 1 4 ? -7.914 -5.227 3.294 1.00 89.25 4 A 1 ATOM 35 C CD . GLN A 1 4 ? -7.321 -6.306 2.409 1.00 85.36 4 A 1 ATOM 36 O OE1 . GLN A 1 4 ? -6.941 -6.055 1.275 1.00 78.22 4 A 1 ATOM 37 N NE2 . GLN A 1 4 ? -7.222 -7.521 2.909 1.00 76.90 4 A 1 ATOM 38 N N . THR A 1 5 ? -6.888 -2.858 1.029 1.00 97.69 5 A 1 ATOM 39 C CA . THR A 1 5 ? -6.503 -2.947 -0.384 1.00 97.64 5 A 1 ATOM 40 C C . THR A 1 5 ? -5.385 -1.957 -0.703 1.00 97.96 5 A 1 ATOM 41 O O . THR A 1 5 ? -4.337 -2.335 -1.224 1.00 97.60 5 A 1 ATOM 42 C CB . THR A 1 5 ? -7.720 -2.668 -1.277 1.00 96.94 5 A 1 ATOM 43 O OG1 . THR A 1 5 ? -8.744 -3.604 -0.960 1.00 92.17 5 A 1 ATOM 44 C CG2 . THR A 1 5 ? -7.362 -2.833 -2.750 1.00 90.41 5 A 1 ATOM 45 N N . GLN A 1 6 ? -5.606 -0.683 -0.399 1.00 97.35 6 A 1 ATOM 46 C CA . GLN A 1 6 ? -4.604 0.354 -0.638 1.00 97.59 6 A 1 ATOM 47 C C . GLN A 1 6 ? -3.437 0.232 0.337 1.00 97.98 6 A 1 ATOM 48 O O . GLN A 1 6 ? -2.307 0.584 0.008 1.00 97.66 6 A 1 ATOM 49 C CB . GLN A 1 6 ? -5.251 1.736 -0.509 1.00 97.23 6 A 1 ATOM 50 C CG . GLN A 1 6 ? -5.858 1.985 0.854 1.00 92.48 6 A 1 ATOM 51 C CD . GLN A 1 6 ? -7.283 2.498 0.723 1.00 89.05 6 A 1 ATOM 52 O OE1 . GLN A 1 6 ? -7.516 3.696 0.628 1.00 82.87 6 A 1 ATOM 53 N NE2 . GLN A 1 6 ? -8.238 1.593 0.693 1.00 80.27 6 A 1 ATOM 54 N N . PHE A 1 7 ? -3.727 -0.272 1.522 1.00 97.26 7 A 1 ATOM 55 C CA . PHE A 1 7 ? -2.694 -0.456 2.546 1.00 97.25 7 A 1 ATOM 56 C C . PHE A 1 7 ? -1.692 -1.512 2.099 1.00 97.65 7 A 1 ATOM 57 O O . PHE A 1 7 ? -0.486 -1.345 2.260 1.00 97.49 7 A 1 ATOM 58 C CB . PHE A 1 7 ? -3.345 -0.886 3.858 1.00 96.91 7 A 1 ATOM 59 C CG . PHE A 1 7 ? -3.424 0.241 4.858 1.00 94.77 7 A 1 ATOM 60 C CD1 . PHE A 1 7 ? -4.335 1.272 4.681 1.00 92.11 7 A 1 ATOM 61 C CD2 . PHE A 1 7 ? -2.589 0.254 5.968 1.00 92.54 7 A 1 ATOM 62 C CE1 . PHE A 1 7 ? -4.414 2.314 5.595 1.00 91.58 7 A 1 ATOM 63 C CE2 . PHE A 1 7 ? -2.661 1.292 6.890 1.00 90.90 7 A 1 ATOM 64 C CZ . PHE A 1 7 ? -3.574 2.326 6.705 1.00 90.87 7 A 1 ATOM 65 N N . ALA A 1 8 ? -2.211 -2.589 1.531 1.00 97.77 8 A 1 ATOM 66 C CA . ALA A 1 8 ? -1.360 -3.674 1.045 1.00 97.80 8 A 1 ATOM 67 C C . ALA A 1 8 ? -0.511 -3.198 -0.130 1.00 97.98 8 A 1 ATOM 68 O O . ALA A 1 8 ? 0.623 -3.635 -0.307 1.00 97.66 8 A 1 ATOM 69 C CB . ALA A 1 8 ? -2.231 -4.854 0.623 1.00 97.50 8 A 1 ATOM 70 N N . SER A 1 9 ? -1.075 -2.296 -0.924 1.00 97.71 9 A 1 ATOM 71 C CA . SER A 1 9 ? -0.377 -1.738 -2.084 1.00 97.68 9 A 1 ATOM 72 C C . SER A 1 9 ? 0.745 -0.814 -1.624 1.00 97.98 9 A 1 ATOM 73 O O . SER A 1 9 ? 1.789 -0.717 -2.263 1.00 97.53 9 A 1 ATOM 74 C CB . SER A 1 9 ? -1.366 -0.970 -2.956 1.00 97.10 9 A 1 ATOM 75 O OG . SER A 1 9 ? -1.099 -1.191 -4.323 1.00 90.83 9 A 1 ATOM 76 N N . LEU A 1 10 ? 0.523 -0.134 -0.514 1.00 97.65 10 A 1 ATOM 77 C CA . LEU A 1 10 ? 1.515 0.777 0.054 1.00 97.58 10 A 1 ATOM 78 C C . LEU A 1 10 ? 2.720 -0.004 0.566 1.00 97.91 10 A 1 ATOM 79 O O . LEU A 1 10 ? 3.859 0.437 0.428 1.00 97.81 10 A 1 ATOM 80 C CB . LEU A 1 10 ? 0.880 1.572 1.200 1.00 97.25 10 A 1 ATOM 81 C CG . LEU A 1 10 ? 1.497 2.950 1.405 1.00 94.71 10 A 1 ATOM 82 C CD1 . LEU A 1 10 ? 0.667 4.011 0.691 1.00 93.22 10 A 1 ATOM 83 C CD2 . LEU A 1 10 ? 1.591 3.265 2.885 1.00 92.86 10 A 1 ATOM 84 N N . LEU A 1 11 ? 2.456 -1.153 1.147 1.00 97.68 11 A 1 ATOM 85 C CA . LEU A 1 11 ? 3.518 -2.013 1.673 1.00 97.52 11 A 1 ATOM 86 C C . LEU A 1 11 ? 4.383 -2.543 0.538 1.00 97.75 11 A 1 ATOM 87 O O . LEU A 1 11 ? 5.600 -2.661 0.670 1.00 97.69 11 A 1 ATOM 88 C CB . LEU A 1 11 ? 2.892 -3.177 2.446 1.00 97.25 11 A 1 ATOM 89 C CG . LEU A 1 11 ? 3.219 -3.172 3.934 1.00 95.15 11 A 1 ATOM 90 C CD1 . LEU A 1 11 ? 1.944 -3.168 4.763 1.00 93.37 11 A 1 ATOM 91 C CD2 . LEU A 1 11 ? 4.068 -4.384 4.285 1.00 93.01 11 A 1 ATOM 92 N N . LEU A 1 12 ? 3.737 -2.846 -0.573 1.00 97.69 12 A 1 ATOM 93 C CA . LEU A 1 12 ? 4.441 -3.353 -1.748 1.00 97.53 12 A 1 ATOM 94 C C . LEU A 1 12 ? 5.278 -2.253 -2.391 1.00 97.79 12 A 1 ATOM 95 O O . LEU A 1 12 ? 6.378 -2.499 -2.880 1.00 97.53 12 A 1 ATOM 96 C CB . LEU A 1 12 ? 3.423 -3.896 -2.756 1.00 97.17 12 A 1 ATOM 97 C CG . LEU A 1 12 ? 3.488 -5.407 -2.949 1.00 95.16 12 A 1 ATOM 98 C CD1 . LEU A 1 12 ? 2.473 -6.112 -2.060 1.00 93.62 12 A 1 ATOM 99 C CD2 . LEU A 1 12 ? 3.243 -5.761 -4.400 1.00 93.44 12 A 1 ATOM 100 N N . LEU A 1 13 ? 4.740 -1.039 -2.381 1.00 97.72 13 A 1 ATOM 101 C CA . LEU A 1 13 ? 5.430 0.111 -2.965 1.00 97.37 13 A 1 ATOM 102 C C . LEU A 1 13 ? 6.667 0.473 -2.150 1.00 97.58 13 A 1 ATOM 103 O O . LEU A 1 13 ? 7.700 0.841 -2.703 1.00 97.10 13 A 1 ATOM 104 C CB . LEU A 1 13 ? 4.470 1.305 -3.020 1.00 96.95 13 A 1 ATOM 105 C CG . LEU A 1 13 ? 4.285 1.879 -4.424 1.00 94.65 13 A 1 ATOM 106 C CD1 . LEU A 1 13 ? 2.860 1.661 -4.910 1.00 93.45 13 A 1 ATOM 107 C CD2 . LEU A 1 13 ? 4.618 3.358 -4.431 1.00 92.95 13 A 1 ATOM 108 N N . ALA A 1 14 ? 6.554 0.367 -0.847 1.00 97.26 14 A 1 ATOM 109 C CA . ALA A 1 14 ? 7.657 0.700 0.052 1.00 96.98 14 A 1 ATOM 110 C C . ALA A 1 14 ? 8.845 -0.237 -0.148 1.00 97.26 14 A 1 ATOM 111 O O . ALA A 1 14 ? 9.983 0.128 0.124 1.00 96.25 14 A 1 ATOM 112 C CB . ALA A 1 14 ? 7.172 0.637 1.498 1.00 96.12 14 A 1 ATOM 113 N N . GLY A 1 15 ? 8.580 -1.424 -0.618 1.00 96.82 15 A 1 ATOM 114 C CA . GLY A 1 15 ? 9.650 -2.398 -0.838 1.00 96.50 15 A 1 ATOM 115 C C . GLY A 1 15 ? 9.816 -2.773 -2.299 1.00 96.93 15 A 1 ATOM 116 O O . GLY A 1 15 ? 10.231 -3.884 -2.606 1.00 96.13 15 A 1 ATOM 117 N N . THR A 1 16 ? 9.486 -1.851 -3.181 1.00 96.99 16 A 1 ATOM 118 C CA . THR A 1 16 ? 9.605 -2.106 -4.627 1.00 96.62 16 A 1 ATOM 119 C C . THR A 1 16 ? 9.934 -0.837 -5.408 1.00 96.63 16 A 1 ATOM 120 O O . THR A 1 16 ? 10.763 -0.862 -6.314 1.00 95.07 16 A 1 ATOM 121 C CB . THR A 1 16 ? 8.289 -2.702 -5.171 1.00 95.63 16 A 1 ATOM 122 O OG1 . THR A 1 16 ? 7.197 -1.945 -4.665 1.00 91.58 16 A 1 ATOM 123 C CG2 . THR A 1 16 ? 8.122 -4.152 -4.763 1.00 91.55 16 A 1 ATOM 124 N N . SER A 1 17 ? 9.294 0.260 -5.067 1.00 95.74 17 A 1 ATOM 125 C CA . SER A 1 17 ? 9.495 1.526 -5.776 1.00 95.09 17 A 1 ATOM 126 C C . SER A 1 17 ? 10.261 2.546 -4.935 1.00 95.29 17 A 1 ATOM 127 O O . SER A 1 17 ? 11.320 3.013 -5.330 1.00 93.00 17 A 1 ATOM 128 C CB . SER A 1 17 ? 8.138 2.101 -6.184 1.00 93.14 17 A 1 ATOM 129 O OG . SER A 1 17 ? 8.231 2.766 -7.421 1.00 85.65 17 A 1 ATOM 130 N N . LEU A 1 18 ? 9.719 2.894 -3.786 1.00 94.22 18 A 1 ATOM 131 C CA . LEU A 1 18 ? 10.332 3.885 -2.885 1.00 93.88 18 A 1 ATOM 132 C C . LEU A 1 18 ? 11.850 3.740 -2.814 1.00 94.58 18 A 1 ATOM 133 O O . LEU A 1 18 ? 12.582 4.488 -3.445 1.00 92.92 18 A 1 ATOM 134 C CB . LEU A 1 18 ? 9.703 3.766 -1.496 1.00 91.86 18 A 1 ATOM 135 C CG . LEU A 1 18 ? 8.566 4.770 -1.294 1.00 88.11 18 A 1 ATOM 136 C CD1 . LEU A 1 18 ? 7.392 4.110 -0.584 1.00 84.39 18 A 1 ATOM 137 C CD2 . LEU A 1 18 ? 9.069 5.953 -0.481 1.00 82.12 18 A 1 ATOM 138 N N . ALA A 1 19 ? 12.328 2.783 -2.033 1.00 91.41 19 A 1 ATOM 139 C CA . ALA A 1 19 ? 13.769 2.563 -1.922 1.00 90.40 19 A 1 ATOM 140 C C . ALA A 1 19 ? 14.101 1.345 -1.066 1.00 88.49 19 A 1 ATOM 141 O O . ALA A 1 19 ? 13.537 1.209 0.026 1.00 84.39 19 A 1 ATOM 142 C CB . ALA A 1 19 ? 14.420 3.804 -1.321 1.00 86.40 19 A 1 ATOM 143 O OXT . ALA A 1 19 ? 14.965 0.554 -1.472 1.00 78.58 19 A 1 #