# 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_orf35 # _entry.id orf35 # 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" "C4 H8 N2 O3" 132.118 ASN y ASPARAGINE C([C@@H](C(=O)O)N)C(=O)N ? "L-PEPTIDE LINKING" "C4 H7 N O4" 133.103 ASP y "ASPARTIC ACID" C([C@@H](C(=O)O)N)C(=O)O ? "L-PEPTIDE LINKING" "C3 H7 N O2 S" 121.158 CYS y CYSTEINE C([C@@H](C(=O)O)N)S ? "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" "C5 H9 N O4" 147.129 GLU y "GLUTAMIC ACID" C(CC(=O)O)[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 H10 N3 O2" 156.162 HIS y HISTIDINE c1c([nH+]c[nH]1)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" "C9 H11 N O2" 165.189 PHE y PHENYLALANINE c1ccc(cc1)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C5 H9 N O2" 115.130 PRO y PROLINE C1C[C@H](NC1)C(=O)O ? "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" "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" "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 ILE 3 1 n LEU 4 1 n GLN 5 1 n GLU 6 1 n GLU 7 1 n LYS 8 1 n ASN 9 1 n TYR 10 1 n TRP 11 1 n ALA 12 1 n ALA 13 1 n GLN 14 1 n CYS 15 1 n LEU 16 1 n GLU 17 1 n ALA 18 1 n ARG 19 1 n GLU 20 1 n GLN 21 1 n VAL 22 1 n GLU 23 1 n ARG 24 1 n VAL 25 1 n SER 26 1 n ALA 27 1 n LEU 28 1 n ALA 29 1 n ASP 30 1 n THR 31 1 n ASN 32 1 n GLN 33 1 n ALA 34 1 n LEU 35 1 n TYR 36 1 n GLU 37 1 n GLY 38 1 n GLU 39 1 n LYS 40 1 n LYS 41 1 n VAL 42 1 n ARG 43 1 n GLN 44 1 n GLU 45 1 n ILE 46 1 n GLU 47 1 n GLU 48 1 n ARG 49 1 n PHE 50 1 n GLU 51 1 n LEU 52 1 n LEU 53 1 n PHE 54 1 n GLU 55 1 n LEU 56 1 n MET 57 1 n GLY 58 1 n ILE 59 1 n MET 60 1 n GLN 61 1 n ARG 62 1 n THR 63 1 n GLY 64 1 n TYR 65 1 n THR 66 1 n THR 67 1 n SER 68 1 n VAL 69 1 n ALA 70 1 n LEU 71 1 n ASN 72 1 n ARG 73 1 n ILE 74 1 n THR 75 1 n ALA 76 1 n ASP 77 1 n GLY 78 1 n LEU 79 1 n ARG 80 1 n GLU 81 1 n HIS 82 1 n CYS 83 1 n LYS 84 1 n ARG 85 1 n ALA 86 1 n GLU 87 1 n GLU 88 1 n TYR 89 1 n VAL 90 1 n ARG 91 1 n PRO 92 1 n LYS 93 1 n GLY 94 1 n ARG 95 1 n ARG 96 1 n SER 97 1 n SER 98 1 n ILE 99 1 n ASP 100 1 n ARG 101 1 n LYS 102 1 n ASP 103 1 n LEU 104 1 n VAL 105 1 n LEU 106 1 n VAL 107 1 n ALA 108 1 n TRP 109 1 n ARG 110 1 n ALA 111 1 n ASN 112 1 n GLY 113 1 n SER 114 1 n TYR 115 1 n TYR 116 1 n SER 117 1 n ASP 118 1 n CYS 119 1 n ARG 120 1 n PRO 121 1 n LEU 122 1 n GLY 123 1 n LYS 124 1 n ASP 125 1 n GLU 126 1 n MET 127 1 n ALA 128 1 n ARG 129 1 n VAL 130 1 n GLN 131 1 n ARG 132 1 n VAL 133 1 n LEU 134 1 n THR 135 1 n ARG 136 1 n GLY 137 1 n LYS 138 1 n GLY 139 1 n GLU 140 1 n LYS 141 1 n ILE 142 1 n ALA 143 1 n LEU 144 1 n TYR 145 1 n ALA 146 1 n LEU 147 1 n ASP 148 1 n PRO 149 1 n GLN 150 1 n ASN 151 1 n ASP 152 1 n GLY 153 1 n GLU 154 # _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 (3.0.1 @ 2025-04-07 01:07:35)" _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 71.77 _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 83.95 1 1 A LYS 2 2 80.34 1 2 A ILE 3 2 86.52 1 3 A LEU 4 2 86.05 1 4 A GLN 5 2 85.58 1 5 A GLU 6 2 87.58 1 6 A GLU 7 2 85.99 1 7 A LYS 8 2 86.91 1 8 A ASN 9 2 93.81 1 9 A TYR 10 2 94.55 1 10 A TRP 11 2 90.03 1 11 A ALA 12 2 97.15 1 12 A ALA 13 2 97.47 1 13 A GLN 14 2 90.55 1 14 A CYS 15 2 96.15 1 15 A LEU 16 2 92.20 1 16 A GLU 17 2 87.99 1 17 A ALA 18 2 98.14 1 18 A ARG 19 2 83.51 1 19 A GLU 20 2 92.07 1 20 A GLN 21 2 87.33 1 21 A VAL 22 2 97.51 1 22 A GLU 23 2 91.62 1 23 A ARG 24 2 82.76 1 24 A VAL 25 2 97.81 1 25 A SER 26 2 96.27 1 26 A ALA 27 2 98.45 1 27 A LEU 28 2 92.70 1 28 A ALA 29 2 98.32 1 29 A ASP 30 2 96.87 1 30 A THR 31 2 96.81 1 31 A ASN 32 2 93.55 1 32 A GLN 33 2 92.31 1 33 A ALA 34 2 98.33 1 34 A LEU 35 2 95.30 1 35 A TYR 36 2 94.30 1 36 A GLU 37 2 93.35 1 37 A GLY 38 2 98.19 1 38 A GLU 39 2 87.61 1 39 A LYS 40 2 93.13 1 40 A LYS 41 2 88.67 1 41 A VAL 42 2 95.72 1 42 A ARG 43 2 82.50 1 43 A GLN 44 2 92.90 1 44 A GLU 45 2 83.48 1 45 A ILE 46 2 91.24 1 46 A GLU 47 2 90.17 1 47 A GLU 48 2 89.60 1 48 A ARG 49 2 83.22 1 49 A PHE 50 2 82.96 1 50 A GLU 51 2 86.95 1 51 A LEU 52 2 91.95 1 52 A LEU 53 2 87.48 1 53 A PHE 54 2 84.33 1 54 A GLU 55 2 86.42 1 55 A LEU 56 2 89.25 1 56 A MET 57 2 83.83 1 57 A GLY 58 2 91.16 1 58 A ILE 59 2 88.68 1 59 A MET 60 2 85.16 1 60 A GLN 61 2 79.58 1 61 A ARG 62 2 76.58 1 62 A THR 63 2 83.33 1 63 A GLY 64 2 80.19 1 64 A TYR 65 2 80.05 1 65 A THR 66 2 78.70 1 66 A THR 67 2 79.39 1 67 A SER 68 2 72.83 1 68 A VAL 69 2 76.53 1 69 A ALA 70 2 78.12 1 70 A LEU 71 2 76.20 1 71 A ASN 72 2 71.39 1 72 A ARG 73 2 68.23 1 73 A ILE 74 2 83.95 1 74 A THR 75 2 88.69 1 75 A ALA 76 2 92.46 1 76 A ASP 77 2 89.06 1 77 A GLY 78 2 92.66 1 78 A LEU 79 2 90.71 1 79 A ARG 80 2 87.06 1 80 A GLU 81 2 85.06 1 81 A HIS 82 2 88.08 1 82 A CYS 83 2 91.98 1 83 A LYS 84 2 85.45 1 84 A ARG 85 2 81.10 1 85 A ALA 86 2 89.09 1 86 A GLU 87 2 82.81 1 87 A GLU 88 2 85.83 1 88 A TYR 89 2 81.66 1 89 A VAL 90 2 76.02 1 90 A ARG 91 2 61.99 1 91 A PRO 92 2 67.77 1 92 A LYS 93 2 59.21 1 93 A GLY 94 2 56.39 1 94 A ARG 95 2 41.47 1 95 A ARG 96 2 42.68 1 96 A SER 97 2 50.27 1 97 A SER 98 2 55.95 1 98 A ILE 99 2 52.96 1 99 A ASP 100 2 54.51 1 100 A ARG 101 2 47.69 1 101 A LYS 102 2 50.26 1 102 A ASP 103 2 50.52 1 103 A LEU 104 2 51.51 1 104 A VAL 105 2 50.31 1 105 A LEU 106 2 51.64 1 106 A VAL 107 2 51.03 1 107 A ALA 108 2 49.38 1 108 A TRP 109 2 42.11 1 109 A ARG 110 2 39.73 1 110 A ALA 111 2 47.11 1 111 A ASN 112 2 43.44 1 112 A GLY 113 2 50.16 1 113 A SER 114 2 46.26 1 114 A TYR 115 2 41.40 1 115 A TYR 116 2 41.40 1 116 A SER 117 2 48.23 1 117 A ASP 118 2 47.34 1 118 A CYS 119 2 46.76 1 119 A ARG 120 2 47.91 1 120 A PRO 121 2 55.95 1 121 A LEU 122 2 56.38 1 122 A GLY 123 2 64.47 1 123 A LYS 124 2 64.50 1 124 A ASP 125 2 66.19 1 125 A GLU 126 2 59.20 1 126 A MET 127 2 59.83 1 127 A ALA 128 2 67.08 1 128 A ARG 129 2 55.92 1 129 A VAL 130 2 61.72 1 130 A GLN 131 2 59.24 1 131 A ARG 132 2 56.21 1 132 A VAL 133 2 59.23 1 133 A LEU 134 2 58.27 1 134 A THR 135 2 60.09 1 135 A ARG 136 2 52.31 1 136 A GLY 137 2 52.99 1 137 A LYS 138 2 47.57 1 138 A GLY 139 2 49.07 1 139 A GLU 140 2 45.62 1 140 A LYS 141 2 38.97 1 141 A ILE 142 2 45.25 1 142 A ALA 143 2 48.83 1 143 A LEU 144 2 45.29 1 144 A TYR 145 2 43.01 1 145 A ALA 146 2 41.56 1 146 A LEU 147 2 40.48 1 147 A ASP 148 2 37.11 1 148 A PRO 149 2 38.27 1 149 A GLN 150 2 38.67 1 150 A ASN 151 2 35.95 1 151 A ASP 152 2 35.24 1 152 A GLY 153 2 36.14 1 153 A GLU 154 2 26.44 1 154 # _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 ILE . 3 A 3 A 4 1 n LEU . 4 A 4 A 5 1 n GLN . 5 A 5 A 6 1 n GLU . 6 A 6 A 7 1 n GLU . 7 A 7 A 8 1 n LYS . 8 A 8 A 9 1 n ASN . 9 A 9 A 10 1 n TYR . 10 A 10 A 11 1 n TRP . 11 A 11 A 12 1 n ALA . 12 A 12 A 13 1 n ALA . 13 A 13 A 14 1 n GLN . 14 A 14 A 15 1 n CYS . 15 A 15 A 16 1 n LEU . 16 A 16 A 17 1 n GLU . 17 A 17 A 18 1 n ALA . 18 A 18 A 19 1 n ARG . 19 A 19 A 20 1 n GLU . 20 A 20 A 21 1 n GLN . 21 A 21 A 22 1 n VAL . 22 A 22 A 23 1 n GLU . 23 A 23 A 24 1 n ARG . 24 A 24 A 25 1 n VAL . 25 A 25 A 26 1 n SER . 26 A 26 A 27 1 n ALA . 27 A 27 A 28 1 n LEU . 28 A 28 A 29 1 n ALA . 29 A 29 A 30 1 n ASP . 30 A 30 A 31 1 n THR . 31 A 31 A 32 1 n ASN . 32 A 32 A 33 1 n GLN . 33 A 33 A 34 1 n ALA . 34 A 34 A 35 1 n LEU . 35 A 35 A 36 1 n TYR . 36 A 36 A 37 1 n GLU . 37 A 37 A 38 1 n GLY . 38 A 38 A 39 1 n GLU . 39 A 39 A 40 1 n LYS . 40 A 40 A 41 1 n LYS . 41 A 41 A 42 1 n VAL . 42 A 42 A 43 1 n ARG . 43 A 43 A 44 1 n GLN . 44 A 44 A 45 1 n GLU . 45 A 45 A 46 1 n ILE . 46 A 46 A 47 1 n GLU . 47 A 47 A 48 1 n GLU . 48 A 48 A 49 1 n ARG . 49 A 49 A 50 1 n PHE . 50 A 50 A 51 1 n GLU . 51 A 51 A 52 1 n LEU . 52 A 52 A 53 1 n LEU . 53 A 53 A 54 1 n PHE . 54 A 54 A 55 1 n GLU . 55 A 55 A 56 1 n LEU . 56 A 56 A 57 1 n MET . 57 A 57 A 58 1 n GLY . 58 A 58 A 59 1 n ILE . 59 A 59 A 60 1 n MET . 60 A 60 A 61 1 n GLN . 61 A 61 A 62 1 n ARG . 62 A 62 A 63 1 n THR . 63 A 63 A 64 1 n GLY . 64 A 64 A 65 1 n TYR . 65 A 65 A 66 1 n THR . 66 A 66 A 67 1 n THR . 67 A 67 A 68 1 n SER . 68 A 68 A 69 1 n VAL . 69 A 69 A 70 1 n ALA . 70 A 70 A 71 1 n LEU . 71 A 71 A 72 1 n ASN . 72 A 72 A 73 1 n ARG . 73 A 73 A 74 1 n ILE . 74 A 74 A 75 1 n THR . 75 A 75 A 76 1 n ALA . 76 A 76 A 77 1 n ASP . 77 A 77 A 78 1 n GLY . 78 A 78 A 79 1 n LEU . 79 A 79 A 80 1 n ARG . 80 A 80 A 81 1 n GLU . 81 A 81 A 82 1 n HIS . 82 A 82 A 83 1 n CYS . 83 A 83 A 84 1 n LYS . 84 A 84 A 85 1 n ARG . 85 A 85 A 86 1 n ALA . 86 A 86 A 87 1 n GLU . 87 A 87 A 88 1 n GLU . 88 A 88 A 89 1 n TYR . 89 A 89 A 90 1 n VAL . 90 A 90 A 91 1 n ARG . 91 A 91 A 92 1 n PRO . 92 A 92 A 93 1 n LYS . 93 A 93 A 94 1 n GLY . 94 A 94 A 95 1 n ARG . 95 A 95 A 96 1 n ARG . 96 A 96 A 97 1 n SER . 97 A 97 A 98 1 n SER . 98 A 98 A 99 1 n ILE . 99 A 99 A 100 1 n ASP . 100 A 100 A 101 1 n ARG . 101 A 101 A 102 1 n LYS . 102 A 102 A 103 1 n ASP . 103 A 103 A 104 1 n LEU . 104 A 104 A 105 1 n VAL . 105 A 105 A 106 1 n LEU . 106 A 106 A 107 1 n VAL . 107 A 107 A 108 1 n ALA . 108 A 108 A 109 1 n TRP . 109 A 109 A 110 1 n ARG . 110 A 110 A 111 1 n ALA . 111 A 111 A 112 1 n ASN . 112 A 112 A 113 1 n GLY . 113 A 113 A 114 1 n SER . 114 A 114 A 115 1 n TYR . 115 A 115 A 116 1 n TYR . 116 A 116 A 117 1 n SER . 117 A 117 A 118 1 n ASP . 118 A 118 A 119 1 n CYS . 119 A 119 A 120 1 n ARG . 120 A 120 A 121 1 n PRO . 121 A 121 A 122 1 n LEU . 122 A 122 A 123 1 n GLY . 123 A 123 A 124 1 n LYS . 124 A 124 A 125 1 n ASP . 125 A 125 A 126 1 n GLU . 126 A 126 A 127 1 n MET . 127 A 127 A 128 1 n ALA . 128 A 128 A 129 1 n ARG . 129 A 129 A 130 1 n VAL . 130 A 130 A 131 1 n GLN . 131 A 131 A 132 1 n ARG . 132 A 132 A 133 1 n VAL . 133 A 133 A 134 1 n LEU . 134 A 134 A 135 1 n THR . 135 A 135 A 136 1 n ARG . 136 A 136 A 137 1 n GLY . 137 A 137 A 138 1 n LYS . 138 A 138 A 139 1 n GLY . 139 A 139 A 140 1 n GLU . 140 A 140 A 141 1 n LYS . 141 A 141 A 142 1 n ILE . 142 A 142 A 143 1 n ALA . 143 A 143 A 144 1 n LEU . 144 A 144 A 145 1 n TYR . 145 A 145 A 146 1 n ALA . 146 A 146 A 147 1 n LEU . 147 A 147 A 148 1 n ASP . 148 A 148 A 149 1 n PRO . 149 A 149 A 150 1 n GLN . 150 A 150 A 151 1 n ASN . 151 A 151 A 152 1 n ASP . 152 A 152 A 153 1 n GLY . 153 A 153 A 154 1 n GLU . 154 A 154 # _software.classification other _software.date ? _software.description "Structure prediction" _software.name AlphaFold _software.pdbx_ordinal 1 _software.type package _software.version "AlphaFold-beta-20231127 (fa08f1a239cfd4fd49a5c37bef32bd41139da97e359ba389d3209450484ef018)" # _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 ? 32.303 -44.916 63.292 1.00 87.94 1 A 1 ATOM 2 C CA . MET A 1 1 ? 32.646 -43.629 62.644 1.00 93.86 1 A 1 ATOM 3 C C . MET A 1 1 ? 32.602 -43.663 61.112 1.00 94.38 1 A 1 ATOM 4 O O . MET A 1 1 ? 32.135 -42.690 60.553 1.00 89.57 1 A 1 ATOM 5 C CB . MET A 1 1 ? 33.979 -43.056 63.134 1.00 89.00 1 A 1 ATOM 6 C CG . MET A 1 1 ? 33.869 -42.502 64.564 1.00 79.93 1 A 1 ATOM 7 S SD . MET A 1 1 ? 35.237 -41.385 64.958 1.00 73.53 1 A 1 ATOM 8 C CE . MET A 1 1 ? 35.232 -41.440 66.760 1.00 63.43 1 A 1 ATOM 9 N N . LYS A 1 2 ? 33.017 -44.740 60.408 1.00 88.08 2 A 1 ATOM 10 C CA . LYS A 1 2 ? 32.993 -44.805 58.924 1.00 90.90 2 A 1 ATOM 11 C C . LYS A 1 2 ? 31.589 -44.663 58.318 1.00 92.06 2 A 1 ATOM 12 O O . LYS A 1 2 ? 31.408 -43.807 57.460 1.00 90.03 2 A 1 ATOM 13 C CB . LYS A 1 2 ? 33.693 -46.080 58.415 1.00 88.25 2 A 1 ATOM 14 C CG . LYS A 1 2 ? 35.224 -45.973 58.495 1.00 77.21 2 A 1 ATOM 15 C CD . LYS A 1 2 ? 35.884 -47.214 57.867 1.00 73.42 2 A 1 ATOM 16 C CE . LYS A 1 2 ? 37.408 -47.083 57.843 1.00 65.28 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? 38.043 -48.259 57.196 1.00 57.86 2 A 1 ATOM 18 N N . ILE A 1 3 ? 30.574 -45.388 58.839 1.00 90.92 3 A 1 ATOM 19 C CA . ILE A 1 3 ? 29.184 -45.377 58.334 1.00 91.09 3 A 1 ATOM 20 C C . ILE A 1 3 ? 28.568 -43.967 58.398 1.00 92.16 3 A 1 ATOM 21 O O . ILE A 1 3 ? 28.029 -43.478 57.407 1.00 91.10 3 A 1 ATOM 22 C CB . ILE A 1 3 ? 28.334 -46.418 59.108 1.00 89.76 3 A 1 ATOM 23 C CG1 . ILE A 1 3 ? 28.922 -47.841 58.929 1.00 83.51 3 A 1 ATOM 24 C CG2 . ILE A 1 3 ? 26.867 -46.378 58.660 1.00 80.77 3 A 1 ATOM 25 C CD1 . ILE A 1 3 ? 28.273 -48.914 59.814 1.00 72.82 3 A 1 ATOM 26 N N . LEU A 1 4 ? 28.737 -43.238 59.512 1.00 92.58 4 A 1 ATOM 27 C CA . LEU A 1 4 ? 28.249 -41.855 59.661 1.00 91.89 4 A 1 ATOM 28 C C . LEU A 1 4 ? 28.905 -40.876 58.671 1.00 93.03 4 A 1 ATOM 29 O O . LEU A 1 4 ? 28.272 -39.910 58.240 1.00 93.60 4 A 1 ATOM 30 C CB . LEU A 1 4 ? 28.524 -41.395 61.108 1.00 91.44 4 A 1 ATOM 31 C CG . LEU A 1 4 ? 27.460 -41.856 62.121 1.00 80.20 4 A 1 ATOM 32 C CD1 . LEU A 1 4 ? 28.033 -41.846 63.537 1.00 71.79 4 A 1 ATOM 33 C CD2 . LEU A 1 4 ? 26.242 -40.937 62.086 1.00 73.88 4 A 1 ATOM 34 N N . GLN A 1 5 ? 30.170 -41.093 58.315 1.00 93.01 5 A 1 ATOM 35 C CA . GLN A 1 5 ? 30.869 -40.266 57.329 1.00 92.94 5 A 1 ATOM 36 C C . GLN A 1 5 ? 30.390 -40.569 55.899 1.00 93.46 5 A 1 ATOM 37 O O . GLN A 1 5 ? 30.242 -39.644 55.100 1.00 94.24 5 A 1 ATOM 38 C CB . GLN A 1 5 ? 32.389 -40.457 57.485 1.00 92.30 5 A 1 ATOM 39 C CG . GLN A 1 5 ? 33.206 -39.480 56.630 1.00 83.16 5 A 1 ATOM 40 C CD . GLN A 1 5 ? 32.962 -38.019 57.011 1.00 79.19 5 A 1 ATOM 41 O OE1 . GLN A 1 5 ? 32.918 -37.634 58.169 1.00 73.44 5 A 1 ATOM 42 N NE2 . GLN A 1 5 ? 32.784 -37.135 56.054 1.00 68.49 5 A 1 ATOM 43 N N . GLU A 1 6 ? 30.106 -41.836 55.575 1.00 94.96 6 A 1 ATOM 44 C CA . GLU A 1 6 ? 29.544 -42.262 54.284 1.00 94.77 6 A 1 ATOM 45 C C . GLU A 1 6 ? 28.123 -41.713 54.083 1.00 95.24 6 A 1 ATOM 46 O O . GLU A 1 6 ? 27.849 -41.117 53.038 1.00 94.80 6 A 1 ATOM 47 C CB . GLU A 1 6 ? 29.577 -43.797 54.189 1.00 94.29 6 A 1 ATOM 48 C CG . GLU A 1 6 ? 31.010 -44.317 53.977 1.00 85.74 6 A 1 ATOM 49 C CD . GLU A 1 6 ? 31.166 -45.839 54.146 1.00 81.18 6 A 1 ATOM 50 O OE1 . GLU A 1 6 ? 32.333 -46.300 54.037 1.00 73.03 6 A 1 ATOM 51 O OE2 . GLU A 1 6 ? 30.167 -46.524 54.450 1.00 74.22 6 A 1 ATOM 52 N N . GLU A 1 7 ? 27.258 -41.787 55.107 1.00 95.60 7 A 1 ATOM 53 C CA . GLU A 1 7 ? 25.924 -41.164 55.084 1.00 95.19 7 A 1 ATOM 54 C C . GLU A 1 7 ? 26.003 -39.644 54.890 1.00 95.77 7 A 1 ATOM 55 O O . GLU A 1 7 ? 25.307 -39.078 54.042 1.00 95.54 7 A 1 ATOM 56 C CB . GLU A 1 7 ? 25.175 -41.464 56.390 1.00 94.57 7 A 1 ATOM 57 C CG . GLU A 1 7 ? 24.650 -42.902 56.462 1.00 81.31 7 A 1 ATOM 58 C CD . GLU A 1 7 ? 23.901 -43.189 57.773 1.00 76.86 7 A 1 ATOM 59 O OE1 . GLU A 1 7 ? 23.202 -44.226 57.817 1.00 68.70 7 A 1 ATOM 60 O OE2 . GLU A 1 7 ? 24.040 -42.392 58.732 1.00 70.33 7 A 1 ATOM 61 N N . LYS A 1 8 ? 26.901 -38.970 55.630 1.00 95.27 8 A 1 ATOM 62 C CA . LYS A 1 8 ? 27.110 -37.525 55.476 1.00 94.71 8 A 1 ATOM 63 C C . LYS A 1 8 ? 27.546 -37.158 54.050 1.00 95.05 8 A 1 ATOM 64 O O . LYS A 1 8 ? 27.041 -36.178 53.496 1.00 95.84 8 A 1 ATOM 65 C CB . LYS A 1 8 ? 28.124 -37.051 56.527 1.00 94.20 8 A 1 ATOM 66 C CG . LYS A 1 8 ? 28.314 -35.528 56.488 1.00 84.92 8 A 1 ATOM 67 C CD . LYS A 1 8 ? 29.348 -35.088 57.525 1.00 81.56 8 A 1 ATOM 68 C CE . LYS A 1 8 ? 29.548 -33.579 57.410 1.00 73.52 8 A 1 ATOM 69 N NZ . LYS A 1 8 ? 30.584 -33.097 58.353 1.00 67.13 8 A 1 ATOM 70 N N . ASN A 1 9 ? 28.455 -37.924 53.456 1.00 96.89 9 A 1 ATOM 71 C CA . ASN A 1 9 ? 28.926 -37.705 52.086 1.00 96.92 9 A 1 ATOM 72 C C . ASN A 1 9 ? 27.811 -37.961 51.057 1.00 96.99 9 A 1 ATOM 73 O O . ASN A 1 9 ? 27.677 -37.192 50.107 1.00 96.68 9 A 1 ATOM 74 C CB . ASN A 1 9 ? 30.146 -38.606 51.820 1.00 96.56 9 A 1 ATOM 75 C CG . ASN A 1 9 ? 31.404 -38.215 52.581 1.00 93.27 9 A 1 ATOM 76 O OD1 . ASN A 1 9 ? 31.521 -37.184 53.225 1.00 86.70 9 A 1 ATOM 77 N ND2 . ASN A 1 9 ? 32.420 -39.048 52.511 1.00 86.43 9 A 1 ATOM 78 N N . TYR A 1 10 ? 26.981 -39.001 51.268 1.00 97.48 10 A 1 ATOM 79 C CA . TYR A 1 10 ? 25.818 -39.292 50.429 1.00 97.39 10 A 1 ATOM 80 C C . TYR A 1 10 ? 24.823 -38.123 50.423 1.00 97.67 10 A 1 ATOM 81 O O . TYR A 1 10 ? 24.476 -37.614 49.358 1.00 97.44 10 A 1 ATOM 82 C CB . TYR A 1 10 ? 25.164 -40.596 50.909 1.00 97.32 10 A 1 ATOM 83 C CG . TYR A 1 10 ? 23.875 -40.914 50.175 1.00 95.88 10 A 1 ATOM 84 C CD1 . TYR A 1 10 ? 22.634 -40.562 50.743 1.00 90.25 10 A 1 ATOM 85 C CD2 . TYR A 1 10 ? 23.919 -41.529 48.909 1.00 92.50 10 A 1 ATOM 86 C CE1 . TYR A 1 10 ? 21.439 -40.824 50.043 1.00 91.50 10 A 1 ATOM 87 C CE2 . TYR A 1 10 ? 22.732 -41.792 48.206 1.00 92.01 10 A 1 ATOM 88 C CZ . TYR A 1 10 ? 21.489 -41.438 48.777 1.00 92.95 10 A 1 ATOM 89 O OH . TYR A 1 10 ? 20.336 -41.685 48.100 1.00 92.17 10 A 1 ATOM 90 N N . TRP A 1 11 ? 24.411 -37.638 51.604 1.00 95.58 11 A 1 ATOM 91 C CA . TRP A 1 11 ? 23.478 -36.508 51.698 1.00 95.48 11 A 1 ATOM 92 C C . TRP A 1 11 ? 24.068 -35.209 51.149 1.00 96.41 11 A 1 ATOM 93 O O . TRP A 1 11 ? 23.350 -34.435 50.519 1.00 96.56 11 A 1 ATOM 94 C CB . TRP A 1 11 ? 23.014 -36.341 53.148 1.00 94.92 11 A 1 ATOM 95 C CG . TRP A 1 11 ? 22.076 -37.414 53.610 1.00 93.52 11 A 1 ATOM 96 C CD1 . TRP A 1 11 ? 22.313 -38.327 54.581 1.00 87.17 11 A 1 ATOM 97 C CD2 . TRP A 1 11 ? 20.744 -37.728 53.095 1.00 90.76 11 A 1 ATOM 98 N NE1 . TRP A 1 11 ? 21.233 -39.177 54.704 1.00 85.19 11 A 1 ATOM 99 C CE2 . TRP A 1 11 ? 20.240 -38.856 53.812 1.00 88.49 11 A 1 ATOM 100 C CE3 . TRP A 1 11 ? 19.924 -37.176 52.097 1.00 83.87 11 A 1 ATOM 101 C CZ2 . TRP A 1 11 ? 18.975 -39.401 53.551 1.00 87.13 11 A 1 ATOM 102 C CZ3 . TRP A 1 11 ? 18.647 -37.717 51.825 1.00 82.73 11 A 1 ATOM 103 C CH2 . TRP A 1 11 ? 18.174 -38.828 52.547 1.00 82.59 11 A 1 ATOM 104 N N . ALA A 1 12 ? 25.376 -34.973 51.328 1.00 97.30 12 A 1 ATOM 105 C CA . ALA A 1 12 ? 26.054 -33.825 50.727 1.00 97.15 12 A 1 ATOM 106 C C . ALA A 1 12 ? 26.013 -33.871 49.189 1.00 97.16 12 A 1 ATOM 107 O O . ALA A 1 12 ? 25.742 -32.845 48.564 1.00 97.06 12 A 1 ATOM 108 C CB . ALA A 1 12 ? 27.492 -33.760 51.259 1.00 97.06 12 A 1 ATOM 109 N N . ALA A 1 13 ? 26.217 -35.056 48.585 1.00 97.66 13 A 1 ATOM 110 C CA . ALA A 1 13 ? 26.111 -35.241 47.138 1.00 97.61 13 A 1 ATOM 111 C C . ALA A 1 13 ? 24.676 -35.012 46.633 1.00 97.61 13 A 1 ATOM 112 O O . ALA A 1 13 ? 24.483 -34.267 45.673 1.00 97.11 13 A 1 ATOM 113 C CB . ALA A 1 13 ? 26.636 -36.639 46.779 1.00 97.35 13 A 1 ATOM 114 N N . GLN A 1 14 ? 23.664 -35.557 47.329 1.00 97.28 14 A 1 ATOM 115 C CA . GLN A 1 14 ? 22.248 -35.336 46.996 1.00 97.12 14 A 1 ATOM 116 C C . GLN A 1 14 ? 21.850 -33.853 47.084 1.00 97.47 14 A 1 ATOM 117 O O . GLN A 1 14 ? 21.142 -33.336 46.221 1.00 97.37 14 A 1 ATOM 118 C CB . GLN A 1 14 ? 21.371 -36.173 47.947 1.00 97.06 14 A 1 ATOM 119 C CG . GLN A 1 14 ? 21.462 -37.685 47.680 1.00 90.17 14 A 1 ATOM 120 C CD . GLN A 1 14 ? 20.896 -38.040 46.310 1.00 86.49 14 A 1 ATOM 121 O OE1 . GLN A 1 14 ? 19.748 -37.778 46.019 1.00 77.94 14 A 1 ATOM 122 N NE2 . GLN A 1 14 ? 21.673 -38.625 45.420 1.00 74.05 14 A 1 ATOM 123 N N . CYS A 1 15 ? 22.332 -33.132 48.112 1.00 97.84 15 A 1 ATOM 124 C CA . CYS A 1 15 ? 22.093 -31.689 48.231 1.00 97.66 15 A 1 ATOM 125 C C . CYS A 1 15 ? 22.748 -30.889 47.098 1.00 97.51 15 A 1 ATOM 126 O O . CYS A 1 15 ? 22.186 -29.881 46.665 1.00 97.81 15 A 1 ATOM 127 C CB . CYS A 1 15 ? 22.621 -31.195 49.585 1.00 97.52 15 A 1 ATOM 128 S SG . CYS A 1 15 ? 21.544 -31.733 50.946 1.00 88.59 15 A 1 ATOM 129 N N . LEU A 1 16 ? 23.936 -31.306 46.636 1.00 97.69 16 A 1 ATOM 130 C CA . LEU A 1 16 ? 24.638 -30.650 45.533 1.00 97.31 16 A 1 ATOM 131 C C . LEU A 1 16 ? 23.903 -30.880 44.204 1.00 97.40 16 A 1 ATOM 132 O O . LEU A 1 16 ? 23.612 -29.914 43.504 1.00 97.66 16 A 1 ATOM 133 C CB . LEU A 1 16 ? 26.105 -31.120 45.531 1.00 97.50 16 A 1 ATOM 134 C CG . LEU A 1 16 ? 27.009 -30.280 44.605 1.00 87.58 16 A 1 ATOM 135 C CD1 . LEU A 1 16 ? 28.354 -30.008 45.281 1.00 79.78 16 A 1 ATOM 136 C CD2 . LEU A 1 16 ? 27.284 -30.994 43.281 1.00 82.67 16 A 1 ATOM 137 N N . GLU A 1 17 ? 23.483 -32.113 43.917 1.00 98.00 17 A 1 ATOM 138 C CA . GLU A 1 17 ? 22.681 -32.455 42.735 1.00 97.86 17 A 1 ATOM 139 C C . GLU A 1 17 ? 21.343 -31.695 42.713 1.00 97.94 17 A 1 ATOM 140 O O . GLU A 1 17 ? 20.952 -31.130 41.686 1.00 97.78 17 A 1 ATOM 141 C CB . GLU A 1 17 ? 22.464 -33.975 42.719 1.00 97.83 17 A 1 ATOM 142 C CG . GLU A 1 17 ? 21.765 -34.452 41.430 1.00 85.00 17 A 1 ATOM 143 C CD . GLU A 1 17 ? 21.575 -35.977 41.371 1.00 78.63 17 A 1 ATOM 144 O OE1 . GLU A 1 17 ? 21.125 -36.446 40.300 1.00 67.64 17 A 1 ATOM 145 O OE2 . GLU A 1 17 ? 21.855 -36.667 42.377 1.00 71.24 17 A 1 ATOM 146 N N . ALA A 1 18 ? 20.661 -31.598 43.858 1.00 98.33 18 A 1 ATOM 147 C CA . ALA A 1 18 ? 19.429 -30.821 43.984 1.00 98.12 18 A 1 ATOM 148 C C . ALA A 1 18 ? 19.654 -29.326 43.701 1.00 98.16 18 A 1 ATOM 149 O O . ALA A 1 18 ? 18.834 -28.706 43.025 1.00 98.02 18 A 1 ATOM 150 C CB . ALA A 1 18 ? 18.840 -31.054 45.381 1.00 98.08 18 A 1 ATOM 151 N N . ARG A 1 19 ? 20.768 -28.749 44.170 1.00 98.15 19 A 1 ATOM 152 C CA . ARG A 1 19 ? 21.136 -27.356 43.860 1.00 97.94 19 A 1 ATOM 153 C C . ARG A 1 19 ? 21.390 -27.142 42.373 1.00 98.05 19 A 1 ATOM 154 O O . ARG A 1 19 ? 20.808 -26.225 41.801 1.00 98.06 19 A 1 ATOM 155 C CB . ARG A 1 19 ? 22.368 -26.924 44.661 1.00 97.90 19 A 1 ATOM 156 C CG . ARG A 1 19 ? 21.991 -26.463 46.068 1.00 88.76 19 A 1 ATOM 157 C CD . ARG A 1 19 ? 23.263 -26.029 46.799 1.00 84.10 19 A 1 ATOM 158 N NE . ARG A 1 19 ? 22.944 -25.291 48.034 1.00 72.31 19 A 1 ATOM 159 C CZ . ARG A 1 19 ? 23.815 -24.673 48.809 1.00 66.62 19 A 1 ATOM 160 N NH1 . ARG A 1 19 ? 25.102 -24.723 48.571 1.00 60.96 19 A 1 ATOM 161 N NH2 . ARG A 1 19 ? 23.413 -23.975 49.833 1.00 55.75 19 A 1 ATOM 162 N N . GLU A 1 20 ? 22.178 -28.003 41.737 1.00 98.27 20 A 1 ATOM 163 C CA . GLU A 1 20 ? 22.442 -27.926 40.294 1.00 98.16 20 A 1 ATOM 164 C C . GLU A 1 20 ? 21.155 -28.067 39.467 1.00 98.26 20 A 1 ATOM 165 O O . GLU A 1 20 ? 20.993 -27.426 38.421 1.00 98.01 20 A 1 ATOM 166 C CB . GLU A 1 20 ? 23.395 -29.052 39.881 1.00 98.10 20 A 1 ATOM 167 C CG . GLU A 1 20 ? 24.839 -28.867 40.364 1.00 90.85 20 A 1 ATOM 168 C CD . GLU A 1 20 ? 25.750 -30.023 39.909 1.00 86.66 20 A 1 ATOM 169 O OE1 . GLU A 1 20 ? 26.950 -29.986 40.267 1.00 78.53 20 A 1 ATOM 170 O OE2 . GLU A 1 20 ? 25.254 -30.928 39.190 1.00 81.77 20 A 1 ATOM 171 N N . GLN A 1 21 ? 20.212 -28.898 39.930 1.00 98.48 21 A 1 ATOM 172 C CA . GLN A 1 21 ? 18.909 -29.031 39.285 1.00 98.32 21 A 1 ATOM 173 C C . GLN A 1 21 ? 18.077 -27.748 39.415 1.00 98.44 21 A 1 ATOM 174 O O . GLN A 1 21 ? 17.481 -27.311 38.431 1.00 98.39 21 A 1 ATOM 175 C CB . GLN A 1 21 ? 18.180 -30.258 39.851 1.00 98.12 21 A 1 ATOM 176 C CG . GLN A 1 21 ? 16.881 -30.584 39.095 1.00 83.73 21 A 1 ATOM 177 C CD . GLN A 1 21 ? 17.086 -30.991 37.635 1.00 75.73 21 A 1 ATOM 178 O OE1 . GLN A 1 21 ? 18.160 -31.321 37.158 1.00 70.30 21 A 1 ATOM 179 N NE2 . GLN A 1 21 ? 16.036 -30.990 36.846 1.00 64.45 21 A 1 ATOM 180 N N . VAL A 1 22 ? 18.059 -27.115 40.591 1.00 98.36 22 A 1 ATOM 181 C CA . VAL A 1 22 ? 17.375 -25.830 40.809 1.00 98.24 22 A 1 ATOM 182 C C . VAL A 1 22 ? 17.991 -24.731 39.943 1.00 98.32 22 A 1 ATOM 183 O O . VAL A 1 22 ? 17.248 -23.993 39.299 1.00 98.23 22 A 1 ATOM 184 C CB . VAL A 1 22 ? 17.381 -25.448 42.303 1.00 98.11 22 A 1 ATOM 185 C CG1 . VAL A 1 22 ? 16.916 -24.007 42.552 1.00 95.60 22 A 1 ATOM 186 C CG2 . VAL A 1 22 ? 16.436 -26.367 43.090 1.00 95.69 22 A 1 ATOM 187 N N . GLU A 1 23 ? 19.317 -24.647 39.863 1.00 98.41 23 A 1 ATOM 188 C CA . GLU A 1 23 ? 20.010 -23.669 39.015 1.00 98.26 23 A 1 ATOM 189 C C . GLU A 1 23 ? 19.675 -23.863 37.531 1.00 98.30 23 A 1 ATOM 190 O O . GLU A 1 23 ? 19.337 -22.897 36.840 1.00 98.07 23 A 1 ATOM 191 C CB . GLU A 1 23 ? 21.529 -23.762 39.239 1.00 98.28 23 A 1 ATOM 192 C CG . GLU A 1 23 ? 21.949 -23.154 40.589 1.00 91.83 23 A 1 ATOM 193 C CD . GLU A 1 23 ? 23.454 -23.301 40.886 1.00 85.87 23 A 1 ATOM 194 O OE1 . GLU A 1 23 ? 23.851 -22.888 42.004 1.00 76.40 23 A 1 ATOM 195 O OE2 . GLU A 1 23 ? 24.197 -23.821 40.026 1.00 79.20 23 A 1 ATOM 196 N N . ARG A 1 24 ? 19.655 -25.115 37.037 1.00 98.47 24 A 1 ATOM 197 C CA . ARG A 1 24 ? 19.244 -25.439 35.660 1.00 98.47 24 A 1 ATOM 198 C C . ARG A 1 24 ? 17.794 -25.043 35.373 1.00 98.56 24 A 1 ATOM 199 O O . ARG A 1 24 ? 17.515 -24.475 34.319 1.00 98.30 24 A 1 ATOM 200 C CB . ARG A 1 24 ? 19.464 -26.938 35.391 1.00 98.28 24 A 1 ATOM 201 C CG . ARG A 1 24 ? 20.931 -27.243 35.050 1.00 86.57 24 A 1 ATOM 202 C CD . ARG A 1 24 ? 21.137 -28.736 34.741 1.00 84.07 24 A 1 ATOM 203 N NE . ARG A 1 24 ? 21.438 -29.513 35.954 1.00 70.34 24 A 1 ATOM 204 C CZ . ARG A 1 24 ? 21.269 -30.816 36.133 1.00 65.69 24 A 1 ATOM 205 N NH1 . ARG A 1 24 ? 20.665 -31.567 35.256 1.00 58.52 24 A 1 ATOM 206 N NH2 . ARG A 1 24 ? 21.714 -31.394 37.217 1.00 53.06 24 A 1 ATOM 207 N N . VAL A 1 25 ? 16.874 -25.334 36.292 1.00 98.50 25 A 1 ATOM 208 C CA . VAL A 1 25 ? 15.457 -24.962 36.150 1.00 98.41 25 A 1 ATOM 209 C C . VAL A 1 25 ? 15.284 -23.441 36.171 1.00 98.53 25 A 1 ATOM 210 O O . VAL A 1 25 ? 14.528 -22.918 35.354 1.00 98.51 25 A 1 ATOM 211 C CB . VAL A 1 25 ? 14.598 -25.650 37.230 1.00 98.27 25 A 1 ATOM 212 C CG1 . VAL A 1 25 ? 13.157 -25.125 37.268 1.00 96.29 25 A 1 ATOM 213 C CG2 . VAL A 1 25 ? 14.520 -27.164 36.961 1.00 96.15 25 A 1 ATOM 214 N N . SER A 1 26 ? 16.000 -22.731 37.054 1.00 98.50 26 A 1 ATOM 215 C CA . SER A 1 26 ? 15.978 -21.263 37.106 1.00 98.42 26 A 1 ATOM 216 C C . SER A 1 26 ? 16.476 -20.647 35.800 1.00 98.45 26 A 1 ATOM 217 O O . SER A 1 26 ? 15.775 -19.833 35.203 1.00 98.32 26 A 1 ATOM 218 C CB . SER A 1 26 ? 16.822 -20.760 38.281 1.00 98.27 26 A 1 ATOM 219 O OG . SER A 1 26 ? 16.506 -19.414 38.573 1.00 85.66 26 A 1 ATOM 220 N N . ALA A 1 27 ? 17.625 -21.106 35.287 1.00 98.53 27 A 1 ATOM 221 C CA . ALA A 1 27 ? 18.175 -20.618 34.020 1.00 98.47 27 A 1 ATOM 222 C C . ALA A 1 27 ? 17.227 -20.869 32.832 1.00 98.52 27 A 1 ATOM 223 O O . ALA A 1 27 ? 17.086 -20.025 31.942 1.00 98.26 27 A 1 ATOM 224 C CB . ALA A 1 27 ? 19.532 -21.297 33.804 1.00 98.47 27 A 1 ATOM 225 N N . LEU A 1 28 ? 16.539 -22.015 32.814 1.00 98.28 28 A 1 ATOM 226 C CA . LEU A 1 28 ? 15.521 -22.312 31.803 1.00 98.02 28 A 1 ATOM 227 C C . LEU A 1 28 ? 14.304 -21.385 31.934 1.00 98.14 28 A 1 ATOM 228 O O . LEU A 1 28 ? 13.784 -20.914 30.920 1.00 98.30 28 A 1 ATOM 229 C CB . LEU A 1 28 ? 15.126 -23.797 31.915 1.00 98.21 28 A 1 ATOM 230 C CG . LEU A 1 28 ? 14.098 -24.248 30.857 1.00 87.62 28 A 1 ATOM 231 C CD1 . LEU A 1 28 ? 14.653 -24.150 29.433 1.00 79.82 28 A 1 ATOM 232 C CD2 . LEU A 1 28 ? 13.686 -25.695 31.121 1.00 83.22 28 A 1 ATOM 233 N N . ALA A 1 29 ? 13.848 -21.109 33.157 1.00 98.40 29 A 1 ATOM 234 C CA . ALA A 1 29 ? 12.744 -20.187 33.414 1.00 98.29 29 A 1 ATOM 235 C C . ALA A 1 29 ? 13.082 -18.763 32.949 1.00 98.28 29 A 1 ATOM 236 O O . ALA A 1 29 ? 12.290 -18.167 32.221 1.00 98.30 29 A 1 ATOM 237 C CB . ALA A 1 29 ? 12.379 -20.243 34.902 1.00 98.32 29 A 1 ATOM 238 N N . ASP A 1 30 ? 14.280 -18.270 33.266 1.00 98.49 30 A 1 ATOM 239 C CA . ASP A 1 30 ? 14.761 -16.954 32.833 1.00 98.50 30 A 1 ATOM 240 C C . ASP A 1 30 ? 14.834 -16.859 31.301 1.00 98.53 30 A 1 ATOM 241 O O . ASP A 1 30 ? 14.396 -15.876 30.695 1.00 98.35 30 A 1 ATOM 242 C CB . ASP A 1 30 ? 16.153 -16.686 33.439 1.00 98.41 30 A 1 ATOM 243 C CG . ASP A 1 30 ? 16.168 -16.559 34.971 1.00 96.52 30 A 1 ATOM 244 O OD1 . ASP A 1 30 ? 15.122 -16.206 35.554 1.00 92.89 30 A 1 ATOM 245 O OD2 . ASP A 1 30 ? 17.251 -16.805 35.548 1.00 93.30 30 A 1 ATOM 246 N N . THR A 1 31 ? 15.321 -17.919 30.640 1.00 98.37 31 A 1 ATOM 247 C CA . THR A 1 31 ? 15.372 -17.995 29.171 1.00 98.11 31 A 1 ATOM 248 C C . THR A 1 31 ? 13.969 -17.963 28.560 1.00 98.14 31 A 1 ATOM 249 O O . THR A 1 31 ? 13.714 -17.202 27.624 1.00 98.03 31 A 1 ATOM 250 C CB . THR A 1 31 ? 16.104 -19.260 28.706 1.00 98.12 31 A 1 ATOM 251 O OG1 . THR A 1 31 ? 17.405 -19.309 29.244 1.00 94.26 31 A 1 ATOM 252 C CG2 . THR A 1 31 ? 16.264 -19.307 27.184 1.00 92.67 31 A 1 ATOM 253 N N . ASN A 1 32 ? 13.035 -18.746 29.098 1.00 98.32 32 A 1 ATOM 254 C CA . ASN A 1 32 ? 11.650 -18.775 28.626 1.00 98.18 32 A 1 ATOM 255 C C . ASN A 1 32 ? 10.942 -17.432 28.843 1.00 98.18 32 A 1 ATOM 256 O O . ASN A 1 32 ? 10.188 -16.990 27.975 1.00 98.29 32 A 1 ATOM 257 C CB . ASN A 1 32 ? 10.900 -19.907 29.345 1.00 98.13 32 A 1 ATOM 258 C CG . ASN A 1 32 ? 11.270 -21.291 28.841 1.00 92.39 32 A 1 ATOM 259 O OD1 . ASN A 1 32 ? 11.718 -21.501 27.724 1.00 83.02 32 A 1 ATOM 260 N ND2 . ASN A 1 32 ? 11.045 -22.307 29.639 1.00 81.85 32 A 1 ATOM 261 N N . GLN A 1 33 ? 11.201 -16.765 29.970 1.00 98.37 33 A 1 ATOM 262 C CA . GLN A 1 33 ? 10.667 -15.433 30.232 1.00 98.01 33 A 1 ATOM 263 C C . GLN A 1 33 ? 11.202 -14.411 29.221 1.00 97.83 33 A 1 ATOM 264 O O . GLN A 1 33 ? 10.414 -13.665 28.635 1.00 97.94 33 A 1 ATOM 265 C CB . GLN A 1 33 ? 10.972 -15.034 31.678 1.00 98.24 33 A 1 ATOM 266 C CG . GLN A 1 33 ? 10.374 -13.655 31.982 1.00 93.74 33 A 1 ATOM 267 C CD . GLN A 1 33 ? 10.505 -13.226 33.434 1.00 86.52 33 A 1 ATOM 268 O OE1 . GLN A 1 33 ? 10.746 -13.998 34.342 1.00 81.98 33 A 1 ATOM 269 N NE2 . GLN A 1 33 ? 10.300 -11.958 33.695 1.00 78.15 33 A 1 ATOM 270 N N . ALA A 1 34 ? 12.507 -14.412 28.941 1.00 98.55 34 A 1 ATOM 271 C CA . ALA A 1 34 ? 13.109 -13.519 27.951 1.00 98.39 34 A 1 ATOM 272 C C . ALA A 1 34 ? 12.538 -13.746 26.540 1.00 98.34 34 A 1 ATOM 273 O O . ALA A 1 34 ? 12.249 -12.781 25.825 1.00 97.99 34 A 1 ATOM 274 C CB . ALA A 1 34 ? 14.628 -13.718 27.986 1.00 98.37 34 A 1 ATOM 275 N N . LEU A 1 35 ? 12.319 -15.006 26.143 1.00 98.29 35 A 1 ATOM 276 C CA . LEU A 1 35 ? 11.671 -15.348 24.871 1.00 98.10 35 A 1 ATOM 277 C C . LEU A 1 35 ? 10.231 -14.833 24.819 1.00 98.18 35 A 1 ATOM 278 O O . LEU A 1 35 ? 9.855 -14.171 23.850 1.00 98.18 35 A 1 ATOM 279 C CB . LEU A 1 35 ? 11.705 -16.872 24.657 1.00 98.16 35 A 1 ATOM 280 C CG . LEU A 1 35 ? 13.093 -17.444 24.305 1.00 94.23 35 A 1 ATOM 281 C CD1 . LEU A 1 35 ? 13.025 -18.972 24.293 1.00 87.94 35 A 1 ATOM 282 C CD2 . LEU A 1 35 ? 13.580 -16.978 22.930 1.00 89.30 35 A 1 ATOM 283 N N . TYR A 1 36 ? 9.446 -15.064 25.871 1.00 98.53 36 A 1 ATOM 284 C CA . TYR A 1 36 ? 8.063 -14.594 25.958 1.00 98.49 36 A 1 ATOM 285 C C . TYR A 1 36 ? 7.967 -13.064 25.881 1.00 98.51 36 A 1 ATOM 286 O O . TYR A 1 36 ? 7.124 -12.520 25.160 1.00 98.54 36 A 1 ATOM 287 C CB . TYR A 1 36 ? 7.447 -15.113 27.261 1.00 98.43 36 A 1 ATOM 288 C CG . TYR A 1 36 ? 6.029 -14.628 27.475 1.00 95.41 36 A 1 ATOM 289 C CD1 . TYR A 1 36 ? 5.777 -13.526 28.321 1.00 89.60 36 A 1 ATOM 290 C CD2 . TYR A 1 36 ? 4.967 -15.248 26.790 1.00 92.35 36 A 1 ATOM 291 C CE1 . TYR A 1 36 ? 4.462 -13.054 28.486 1.00 90.48 36 A 1 ATOM 292 C CE2 . TYR A 1 36 ? 3.652 -14.777 26.951 1.00 91.77 36 A 1 ATOM 293 C CZ . TYR A 1 36 ? 3.397 -13.679 27.801 1.00 90.81 36 A 1 ATOM 294 O OH . TYR A 1 36 ? 2.128 -13.222 27.956 1.00 88.66 36 A 1 ATOM 295 N N . GLU A 1 37 ? 8.840 -12.343 26.587 1.00 98.37 37 A 1 ATOM 296 C CA . GLU A 1 37 ? 8.893 -10.880 26.532 1.00 98.23 37 A 1 ATOM 297 C C . GLU A 1 37 ? 9.295 -10.372 25.140 1.00 98.24 37 A 1 ATOM 298 O O . GLU A 1 37 ? 8.740 -9.380 24.664 1.00 98.00 37 A 1 ATOM 299 C CB . GLU A 1 37 ? 9.878 -10.354 27.584 1.00 98.30 37 A 1 ATOM 300 C CG . GLU A 1 37 ? 9.323 -10.470 29.015 1.00 95.07 37 A 1 ATOM 301 C CD . GLU A 1 37 ? 10.306 -9.968 30.084 1.00 90.02 37 A 1 ATOM 302 O OE1 . GLU A 1 37 ? 10.020 -10.207 31.281 1.00 80.40 37 A 1 ATOM 303 O OE2 . GLU A 1 37 ? 11.303 -9.306 29.708 1.00 83.49 37 A 1 ATOM 304 N N . GLY A 1 38 ? 10.223 -11.057 24.465 1.00 98.40 38 A 1 ATOM 305 C CA . GLY A 1 38 ? 10.596 -10.780 23.079 1.00 98.11 38 A 1 ATOM 306 C C . GLY A 1 38 ? 9.427 -10.969 22.112 1.00 98.27 38 A 1 ATOM 307 O O . GLY A 1 38 ? 9.095 -10.047 21.360 1.00 98.00 38 A 1 ATOM 308 N N . GLU A 1 39 ? 8.743 -12.110 22.172 1.00 98.12 39 A 1 ATOM 309 C CA . GLU A 1 39 ? 7.565 -12.395 21.343 1.00 98.10 39 A 1 ATOM 310 C C . GLU A 1 39 ? 6.425 -11.405 21.594 1.00 98.13 39 A 1 ATOM 311 O O . GLU A 1 39 ? 5.785 -10.939 20.649 1.00 98.01 39 A 1 ATOM 312 C CB . GLU A 1 39 ? 7.049 -13.810 21.621 1.00 98.06 39 A 1 ATOM 313 C CG . GLU A 1 39 ? 7.940 -14.905 21.025 1.00 85.48 39 A 1 ATOM 314 C CD . GLU A 1 39 ? 7.355 -16.316 21.218 1.00 76.23 39 A 1 ATOM 315 O OE1 . GLU A 1 39 ? 7.953 -17.258 20.656 1.00 67.43 39 A 1 ATOM 316 O OE2 . GLU A 1 39 ? 6.286 -16.444 21.866 1.00 68.97 39 A 1 ATOM 317 N N . LYS A 1 40 ? 6.192 -11.036 22.861 1.00 98.45 40 A 1 ATOM 318 C CA . LYS A 1 40 ? 5.183 -10.041 23.232 1.00 98.37 40 A 1 ATOM 319 C C . LYS A 1 40 ? 5.468 -8.681 22.598 1.00 98.23 40 A 1 ATOM 320 O O . LYS A 1 40 ? 4.546 -8.070 22.065 1.00 98.03 40 A 1 ATOM 321 C CB . LYS A 1 40 ? 5.098 -9.959 24.759 1.00 98.28 40 A 1 ATOM 322 C CG . LYS A 1 40 ? 3.993 -8.999 25.215 1.00 95.44 40 A 1 ATOM 323 C CD . LYS A 1 40 ? 3.937 -8.946 26.744 1.00 91.21 40 A 1 ATOM 324 C CE . LYS A 1 40 ? 2.871 -7.940 27.172 1.00 84.06 40 A 1 ATOM 325 N NZ . LYS A 1 40 ? 2.827 -7.804 28.653 1.00 76.12 40 A 1 ATOM 326 N N . LYS A 1 41 ? 6.724 -8.216 22.617 1.00 98.10 41 A 1 ATOM 327 C CA . LYS A 1 41 ? 7.125 -6.954 21.969 1.00 97.44 41 A 1 ATOM 328 C C . LYS A 1 41 ? 6.910 -7.003 20.460 1.00 96.96 41 A 1 ATOM 329 O O . LYS A 1 41 ? 6.316 -6.084 19.905 1.00 96.23 41 A 1 ATOM 330 C CB . LYS A 1 41 ? 8.591 -6.639 22.279 1.00 97.35 41 A 1 ATOM 331 C CG . LYS A 1 41 ? 8.787 -6.132 23.712 1.00 87.87 41 A 1 ATOM 332 C CD . LYS A 1 41 ? 10.283 -5.981 24.009 1.00 83.87 41 A 1 ATOM 333 C CE . LYS A 1 41 ? 10.475 -5.556 25.466 1.00 73.25 41 A 1 ATOM 334 N NZ . LYS A 1 41 ? 11.910 -5.529 25.840 1.00 66.96 41 A 1 ATOM 335 N N . VAL A 1 42 ? 7.331 -8.088 19.803 1.00 97.21 42 A 1 ATOM 336 C CA . VAL A 1 42 ? 7.130 -8.271 18.357 1.00 96.26 42 A 1 ATOM 337 C C . VAL A 1 42 ? 5.644 -8.281 18.008 1.00 95.84 42 A 1 ATOM 338 O O . VAL A 1 42 ? 5.234 -7.637 17.044 1.00 95.34 42 A 1 ATOM 339 C CB . VAL A 1 42 ? 7.815 -9.565 17.876 1.00 96.11 42 A 1 ATOM 340 C CG1 . VAL A 1 42 ? 7.484 -9.896 16.411 1.00 94.69 42 A 1 ATOM 341 C CG2 . VAL A 1 42 ? 9.339 -9.445 17.981 1.00 94.61 42 A 1 ATOM 342 N N . ARG A 1 43 ? 4.815 -8.971 18.798 1.00 96.66 43 A 1 ATOM 343 C CA . ARG A 1 43 ? 3.362 -8.987 18.601 1.00 96.46 43 A 1 ATOM 344 C C . ARG A 1 43 ? 2.762 -7.585 18.710 1.00 95.50 43 A 1 ATOM 345 O O . ARG A 1 43 ? 2.019 -7.196 17.820 1.00 95.82 43 A 1 ATOM 346 C CB . ARG A 1 43 ? 2.713 -9.964 19.583 1.00 96.91 43 A 1 ATOM 347 C CG . ARG A 1 43 ? 1.194 -10.026 19.359 1.00 86.36 43 A 1 ATOM 348 C CD . ARG A 1 43 ? 0.495 -10.942 20.358 1.00 85.16 43 A 1 ATOM 349 N NE . ARG A 1 43 ? 0.875 -12.355 20.181 1.00 71.89 43 A 1 ATOM 350 C CZ . ARG A 1 43 ? 0.149 -13.402 20.531 1.00 67.06 43 A 1 ATOM 351 N NH1 . ARG A 1 43 ? -1.018 -13.265 21.108 1.00 60.04 43 A 1 ATOM 352 N NH2 . ARG A 1 43 ? 0.587 -14.609 20.302 1.00 55.62 43 A 1 ATOM 353 N N . GLN A 1 44 ? 3.118 -6.830 19.751 1.00 97.42 44 A 1 ATOM 354 C CA . GLN A 1 44 ? 2.637 -5.457 19.947 1.00 96.64 44 A 1 ATOM 355 C C . GLN A 1 44 ? 3.027 -4.540 18.784 1.00 95.55 44 A 1 ATOM 356 O O . GLN A 1 44 ? 2.193 -3.786 18.292 1.00 94.88 44 A 1 ATOM 357 C CB . GLN A 1 44 ? 3.196 -4.903 21.268 1.00 97.22 44 A 1 ATOM 358 C CG . GLN A 1 44 ? 2.473 -5.501 22.481 1.00 92.68 44 A 1 ATOM 359 C CD . GLN A 1 44 ? 3.049 -5.038 23.817 1.00 89.16 44 A 1 ATOM 360 O OE1 . GLN A 1 44 ? 4.214 -4.724 23.997 1.00 86.65 44 A 1 ATOM 361 N NE2 . GLN A 1 44 ? 2.233 -4.997 24.850 1.00 85.88 44 A 1 ATOM 362 N N . GLU A 1 45 ? 4.262 -4.641 18.288 1.00 95.26 45 A 1 ATOM 363 C CA . GLU A 1 45 ? 4.711 -3.865 17.125 1.00 92.95 45 A 1 ATOM 364 C C . GLU A 1 45 ? 3.922 -4.231 15.857 1.00 92.80 45 A 1 ATOM 365 O O . GLU A 1 45 ? 3.545 -3.362 15.067 1.00 91.68 45 A 1 ATOM 366 C CB . GLU A 1 45 ? 6.216 -4.102 16.911 1.00 91.68 45 A 1 ATOM 367 C CG . GLU A 1 45 ? 6.804 -3.164 15.845 1.00 78.90 45 A 1 ATOM 368 C CD . GLU A 1 45 ? 8.253 -3.487 15.456 1.00 74.19 45 A 1 ATOM 369 O OE1 . GLU A 1 45 ? 8.653 -3.025 14.357 1.00 65.73 45 A 1 ATOM 370 O OE2 . GLU A 1 45 ? 8.944 -4.208 16.206 1.00 68.17 45 A 1 ATOM 371 N N . ILE A 1 46 ? 3.647 -5.521 15.644 1.00 93.08 46 A 1 ATOM 372 C CA . ILE A 1 46 ? 2.845 -5.983 14.507 1.00 92.56 46 A 1 ATOM 373 C C . ILE A 1 46 ? 1.407 -5.470 14.614 1.00 92.99 46 A 1 ATOM 374 O O . ILE A 1 46 ? 0.884 -4.961 13.623 1.00 93.31 46 A 1 ATOM 375 C CB . ILE A 1 46 ? 2.922 -7.520 14.382 1.00 92.28 46 A 1 ATOM 376 C CG1 . ILE A 1 46 ? 4.330 -7.934 13.893 1.00 90.47 46 A 1 ATOM 377 C CG2 . ILE A 1 46 ? 1.855 -8.069 13.419 1.00 90.20 46 A 1 ATOM 378 C CD1 . ILE A 1 46 ? 4.598 -9.442 13.976 1.00 85.02 46 A 1 ATOM 379 N N . GLU A 1 47 ? 0.775 -5.574 15.787 1.00 93.31 47 A 1 ATOM 380 C CA . GLU A 1 47 ? -0.588 -5.084 16.041 1.00 94.11 47 A 1 ATOM 381 C C . GLU A 1 47 ? -0.691 -3.581 15.764 1.00 93.79 47 A 1 ATOM 382 O O . GLU A 1 47 ? -1.515 -3.168 14.946 1.00 93.67 47 A 1 ATOM 383 C CB . GLU A 1 47 ? -1.007 -5.432 17.484 1.00 95.36 47 A 1 ATOM 384 C CG . GLU A 1 47 ? -1.349 -6.928 17.634 1.00 89.37 47 A 1 ATOM 385 C CD . GLU A 1 47 ? -1.507 -7.421 19.088 1.00 86.89 47 A 1 ATOM 386 O OE1 . GLU A 1 47 ? -1.782 -8.638 19.255 1.00 81.51 47 A 1 ATOM 387 O OE2 . GLU A 1 47 ? -1.283 -6.641 20.039 1.00 83.52 47 A 1 ATOM 388 N N . GLU A 1 48 ? 0.219 -2.778 16.311 1.00 95.20 48 A 1 ATOM 389 C CA . GLU A 1 48 ? 0.286 -1.330 16.069 1.00 94.40 48 A 1 ATOM 390 C C . GLU A 1 48 ? 0.433 -0.997 14.578 1.00 93.87 48 A 1 ATOM 391 O O . GLU A 1 48 ? -0.250 -0.118 14.036 1.00 93.00 48 A 1 ATOM 392 C CB . GLU A 1 48 ? 1.470 -0.767 16.870 1.00 94.25 48 A 1 ATOM 393 C CG . GLU A 1 48 ? 1.611 0.748 16.698 1.00 89.20 48 A 1 ATOM 394 C CD . GLU A 1 48 ? 2.761 1.333 17.523 1.00 86.79 48 A 1 ATOM 395 O OE1 . GLU A 1 48 ? 2.642 2.520 17.885 1.00 78.18 48 A 1 ATOM 396 O OE2 . GLU A 1 48 ? 3.791 0.669 17.734 1.00 81.49 48 A 1 ATOM 397 N N . ARG A 1 49 ? 1.297 -1.718 13.858 1.00 93.82 49 A 1 ATOM 398 C CA . ARG A 1 49 ? 1.469 -1.522 12.413 1.00 92.63 49 A 1 ATOM 399 C C . ARG A 1 49 ? 0.213 -1.894 11.629 1.00 92.53 49 A 1 ATOM 400 O O . ARG A 1 49 ? -0.090 -1.224 10.643 1.00 92.30 49 A 1 ATOM 401 C CB . ARG A 1 49 ? 2.678 -2.319 11.919 1.00 92.08 49 A 1 ATOM 402 C CG . ARG A 1 49 ? 4.000 -1.671 12.364 1.00 86.28 49 A 1 ATOM 403 C CD . ARG A 1 49 ? 5.192 -2.546 11.991 1.00 84.95 49 A 1 ATOM 404 N NE . ARG A 1 49 ? 5.360 -2.617 10.524 1.00 77.62 49 A 1 ATOM 405 C CZ . ARG A 1 49 ? 5.919 -3.593 9.843 1.00 74.02 49 A 1 ATOM 406 N NH1 . ARG A 1 49 ? 6.457 -4.630 10.425 1.00 65.98 49 A 1 ATOM 407 N NH2 . ARG A 1 49 ? 5.934 -3.539 8.545 1.00 63.21 49 A 1 ATOM 408 N N . PHE A 1 50 ? -0.514 -2.937 12.030 1.00 92.11 50 A 1 ATOM 409 C CA . PHE A 1 50 ? -1.785 -3.297 11.399 1.00 91.71 50 A 1 ATOM 410 C C . PHE A 1 50 ? -2.856 -2.230 11.612 1.00 92.69 50 A 1 ATOM 411 O O . PHE A 1 50 ? -3.537 -1.872 10.648 1.00 93.27 50 A 1 ATOM 412 C CB . PHE A 1 50 ? -2.273 -4.663 11.903 1.00 90.95 50 A 1 ATOM 413 C CG . PHE A 1 50 ? -1.776 -5.836 11.082 1.00 83.97 50 A 1 ATOM 414 C CD1 . PHE A 1 50 ? -2.227 -5.998 9.761 1.00 77.15 50 A 1 ATOM 415 C CD2 . PHE A 1 50 ? -0.888 -6.773 11.631 1.00 75.95 50 A 1 ATOM 416 C CE1 . PHE A 1 50 ? -1.780 -7.084 8.989 1.00 71.90 50 A 1 ATOM 417 C CE2 . PHE A 1 50 ? -0.440 -7.860 10.864 1.00 71.36 50 A 1 ATOM 418 C CZ . PHE A 1 50 ? -0.884 -8.014 9.542 1.00 71.53 50 A 1 ATOM 419 N N . GLU A 1 51 ? -2.979 -1.686 12.822 1.00 92.71 51 A 1 ATOM 420 C CA . GLU A 1 51 ? -3.908 -0.591 13.121 1.00 93.41 51 A 1 ATOM 421 C C . GLU A 1 51 ? -3.610 0.641 12.260 1.00 93.41 51 A 1 ATOM 422 O O . GLU A 1 51 ? -4.492 1.143 11.559 1.00 93.30 51 A 1 ATOM 423 C CB . GLU A 1 51 ? -3.839 -0.240 14.612 1.00 94.29 51 A 1 ATOM 424 C CG . GLU A 1 51 ? -4.465 -1.336 15.489 1.00 87.52 51 A 1 ATOM 425 C CD . GLU A 1 51 ? -4.398 -1.030 16.997 1.00 81.21 51 A 1 ATOM 426 O OE1 . GLU A 1 51 ? -5.007 -1.815 17.756 1.00 72.49 51 A 1 ATOM 427 O OE2 . GLU A 1 51 ? -3.782 -0.008 17.376 1.00 74.20 51 A 1 ATOM 428 N N . LEU A 1 52 ? -2.344 1.060 12.197 1.00 93.14 52 A 1 ATOM 429 C CA . LEU A 1 52 ? -1.914 2.191 11.368 1.00 92.77 52 A 1 ATOM 430 C C . LEU A 1 52 ? -2.123 1.946 9.867 1.00 92.97 52 A 1 ATOM 431 O O . LEU A 1 52 ? -2.487 2.863 9.129 1.00 92.95 52 A 1 ATOM 432 C CB . LEU A 1 52 ? -0.435 2.477 11.649 1.00 93.44 52 A 1 ATOM 433 C CG . LEU A 1 52 ? -0.154 3.079 13.036 1.00 92.36 52 A 1 ATOM 434 C CD1 . LEU A 1 52 ? 1.351 3.045 13.292 1.00 88.75 52 A 1 ATOM 435 C CD2 . LEU A 1 52 ? -0.622 4.533 13.129 1.00 89.19 52 A 1 ATOM 436 N N . LEU A 1 53 ? -1.912 0.721 9.375 1.00 92.67 53 A 1 ATOM 437 C CA . LEU A 1 53 ? -2.200 0.365 7.980 1.00 91.63 53 A 1 ATOM 438 C C . LEU A 1 53 ? -3.693 0.450 7.669 1.00 91.76 53 A 1 ATOM 439 O O . LEU A 1 53 ? -4.070 0.939 6.602 1.00 91.98 53 A 1 ATOM 440 C CB . LEU A 1 53 ? -1.687 -1.053 7.678 1.00 90.90 53 A 1 ATOM 441 C CG . LEU A 1 53 ? -0.181 -1.136 7.390 1.00 83.77 53 A 1 ATOM 442 C CD1 . LEU A 1 53 ? 0.264 -2.600 7.371 1.00 78.63 53 A 1 ATOM 443 C CD2 . LEU A 1 53 ? 0.163 -0.533 6.026 1.00 78.51 53 A 1 ATOM 444 N N . PHE A 1 54 ? -4.539 -0.009 8.588 1.00 92.12 54 A 1 ATOM 445 C CA . PHE A 1 54 ? -5.988 0.062 8.442 1.00 92.17 54 A 1 ATOM 446 C C . PHE A 1 54 ? -6.479 1.512 8.439 1.00 92.38 54 A 1 ATOM 447 O O . PHE A 1 54 ? -7.267 1.900 7.571 1.00 92.58 54 A 1 ATOM 448 C CB . PHE A 1 54 ? -6.644 -0.759 9.558 1.00 91.91 54 A 1 ATOM 449 C CG . PHE A 1 54 ? -8.140 -0.868 9.399 1.00 84.90 54 A 1 ATOM 450 C CD1 . PHE A 1 54 ? -8.999 -0.012 10.112 1.00 77.89 54 A 1 ATOM 451 C CD2 . PHE A 1 54 ? -8.680 -1.815 8.509 1.00 77.95 54 A 1 ATOM 452 C CE1 . PHE A 1 54 ? -10.390 -0.108 9.938 1.00 74.94 54 A 1 ATOM 453 C CE2 . PHE A 1 54 ? -10.069 -1.909 8.333 1.00 75.92 54 A 1 ATOM 454 C CZ . PHE A 1 54 ? -10.926 -1.054 9.051 1.00 74.84 54 A 1 ATOM 455 N N . GLU A 1 55 ? -5.963 2.337 9.345 1.00 91.69 55 A 1 ATOM 456 C CA . GLU A 1 55 ? -6.227 3.775 9.387 1.00 91.84 55 A 1 ATOM 457 C C . GLU A 1 55 ? -5.815 4.456 8.075 1.00 91.55 55 A 1 ATOM 458 O O . GLU A 1 55 ? -6.644 5.097 7.418 1.00 90.86 55 A 1 ATOM 459 C CB . GLU A 1 55 ? -5.496 4.381 10.592 1.00 92.74 55 A 1 ATOM 460 C CG . GLU A 1 55 ? -5.819 5.872 10.747 1.00 85.44 55 A 1 ATOM 461 C CD . GLU A 1 55 ? -5.099 6.531 11.931 1.00 83.39 55 A 1 ATOM 462 O OE1 . GLU A 1 55 ? -5.365 7.739 12.128 1.00 73.67 55 A 1 ATOM 463 O OE2 . GLU A 1 55 ? -4.300 5.847 12.605 1.00 76.64 55 A 1 ATOM 464 N N . LEU A 1 56 ? -4.571 4.248 7.632 1.00 91.95 56 A 1 ATOM 465 C CA . LEU A 1 56 ? -4.051 4.808 6.386 1.00 90.85 56 A 1 ATOM 466 C C . LEU A 1 56 ? -4.903 4.398 5.181 1.00 90.18 56 A 1 ATOM 467 O O . LEU A 1 56 ? -5.226 5.244 4.344 1.00 90.17 56 A 1 ATOM 468 C CB . LEU A 1 56 ? -2.584 4.378 6.213 1.00 91.40 56 A 1 ATOM 469 C CG . LEU A 1 56 ? -1.926 4.876 4.911 1.00 90.24 56 A 1 ATOM 470 C CD1 . LEU A 1 56 ? -1.936 6.398 4.774 1.00 84.57 56 A 1 ATOM 471 C CD2 . LEU A 1 56 ? -0.469 4.419 4.860 1.00 84.61 56 A 1 ATOM 472 N N . MET A 1 57 ? -5.318 3.139 5.094 1.00 91.94 57 A 1 ATOM 473 C CA . MET A 1 57 ? -6.195 2.658 4.022 1.00 90.46 57 A 1 ATOM 474 C C . MET A 1 57 ? -7.538 3.399 4.012 1.00 90.86 57 A 1 ATOM 475 O O . MET A 1 57 ? -8.005 3.822 2.951 1.00 90.18 57 A 1 ATOM 476 C CB . MET A 1 57 ? -6.387 1.144 4.178 1.00 88.78 57 A 1 ATOM 477 C CG . MET A 1 57 ? -7.204 0.542 3.032 1.00 81.05 57 A 1 ATOM 478 S SD . MET A 1 57 ? -7.386 -1.259 3.097 1.00 73.85 57 A 1 ATOM 479 C CE . MET A 1 57 ? -8.318 -1.452 4.641 1.00 63.52 57 A 1 ATOM 480 N N . GLY A 1 58 ? -8.138 3.624 5.188 1.00 91.29 58 A 1 ATOM 481 C CA . GLY A 1 58 ? -9.355 4.421 5.323 1.00 91.46 58 A 1 ATOM 482 C C . GLY A 1 58 ? -9.169 5.872 4.867 1.00 91.77 58 A 1 ATOM 483 O O . GLY A 1 58 ? -10.022 6.424 4.170 1.00 90.10 58 A 1 ATOM 484 N N . ILE A 1 59 ? -8.035 6.496 5.202 1.00 89.71 59 A 1 ATOM 485 C CA . ILE A 1 59 ? -7.703 7.855 4.743 1.00 89.19 59 A 1 ATOM 486 C C . ILE A 1 59 ? -7.506 7.876 3.223 1.00 88.56 59 A 1 ATOM 487 O O . ILE A 1 59 ? -8.084 8.722 2.540 1.00 87.27 59 A 1 ATOM 488 C CB . ILE A 1 59 ? -6.466 8.420 5.481 1.00 90.55 59 A 1 ATOM 489 C CG1 . ILE A 1 59 ? -6.669 8.481 7.012 1.00 89.88 59 A 1 ATOM 490 C CG2 . ILE A 1 59 ? -6.171 9.841 4.968 1.00 88.18 59 A 1 ATOM 491 C CD1 . ILE A 1 59 ? -5.360 8.634 7.789 1.00 86.12 59 A 1 ATOM 492 N N . MET A 1 60 ? -6.767 6.913 2.659 1.00 90.03 60 A 1 ATOM 493 C CA . MET A 1 60 ? -6.522 6.798 1.217 1.00 88.52 60 A 1 ATOM 494 C C . MET A 1 60 ? -7.819 6.654 0.414 1.00 88.09 60 A 1 ATOM 495 O O . MET A 1 60 ? -7.954 7.270 -0.644 1.00 86.39 60 A 1 ATOM 496 C CB . MET A 1 60 ? -5.603 5.597 0.933 1.00 87.60 60 A 1 ATOM 497 C CG . MET A 1 60 ? -4.155 5.846 1.355 1.00 85.52 60 A 1 ATOM 498 S SD . MET A 1 60 ? -3.041 4.430 1.106 1.00 82.71 60 A 1 ATOM 499 C CE . MET A 1 60 ? -2.888 4.446 -0.698 1.00 72.44 60 A 1 ATOM 500 N N . GLN A 1 61 ? -8.795 5.892 0.917 1.00 86.74 61 A 1 ATOM 501 C CA . GLN A 1 61 ? -10.109 5.762 0.278 1.00 85.94 61 A 1 ATOM 502 C C . GLN A 1 61 ? -10.869 7.096 0.238 1.00 84.99 61 A 1 ATOM 503 O O . GLN A 1 61 ? -11.492 7.416 -0.776 1.00 81.68 61 A 1 ATOM 504 C CB . GLN A 1 61 ? -10.942 4.705 1.016 1.00 86.10 61 A 1 ATOM 505 C CG . GLN A 1 61 ? -10.475 3.270 0.715 1.00 78.88 61 A 1 ATOM 506 C CD . GLN A 1 61 ? -11.245 2.230 1.527 1.00 75.17 61 A 1 ATOM 507 O OE1 . GLN A 1 61 ? -12.102 2.521 2.343 1.00 70.54 61 A 1 ATOM 508 N NE2 . GLN A 1 61 ? -10.978 0.957 1.317 1.00 66.15 61 A 1 ATOM 509 N N . ARG A 1 62 ? -10.804 7.893 1.321 1.00 83.96 62 A 1 ATOM 510 C CA . ARG A 1 62 ? -11.497 9.190 1.410 1.00 83.72 62 A 1 ATOM 511 C C . ARG A 1 62 ? -10.817 10.285 0.583 1.00 82.86 62 A 1 ATOM 512 O O . ARG A 1 62 ? -11.495 11.067 -0.081 1.00 79.59 62 A 1 ATOM 513 C CB . ARG A 1 62 ? -11.598 9.634 2.878 1.00 84.62 62 A 1 ATOM 514 C CG . ARG A 1 62 ? -12.499 8.720 3.728 1.00 80.59 62 A 1 ATOM 515 C CD . ARG A 1 62 ? -12.746 9.310 5.129 1.00 80.72 62 A 1 ATOM 516 N NE . ARG A 1 62 ? -11.509 9.549 5.899 1.00 73.51 62 A 1 ATOM 517 C CZ . ARG A 1 62 ? -10.937 8.748 6.780 1.00 68.83 62 A 1 ATOM 518 N NH1 . ARG A 1 62 ? -11.394 7.559 7.045 1.00 62.71 62 A 1 ATOM 519 N NH2 . ARG A 1 62 ? -9.878 9.136 7.437 1.00 61.22 62 A 1 ATOM 520 N N . THR A 1 63 ? -9.486 10.367 0.636 1.00 85.26 63 A 1 ATOM 521 C CA . THR A 1 63 ? -8.720 11.480 0.042 1.00 84.31 63 A 1 ATOM 522 C C . THR A 1 63 ? -8.237 11.183 -1.378 1.00 84.00 63 A 1 ATOM 523 O O . THR A 1 63 ? -7.998 12.102 -2.167 1.00 80.17 63 A 1 ATOM 524 C CB . THR A 1 63 ? -7.518 11.845 0.927 1.00 84.92 63 A 1 ATOM 525 O OG1 . THR A 1 63 ? -6.628 10.750 0.969 1.00 83.59 63 A 1 ATOM 526 C CG2 . THR A 1 63 ? -7.911 12.207 2.358 1.00 81.07 63 A 1 ATOM 527 N N . GLY A 1 64 ? -8.114 9.898 -1.745 1.00 80.67 64 A 1 ATOM 528 C CA . GLY A 1 64 ? -7.484 9.455 -2.990 1.00 79.64 64 A 1 ATOM 529 C C . GLY A 1 64 ? -5.955 9.563 -2.974 1.00 81.94 64 A 1 ATOM 530 O O . GLY A 1 64 ? -5.345 9.530 -4.044 1.00 78.53 64 A 1 ATOM 531 N N . TYR A 1 65 ? -5.345 9.697 -1.787 1.00 79.25 65 A 1 ATOM 532 C CA . TYR A 1 65 ? -3.893 9.659 -1.622 1.00 81.68 65 A 1 ATOM 533 C C . TYR A 1 65 ? -3.324 8.319 -2.100 1.00 81.23 65 A 1 ATOM 534 O O . TYR A 1 65 ? -3.908 7.260 -1.867 1.00 78.23 65 A 1 ATOM 535 C CB . TYR A 1 65 ? -3.529 9.905 -0.150 1.00 83.68 65 A 1 ATOM 536 C CG . TYR A 1 65 ? -2.041 9.814 0.157 1.00 84.23 65 A 1 ATOM 537 C CD1 . TYR A 1 65 ? -1.519 8.680 0.818 1.00 76.77 65 A 1 ATOM 538 C CD2 . TYR A 1 65 ? -1.177 10.855 -0.224 1.00 75.98 65 A 1 ATOM 539 C CE1 . TYR A 1 65 ? -0.142 8.599 1.106 1.00 74.81 65 A 1 ATOM 540 C CE2 . TYR A 1 65 ? 0.202 10.777 0.062 1.00 74.99 65 A 1 ATOM 541 C CZ . TYR A 1 65 ? 0.721 9.652 0.730 1.00 85.00 65 A 1 ATOM 542 O OH . TYR A 1 65 ? 2.052 9.579 1.016 1.00 84.71 65 A 1 ATOM 543 N N . THR A 1 66 ? -2.181 8.347 -2.768 1.00 82.92 66 A 1 ATOM 544 C CA . THR A 1 66 ? -1.470 7.153 -3.234 1.00 82.05 66 A 1 ATOM 545 C C . THR A 1 66 ? 0.015 7.271 -2.919 1.00 81.80 66 A 1 ATOM 546 O O . THR A 1 66 ? 0.571 8.370 -2.865 1.00 79.05 66 A 1 ATOM 547 C CB . THR A 1 66 ? -1.675 6.893 -4.735 1.00 79.28 66 A 1 ATOM 548 O OG1 . THR A 1 66 ? -1.278 8.001 -5.506 1.00 73.59 66 A 1 ATOM 549 C CG2 . THR A 1 66 ? -3.131 6.590 -5.093 1.00 72.24 66 A 1 ATOM 550 N N . THR A 1 67 ? 0.675 6.132 -2.705 1.00 81.29 67 A 1 ATOM 551 C CA . THR A 1 67 ? 2.117 6.070 -2.465 1.00 81.11 67 A 1 ATOM 552 C C . THR A 1 67 ? 2.718 4.866 -3.177 1.00 79.92 67 A 1 ATOM 553 O O . THR A 1 67 ? 2.073 3.831 -3.319 1.00 77.52 67 A 1 ATOM 554 C CB . THR A 1 67 ? 2.428 6.067 -0.958 1.00 81.40 67 A 1 ATOM 555 O OG1 . THR A 1 67 ? 3.829 6.067 -0.774 1.00 76.90 67 A 1 ATOM 556 C CG2 . THR A 1 67 ? 1.856 4.869 -0.198 1.00 77.57 67 A 1 ATOM 557 N N . SER A 1 68 ? 3.957 5.002 -3.635 1.00 75.89 68 A 1 ATOM 558 C CA . SER A 1 68 ? 4.744 3.906 -4.217 1.00 74.90 68 A 1 ATOM 559 C C . SER A 1 68 ? 5.562 3.135 -3.174 1.00 74.38 68 A 1 ATOM 560 O O . SER A 1 68 ? 6.217 2.151 -3.508 1.00 71.36 68 A 1 ATOM 561 C CB . SER A 1 68 ? 5.662 4.467 -5.307 1.00 73.58 68 A 1 ATOM 562 O OG . SER A 1 68 ? 6.489 5.488 -4.785 1.00 66.89 68 A 1 ATOM 563 N N . VAL A 1 69 ? 5.554 3.576 -1.912 1.00 79.29 69 A 1 ATOM 564 C CA . VAL A 1 69 ? 6.285 2.924 -0.822 1.00 79.27 69 A 1 ATOM 565 C C . VAL A 1 69 ? 5.599 1.605 -0.453 1.00 79.18 69 A 1 ATOM 566 O O . VAL A 1 69 ? 4.376 1.531 -0.357 1.00 77.27 69 A 1 ATOM 567 C CB . VAL A 1 69 ? 6.417 3.860 0.395 1.00 78.17 69 A 1 ATOM 568 C CG1 . VAL A 1 69 ? 7.130 3.188 1.576 1.00 70.96 69 A 1 ATOM 569 C CG2 . VAL A 1 69 ? 7.240 5.102 0.021 1.00 71.58 69 A 1 ATOM 570 N N . ALA A 1 70 ? 6.403 0.560 -0.218 1.00 79.64 70 A 1 ATOM 571 C CA . ALA A 1 70 ? 5.919 -0.727 0.274 1.00 78.91 70 A 1 ATOM 572 C C . ALA A 1 70 ? 5.494 -0.603 1.752 1.00 79.01 70 A 1 ATOM 573 O O . ALA A 1 70 ? 6.304 -0.776 2.660 1.00 75.86 70 A 1 ATOM 574 C CB . ALA A 1 70 ? 7.013 -1.780 0.041 1.00 77.16 70 A 1 ATOM 575 N N . LEU A 1 71 ? 4.217 -0.306 1.984 1.00 78.55 71 A 1 ATOM 576 C CA . LEU A 1 71 ? 3.650 -0.015 3.310 1.00 77.39 71 A 1 ATOM 577 C C . LEU A 1 71 ? 3.808 -1.165 4.318 1.00 78.44 71 A 1 ATOM 578 O O . LEU A 1 71 ? 3.904 -0.932 5.516 1.00 76.16 71 A 1 ATOM 579 C CB . LEU A 1 71 ? 2.160 0.349 3.155 1.00 77.46 71 A 1 ATOM 580 C CG . LEU A 1 71 ? 1.859 1.602 2.311 1.00 75.95 71 A 1 ATOM 581 C CD1 . LEU A 1 71 ? 0.347 1.809 2.219 1.00 73.16 71 A 1 ATOM 582 C CD2 . LEU A 1 71 ? 2.486 2.862 2.904 1.00 72.49 71 A 1 ATOM 583 N N . ASN A 1 72 ? 3.893 -2.406 3.850 1.00 77.78 72 A 1 ATOM 584 C CA . ASN A 1 72 ? 4.109 -3.582 4.699 1.00 75.22 72 A 1 ATOM 585 C C . ASN A 1 72 ? 5.538 -3.686 5.274 1.00 75.76 72 A 1 ATOM 586 O O . ASN A 1 72 ? 5.774 -4.490 6.175 1.00 72.96 72 A 1 ATOM 587 C CB . ASN A 1 72 ? 3.735 -4.843 3.896 1.00 72.92 72 A 1 ATOM 588 C CG . ASN A 1 72 ? 4.620 -5.105 2.685 1.00 69.21 72 A 1 ATOM 589 O OD1 . ASN A 1 72 ? 5.229 -4.218 2.104 1.00 63.71 72 A 1 ATOM 590 N ND2 . ASN A 1 72 ? 4.708 -6.336 2.244 1.00 63.52 72 A 1 ATOM 591 N N . ARG A 1 73 ? 6.492 -2.902 4.754 1.00 79.01 73 A 1 ATOM 592 C CA . ARG A 1 73 ? 7.911 -2.933 5.155 1.00 79.60 73 A 1 ATOM 593 C C . ARG A 1 73 ? 8.358 -1.712 5.953 1.00 80.44 73 A 1 ATOM 594 O O . ARG A 1 73 ? 9.495 -1.698 6.414 1.00 76.68 73 A 1 ATOM 595 C CB . ARG A 1 73 ? 8.804 -3.104 3.917 1.00 78.34 73 A 1 ATOM 596 C CG . ARG A 1 73 ? 8.551 -4.428 3.191 1.00 72.32 73 A 1 ATOM 597 C CD . ARG A 1 73 ? 9.567 -4.600 2.058 1.00 70.07 73 A 1 ATOM 598 N NE . ARG A 1 73 ? 9.357 -5.873 1.345 1.00 62.46 73 A 1 ATOM 599 C CZ . ARG A 1 73 ? 10.126 -6.364 0.385 1.00 54.93 73 A 1 ATOM 600 N NH1 . ARG A 1 73 ? 11.182 -5.731 -0.048 1.00 50.20 73 A 1 ATOM 601 N NH2 . ARG A 1 73 ? 9.840 -7.514 -0.160 1.00 46.49 73 A 1 ATOM 602 N N . ILE A 1 74 ? 7.513 -0.701 6.085 1.00 86.46 74 A 1 ATOM 603 C CA . ILE A 1 74 ? 7.857 0.506 6.843 1.00 87.99 74 A 1 ATOM 604 C C . ILE A 1 74 ? 7.527 0.332 8.330 1.00 89.02 74 A 1 ATOM 605 O O . ILE A 1 74 ? 6.696 -0.503 8.705 1.00 87.17 74 A 1 ATOM 606 C CB . ILE A 1 74 ? 7.261 1.785 6.213 1.00 87.20 74 A 1 ATOM 607 C CG1 . ILE A 1 74 ? 5.726 1.804 6.254 1.00 80.26 74 A 1 ATOM 608 C CG2 . ILE A 1 74 ? 7.793 1.939 4.781 1.00 78.89 74 A 1 ATOM 609 C CD1 . ILE A 1 74 ? 5.132 3.131 5.767 1.00 74.65 74 A 1 ATOM 610 N N . THR A 1 75 ? 8.206 1.119 9.173 1.00 89.62 75 A 1 ATOM 611 C CA . THR A 1 75 ? 8.003 1.156 10.624 1.00 90.09 75 A 1 ATOM 612 C C . THR A 1 75 ? 6.670 1.815 10.984 1.00 91.00 75 A 1 ATOM 613 O O . THR A 1 75 ? 6.072 2.512 10.154 1.00 90.83 75 A 1 ATOM 614 C CB . THR A 1 75 ? 9.157 1.908 11.310 1.00 89.36 75 A 1 ATOM 615 O OG1 . THR A 1 75 ? 9.257 3.217 10.793 1.00 85.88 75 A 1 ATOM 616 C CG2 . THR A 1 75 ? 10.508 1.228 11.072 1.00 84.03 75 A 1 ATOM 617 N N . ALA A 1 76 ? 6.226 1.644 12.230 1.00 90.89 76 A 1 ATOM 618 C CA . ALA A 1 76 ? 5.054 2.337 12.766 1.00 92.24 76 A 1 ATOM 619 C C . ALA A 1 76 ? 5.174 3.864 12.615 1.00 93.62 76 A 1 ATOM 620 O O . ALA A 1 76 ? 4.252 4.508 12.117 1.00 93.44 76 A 1 ATOM 621 C CB . ALA A 1 76 ? 4.881 1.919 14.230 1.00 92.13 76 A 1 ATOM 622 N N . ASP A 1 77 ? 6.337 4.445 12.906 1.00 91.84 77 A 1 ATOM 623 C CA . ASP A 1 77 ? 6.572 5.884 12.719 1.00 92.85 77 A 1 ATOM 624 C C . ASP A 1 77 ? 6.465 6.309 11.249 1.00 93.63 77 A 1 ATOM 625 O O . ASP A 1 77 ? 5.861 7.333 10.927 1.00 93.12 77 A 1 ATOM 626 C CB . ASP A 1 77 ? 7.947 6.262 13.278 1.00 92.65 77 A 1 ATOM 627 C CG . ASP A 1 77 ? 8.021 6.115 14.800 1.00 87.36 77 A 1 ATOM 628 O OD1 . ASP A 1 77 ? 6.960 6.248 15.463 1.00 80.47 77 A 1 ATOM 629 O OD2 . ASP A 1 77 ? 9.148 5.869 15.276 1.00 80.52 77 A 1 ATOM 630 N N . GLY A 1 78 ? 6.981 5.497 10.323 1.00 92.59 78 A 1 ATOM 631 C CA . GLY A 1 78 ? 6.810 5.725 8.892 1.00 92.35 78 A 1 ATOM 632 C C . GLY A 1 78 ? 5.342 5.684 8.455 1.00 93.30 78 A 1 ATOM 633 O O . GLY A 1 78 ? 4.930 6.495 7.621 1.00 92.40 78 A 1 ATOM 634 N N . LEU A 1 79 ? 4.538 4.774 9.022 1.00 91.61 79 A 1 ATOM 635 C CA . LEU A 1 79 ? 3.096 4.705 8.770 1.00 92.07 79 A 1 ATOM 636 C C . LEU A 1 79 ? 2.370 5.946 9.299 1.00 92.76 79 A 1 ATOM 637 O O . LEU A 1 79 ? 1.577 6.522 8.557 1.00 92.89 79 A 1 ATOM 638 C CB . LEU A 1 79 ? 2.505 3.419 9.373 1.00 92.46 79 A 1 ATOM 639 C CG . LEU A 1 79 ? 2.853 2.151 8.580 1.00 91.06 79 A 1 ATOM 640 C CD1 . LEU A 1 79 ? 2.518 0.900 9.388 1.00 86.15 79 A 1 ATOM 641 C CD2 . LEU A 1 79 ? 2.068 2.076 7.267 1.00 86.67 79 A 1 ATOM 642 N N . ARG A 1 80 ? 2.694 6.420 10.505 1.00 92.86 80 A 1 ATOM 643 C CA . ARG A 1 80 ? 2.134 7.666 11.061 1.00 92.96 80 A 1 ATOM 644 C C . ARG A 1 80 ? 2.408 8.870 10.159 1.00 92.92 80 A 1 ATOM 645 O O . ARG A 1 80 ? 1.507 9.659 9.890 1.00 92.55 80 A 1 ATOM 646 C CB . ARG A 1 80 ? 2.709 7.933 12.457 1.00 93.57 80 A 1 ATOM 647 C CG . ARG A 1 80 ? 2.227 6.938 13.525 1.00 90.53 80 A 1 ATOM 648 C CD . ARG A 1 80 ? 2.849 7.317 14.870 1.00 90.06 80 A 1 ATOM 649 N NE . ARG A 1 80 ? 2.619 6.302 15.905 1.00 84.78 80 A 1 ATOM 650 C CZ . ARG A 1 80 ? 3.545 5.624 16.557 1.00 81.70 80 A 1 ATOM 651 N NH1 . ARG A 1 80 ? 4.823 5.729 16.328 1.00 71.63 80 A 1 ATOM 652 N NH2 . ARG A 1 80 ? 3.202 4.813 17.492 1.00 74.09 80 A 1 ATOM 653 N N . GLU A 1 81 ? 3.617 8.991 9.620 1.00 93.11 81 A 1 ATOM 654 C CA . GLU A 1 81 ? 3.953 10.057 8.664 1.00 92.91 81 A 1 ATOM 655 C C . GLU A 1 81 ? 3.207 9.924 7.326 1.00 92.72 81 A 1 ATOM 656 O O . GLU A 1 81 ? 2.897 10.920 6.664 1.00 91.96 81 A 1 ATOM 657 C CB . GLU A 1 81 ? 5.474 10.075 8.425 1.00 93.29 81 A 1 ATOM 658 C CG . GLU A 1 81 ? 6.272 10.590 9.643 1.00 85.63 81 A 1 ATOM 659 C CD . GLU A 1 81 ? 5.816 11.990 10.059 1.00 78.49 81 A 1 ATOM 660 O OE1 . GLU A 1 81 ? 5.459 12.188 11.251 1.00 68.30 81 A 1 ATOM 661 O OE2 . GLU A 1 81 ? 5.732 12.857 9.169 1.00 69.14 81 A 1 ATOM 662 N N . HIS A 1 82 ? 2.893 8.707 6.894 1.00 92.67 82 A 1 ATOM 663 C CA . HIS A 1 82 ? 2.017 8.490 5.742 1.00 91.78 82 A 1 ATOM 664 C C . HIS A 1 82 ? 0.563 8.872 6.041 1.00 92.36 82 A 1 ATOM 665 O O . HIS A 1 82 ? -0.060 9.476 5.168 1.00 91.86 82 A 1 ATOM 666 C CB . HIS A 1 82 ? 2.139 7.051 5.226 1.00 91.18 82 A 1 ATOM 667 C CG . HIS A 1 82 ? 3.243 6.891 4.213 1.00 90.67 82 A 1 ATOM 668 N ND1 . HIS A 1 82 ? 3.156 7.240 2.885 1.00 81.19 82 A 1 ATOM 669 C CD2 . HIS A 1 82 ? 4.502 6.395 4.415 1.00 80.98 82 A 1 ATOM 670 C CE1 . HIS A 1 82 ? 4.339 6.956 2.303 1.00 83.47 82 A 1 ATOM 671 N NE2 . HIS A 1 82 ? 5.191 6.441 3.197 1.00 84.67 82 A 1 ATOM 672 N N . CYS A 1 83 ? 0.036 8.581 7.234 1.00 91.61 83 A 1 ATOM 673 C CA . CYS A 1 83 ? -1.303 9.009 7.656 1.00 91.69 83 A 1 ATOM 674 C C . CYS A 1 83 ? -1.434 10.537 7.620 1.00 91.84 83 A 1 ATOM 675 O O . CYS A 1 83 ? -2.312 11.049 6.925 1.00 92.27 83 A 1 ATOM 676 C CB . CYS A 1 83 ? -1.633 8.447 9.050 1.00 92.80 83 A 1 ATOM 677 S SG . CYS A 1 83 ? -1.833 6.642 8.959 1.00 91.64 83 A 1 ATOM 678 N N . LYS A 1 84 ? -0.501 11.275 8.237 1.00 92.16 84 A 1 ATOM 679 C CA . LYS A 1 84 ? -0.484 12.753 8.206 1.00 92.02 84 A 1 ATOM 680 C C . LYS A 1 84 ? -0.494 13.299 6.781 1.00 91.76 84 A 1 ATOM 681 O O . LYS A 1 84 ? -1.348 14.109 6.420 1.00 90.76 84 A 1 ATOM 682 C CB . LYS A 1 84 ? 0.762 13.281 8.928 1.00 92.45 84 A 1 ATOM 683 C CG . LYS A 1 84 ? 0.742 13.052 10.440 1.00 86.10 84 A 1 ATOM 684 C CD . LYS A 1 84 ? 2.085 13.519 11.002 1.00 82.99 84 A 1 ATOM 685 C CE . LYS A 1 84 ? 2.262 13.136 12.467 1.00 73.77 84 A 1 ATOM 686 N NZ . LYS A 1 84 ? 3.672 13.356 12.870 1.00 67.07 84 A 1 ATOM 687 N N . ARG A 1 85 ? 0.407 12.808 5.921 1.00 91.92 85 A 1 ATOM 688 C CA . ARG A 1 85 ? 0.465 13.226 4.509 1.00 90.97 85 A 1 ATOM 689 C C . ARG A 1 85 ? -0.804 12.882 3.733 1.00 91.22 85 A 1 ATOM 690 O O . ARG A 1 85 ? -1.173 13.615 2.823 1.00 89.64 85 A 1 ATOM 691 C CB . ARG A 1 85 ? 1.679 12.588 3.825 1.00 90.77 85 A 1 ATOM 692 C CG . ARG A 1 85 ? 2.979 13.287 4.237 1.00 86.17 85 A 1 ATOM 693 C CD . ARG A 1 85 ? 4.174 12.697 3.486 1.00 83.54 85 A 1 ATOM 694 N NE . ARG A 1 85 ? 4.495 11.333 3.944 1.00 74.77 85 A 1 ATOM 695 C CZ . ARG A 1 85 ? 5.373 10.513 3.400 1.00 69.38 85 A 1 ATOM 696 N NH1 . ARG A 1 85 ? 6.001 10.796 2.300 1.00 63.45 85 A 1 ATOM 697 N NH2 . ARG A 1 85 ? 5.644 9.377 3.976 1.00 60.26 85 A 1 ATOM 698 N N . ALA A 1 86 ? -1.446 11.758 4.052 1.00 89.68 86 A 1 ATOM 699 C CA . ALA A 1 86 ? -2.684 11.345 3.406 1.00 89.08 86 A 1 ATOM 700 C C . ALA A 1 86 ? -3.885 12.197 3.848 1.00 89.26 86 A 1 ATOM 701 O O . ALA A 1 86 ? -4.765 12.465 3.032 1.00 88.63 86 A 1 ATOM 702 C CB . ALA A 1 86 ? -2.901 9.852 3.679 1.00 88.80 86 A 1 ATOM 703 N N . GLU A 1 87 ? -3.925 12.656 5.105 1.00 88.76 87 A 1 ATOM 704 C CA . GLU A 1 87 ? -4.943 13.590 5.607 1.00 88.82 87 A 1 ATOM 705 C C . GLU A 1 87 ? -4.806 14.983 4.985 1.00 88.28 87 A 1 ATOM 706 O O . GLU A 1 87 ? -5.798 15.587 4.577 1.00 85.90 87 A 1 ATOM 707 C CB . GLU A 1 87 ? -4.843 13.693 7.130 1.00 88.71 87 A 1 ATOM 708 C CG . GLU A 1 87 ? -5.346 12.419 7.813 1.00 83.40 87 A 1 ATOM 709 C CD . GLU A 1 87 ? -5.289 12.497 9.342 1.00 79.75 87 A 1 ATOM 710 O OE1 . GLU A 1 87 ? -6.047 11.715 9.961 1.00 70.44 87 A 1 ATOM 711 O OE2 . GLU A 1 87 ? -4.546 13.348 9.874 1.00 71.19 87 A 1 ATOM 712 N N . GLU A 1 88 ? -3.575 15.470 4.842 1.00 91.41 88 A 1 ATOM 713 C CA . GLU A 1 88 ? -3.268 16.761 4.212 1.00 91.44 88 A 1 ATOM 714 C C . GLU A 1 88 ? -3.391 16.733 2.678 1.00 90.86 88 A 1 ATOM 715 O O . GLU A 1 88 ? -3.370 17.774 2.012 1.00 86.79 88 A 1 ATOM 716 C CB . GLU A 1 88 ? -1.850 17.185 4.621 1.00 91.08 88 A 1 ATOM 717 C CG . GLU A 1 88 ? -1.732 17.511 6.118 1.00 86.19 88 A 1 ATOM 718 C CD . GLU A 1 88 ? -0.285 17.819 6.554 1.00 82.57 88 A 1 ATOM 719 O OE1 . GLU A 1 88 ? -0.095 18.099 7.757 1.00 75.45 88 A 1 ATOM 720 O OE2 . GLU A 1 88 ? 0.630 17.785 5.692 1.00 76.70 88 A 1 ATOM 721 N N . TYR A 1 89 ? -3.523 15.534 2.080 1.00 88.30 89 A 1 ATOM 722 C CA . TYR A 1 89 ? -3.543 15.378 0.635 1.00 86.95 89 A 1 ATOM 723 C C . TYR A 1 89 ? -4.811 15.961 0.011 1.00 85.69 89 A 1 ATOM 724 O O . TYR A 1 89 ? -5.923 15.444 0.146 1.00 82.94 89 A 1 ATOM 725 C CB . TYR A 1 89 ? -3.358 13.911 0.248 1.00 86.31 89 A 1 ATOM 726 C CG . TYR A 1 89 ? -3.388 13.669 -1.249 1.00 84.10 89 A 1 ATOM 727 C CD1 . TYR A 1 89 ? -4.556 13.170 -1.855 1.00 78.26 89 A 1 ATOM 728 C CD2 . TYR A 1 89 ? -2.255 13.953 -2.033 1.00 78.05 89 A 1 ATOM 729 C CE1 . TYR A 1 89 ? -4.584 12.933 -3.239 1.00 75.80 89 A 1 ATOM 730 C CE2 . TYR A 1 89 ? -2.280 13.720 -3.421 1.00 76.22 89 A 1 ATOM 731 C CZ . TYR A 1 89 ? -3.444 13.202 -4.026 1.00 79.23 89 A 1 ATOM 732 O OH . TYR A 1 89 ? -3.472 12.952 -5.363 1.00 78.04 89 A 1 ATOM 733 N N . VAL A 1 90 ? -4.621 16.997 -0.788 1.00 80.66 90 A 1 ATOM 734 C CA . VAL A 1 90 ? -5.664 17.541 -1.658 1.00 79.44 90 A 1 ATOM 735 C C . VAL A 1 90 ? -5.485 16.955 -3.048 1.00 78.90 90 A 1 ATOM 736 O O . VAL A 1 90 ? -4.495 17.222 -3.732 1.00 75.34 90 A 1 ATOM 737 C CB . VAL A 1 90 ? -5.649 19.079 -1.679 1.00 77.05 90 A 1 ATOM 738 C CG1 . VAL A 1 90 ? -6.789 19.623 -2.550 1.00 68.57 90 A 1 ATOM 739 C CG2 . VAL A 1 90 ? -5.819 19.649 -0.267 1.00 72.20 90 A 1 ATOM 740 N N . ARG A 1 91 ? -6.468 16.158 -3.495 1.00 74.88 91 A 1 ATOM 741 C CA . ARG A 1 91 ? -6.455 15.565 -4.835 1.00 74.71 91 A 1 ATOM 742 C C . ARG A 1 91 ? -6.313 16.667 -5.891 1.00 73.70 91 A 1 ATOM 743 O O . ARG A 1 91 ? -7.173 17.555 -5.943 1.00 72.80 91 A 1 ATOM 744 C CB . ARG A 1 91 ? -7.723 14.732 -5.054 1.00 71.01 91 A 1 ATOM 745 C CG . ARG A 1 91 ? -7.616 13.858 -6.309 1.00 61.27 91 A 1 ATOM 746 C CD . ARG A 1 91 ? -8.856 12.969 -6.436 1.00 60.98 91 A 1 ATOM 747 N NE . ARG A 1 91 ? -8.648 11.890 -7.420 1.00 54.19 91 A 1 ATOM 748 C CZ . ARG A 1 91 ? -9.416 10.824 -7.579 1.00 48.68 91 A 1 ATOM 749 N NH1 . ARG A 1 91 ? -10.539 10.681 -6.923 1.00 46.40 91 A 1 ATOM 750 N NH2 . ARG A 1 91 ? -9.064 9.868 -8.391 1.00 43.32 91 A 1 ATOM 751 N N . PRO A 1 92 ? -5.289 16.621 -6.757 1.00 71.19 92 A 1 ATOM 752 C CA . PRO A 1 92 ? -5.174 17.574 -7.849 1.00 69.82 92 A 1 ATOM 753 C C . PRO A 1 92 ? -6.442 17.523 -8.697 1.00 68.87 92 A 1 ATOM 754 O O . PRO A 1 92 ? -6.890 16.445 -9.099 1.00 65.97 92 A 1 ATOM 755 C CB . PRO A 1 92 ? -3.929 17.174 -8.645 1.00 67.03 92 A 1 ATOM 756 C CG . PRO A 1 92 ? -3.101 16.377 -7.643 1.00 63.41 92 A 1 ATOM 757 C CD . PRO A 1 92 ? -4.160 15.714 -6.758 1.00 68.07 92 A 1 ATOM 758 N N . LYS A 1 93 ? -7.042 18.694 -8.971 1.00 68.48 93 A 1 ATOM 759 C CA . LYS A 1 93 ? -8.154 18.764 -9.922 1.00 68.04 93 A 1 ATOM 760 C C . LYS A 1 93 ? -7.628 18.257 -11.261 1.00 66.54 93 A 1 ATOM 761 O O . LYS A 1 93 ? -6.798 18.915 -11.887 1.00 60.72 93 A 1 ATOM 762 C CB . LYS A 1 93 ? -8.727 20.189 -10.020 1.00 64.61 93 A 1 ATOM 763 C CG . LYS A 1 93 ? -9.512 20.599 -8.765 1.00 57.79 93 A 1 ATOM 764 C CD . LYS A 1 93 ? -10.122 22.005 -8.911 1.00 55.33 93 A 1 ATOM 765 C CE . LYS A 1 93 ? -10.891 22.386 -7.637 1.00 48.76 93 A 1 ATOM 766 N NZ . LYS A 1 93 ? -11.426 23.773 -7.689 1.00 42.66 93 A 1 ATOM 767 N N . GLY A 1 94 ? -8.058 17.063 -11.657 1.00 56.19 94 A 1 ATOM 768 C CA . GLY A 1 94 ? -7.696 16.486 -12.943 1.00 56.42 94 A 1 ATOM 769 C C . GLY A 1 94 ? -8.012 17.481 -14.051 1.00 57.66 94 A 1 ATOM 770 O O . GLY A 1 94 ? -9.028 18.180 -13.992 1.00 55.30 94 A 1 ATOM 771 N N . ARG A 1 95 ? -7.133 17.572 -15.045 1.00 47.41 95 A 1 ATOM 772 C CA . ARG A 1 95 ? -7.318 18.421 -16.223 1.00 50.60 95 A 1 ATOM 773 C C . ARG A 1 95 ? -8.559 17.901 -16.961 1.00 52.00 95 A 1 ATOM 774 O O . ARG A 1 95 ? -8.463 16.964 -17.744 1.00 49.98 95 A 1 ATOM 775 C CB . ARG A 1 95 ? -6.021 18.404 -17.059 1.00 46.85 95 A 1 ATOM 776 C CG . ARG A 1 95 ? -5.854 19.612 -18.002 1.00 41.86 95 A 1 ATOM 777 C CD . ARG A 1 95 ? -4.515 19.506 -18.753 1.00 39.41 95 A 1 ATOM 778 N NE . ARG A 1 95 ? -4.172 20.732 -19.502 1.00 36.08 95 A 1 ATOM 779 C CZ . ARG A 1 95 ? -3.142 20.880 -20.327 1.00 32.13 95 A 1 ATOM 780 N NH1 . ARG A 1 95 ? -2.306 19.911 -20.581 1.00 30.50 95 A 1 ATOM 781 N NH2 . ARG A 1 95 ? -2.924 22.020 -20.923 1.00 29.37 95 A 1 ATOM 782 N N . ARG A 1 96 ? -9.737 18.433 -16.634 1.00 49.38 96 A 1 ATOM 783 C CA . ARG A 1 96 ? -10.969 18.127 -17.362 1.00 51.18 96 A 1 ATOM 784 C C . ARG A 1 96 ? -10.844 18.809 -18.719 1.00 51.96 96 A 1 ATOM 785 O O . ARG A 1 96 ? -10.945 20.027 -18.799 1.00 49.38 96 A 1 ATOM 786 C CB . ARG A 1 96 ? -12.223 18.594 -16.593 1.00 47.89 96 A 1 ATOM 787 C CG . ARG A 1 96 ? -12.531 17.723 -15.364 1.00 43.61 96 A 1 ATOM 788 C CD . ARG A 1 96 ? -13.857 18.157 -14.713 1.00 41.31 96 A 1 ATOM 789 N NE . ARG A 1 96 ? -14.218 17.298 -13.565 1.00 38.17 96 A 1 ATOM 790 C CZ . ARG A 1 96 ? -15.345 17.349 -12.871 1.00 33.09 96 A 1 ATOM 791 N NH1 . ARG A 1 96 ? -16.282 18.222 -13.130 1.00 32.55 96 A 1 ATOM 792 N NH2 . ARG A 1 96 ? -15.561 16.517 -11.891 1.00 30.95 96 A 1 ATOM 793 N N . SER A 1 97 ? -10.586 18.036 -19.756 1.00 50.86 97 A 1 ATOM 794 C CA . SER A 1 97 ? -10.788 18.503 -21.120 1.00 52.47 97 A 1 ATOM 795 C C . SER A 1 97 ? -12.294 18.561 -21.366 1.00 54.05 97 A 1 ATOM 796 O O . SER A 1 97 ? -12.885 17.601 -21.851 1.00 51.88 97 A 1 ATOM 797 C CB . SER A 1 97 ? -10.062 17.596 -22.119 1.00 49.11 97 A 1 ATOM 798 O OG . SER A 1 97 ? -10.474 16.251 -21.966 1.00 43.27 97 A 1 ATOM 799 N N . SER A 1 98 ? -12.937 19.653 -20.959 1.00 56.85 98 A 1 ATOM 800 C CA . SER A 1 98 ? -14.292 19.950 -21.412 1.00 58.13 98 A 1 ATOM 801 C C . SER A 1 98 ? -14.183 20.521 -22.821 1.00 59.49 98 A 1 ATOM 802 O O . SER A 1 98 ? -13.688 21.634 -22.999 1.00 58.39 98 A 1 ATOM 803 C CB . SER A 1 98 ? -15.003 20.917 -20.458 1.00 54.72 98 A 1 ATOM 804 O OG . SER A 1 98 ? -14.270 22.112 -20.302 1.00 48.11 98 A 1 ATOM 805 N N . ILE A 1 99 ? -14.589 19.738 -23.812 1.00 55.01 99 A 1 ATOM 806 C CA . ILE A 1 99 ? -14.804 20.249 -25.165 1.00 56.11 99 A 1 ATOM 807 C C . ILE A 1 99 ? -16.261 20.692 -25.213 1.00 56.41 99 A 1 ATOM 808 O O . ILE A 1 99 ? -17.155 19.884 -24.955 1.00 54.38 99 A 1 ATOM 809 C CB . ILE A 1 99 ? -14.447 19.195 -26.233 1.00 54.34 99 A 1 ATOM 810 C CG1 . ILE A 1 99 ? -12.953 18.799 -26.112 1.00 50.57 99 A 1 ATOM 811 C CG2 . ILE A 1 99 ? -14.752 19.737 -27.639 1.00 49.58 99 A 1 ATOM 812 C CD1 . ILE A 1 99 ? -12.513 17.676 -27.058 1.00 47.31 99 A 1 ATOM 813 N N . ASP A 1 100 ? -16.500 21.966 -25.499 1.00 56.99 100 A 1 ATOM 814 C CA . ASP A 1 100 ? -17.857 22.474 -25.642 1.00 58.39 100 A 1 ATOM 815 C C . ASP A 1 100 ? -18.568 21.750 -26.790 1.00 59.11 100 A 1 ATOM 816 O O . ASP A 1 100 ? -17.986 21.495 -27.849 1.00 57.42 100 A 1 ATOM 817 C CB . ASP A 1 100 ? -17.853 23.996 -25.870 1.00 55.88 100 A 1 ATOM 818 C CG . ASP A 1 100 ? -17.819 24.800 -24.569 1.00 51.62 100 A 1 ATOM 819 O OD1 . ASP A 1 100 ? -18.471 24.343 -23.603 1.00 48.96 100 A 1 ATOM 820 O OD2 . ASP A 1 100 ? -17.229 25.899 -24.581 1.00 47.74 100 A 1 ATOM 821 N N . ARG A 1 101 ? -19.865 21.435 -26.617 1.00 55.55 101 A 1 ATOM 822 C CA . ARG A 1 101 ? -20.667 20.723 -27.638 1.00 55.72 101 A 1 ATOM 823 C C . ARG A 1 101 ? -20.647 21.442 -28.998 1.00 56.03 101 A 1 ATOM 824 O O . ARG A 1 101 ? -20.745 20.805 -30.037 1.00 54.74 101 A 1 ATOM 825 C CB . ARG A 1 101 ? -22.097 20.527 -27.096 1.00 53.26 101 A 1 ATOM 826 C CG . ARG A 1 101 ? -22.870 19.384 -27.779 1.00 48.44 101 A 1 ATOM 827 C CD . ARG A 1 101 ? -24.224 19.156 -27.081 1.00 46.33 101 A 1 ATOM 828 N NE . ARG A 1 101 ? -24.941 17.958 -27.578 1.00 42.53 101 A 1 ATOM 829 C CZ . ARG A 1 101 ? -26.025 17.404 -27.039 1.00 38.61 101 A 1 ATOM 830 N NH1 . ARG A 1 101 ? -26.615 17.900 -25.987 1.00 37.17 101 A 1 ATOM 831 N NH2 . ARG A 1 101 ? -26.547 16.323 -27.542 1.00 36.19 101 A 1 ATOM 832 N N . LYS A 1 102 ? -20.423 22.761 -28.974 1.00 54.86 102 A 1 ATOM 833 C CA . LYS A 1 102 ? -20.249 23.616 -30.156 1.00 55.45 102 A 1 ATOM 834 C C . LYS A 1 102 ? -18.940 23.363 -30.914 1.00 55.41 102 A 1 ATOM 835 O O . LYS A 1 102 ? -18.864 23.740 -32.077 1.00 53.15 102 A 1 ATOM 836 C CB . LYS A 1 102 ? -20.311 25.093 -29.735 1.00 53.83 102 A 1 ATOM 837 C CG . LYS A 1 102 ? -21.674 25.487 -29.146 1.00 49.86 102 A 1 ATOM 838 C CD . LYS A 1 102 ? -21.681 26.974 -28.762 1.00 47.51 102 A 1 ATOM 839 C CE . LYS A 1 102 ? -23.029 27.353 -28.146 1.00 43.62 102 A 1 ATOM 840 N NZ . LYS A 1 102 ? -23.044 28.755 -27.667 1.00 38.67 102 A 1 ATOM 841 N N . ASP A 1 103 ? -17.951 22.739 -30.274 1.00 52.88 103 A 1 ATOM 842 C CA . ASP A 1 103 ? -16.656 22.404 -30.873 1.00 53.62 103 A 1 ATOM 843 C C . ASP A 1 103 ? -16.581 20.944 -31.354 1.00 54.37 103 A 1 ATOM 844 O O . ASP A 1 103 ? -15.583 20.542 -31.951 1.00 53.18 103 A 1 ATOM 845 C CB . ASP A 1 103 ? -15.526 22.758 -29.894 1.00 51.96 103 A 1 ATOM 846 C CG . ASP A 1 103 ? -15.355 24.271 -29.692 1.00 48.01 103 A 1 ATOM 847 O OD1 . ASP A 1 103 ? -15.493 25.030 -30.691 1.00 45.19 103 A 1 ATOM 848 O OD2 . ASP A 1 103 ? -15.012 24.665 -28.559 1.00 44.97 103 A 1 ATOM 849 N N . LEU A 1 104 ? -17.647 20.152 -31.144 1.00 54.63 104 A 1 ATOM 850 C CA . LEU A 1 104 ? -17.764 18.791 -31.659 1.00 54.89 104 A 1 ATOM 851 C C . LEU A 1 104 ? -18.204 18.800 -33.130 1.00 54.43 104 A 1 ATOM 852 O O . LEU A 1 104 ? -19.108 19.537 -33.530 1.00 53.19 104 A 1 ATOM 853 C CB . LEU A 1 104 ? -18.715 17.961 -30.782 1.00 52.96 104 A 1 ATOM 854 C CG . LEU A 1 104 ? -18.263 17.810 -29.313 1.00 48.98 104 A 1 ATOM 855 C CD1 . LEU A 1 104 ? -19.325 17.049 -28.525 1.00 47.14 104 A 1 ATOM 856 C CD2 . LEU A 1 104 ? -16.941 17.052 -29.185 1.00 45.86 104 A 1 ATOM 857 N N . VAL A 1 105 ? -17.566 17.944 -33.928 1.00 53.36 105 A 1 ATOM 858 C CA . VAL A 1 105 ? -17.940 17.665 -35.319 1.00 53.01 105 A 1 ATOM 859 C C . VAL A 1 105 ? -18.402 16.217 -35.383 1.00 53.33 105 A 1 ATOM 860 O O . VAL A 1 105 ? -17.698 15.325 -34.910 1.00 51.49 105 A 1 ATOM 861 C CB . VAL A 1 105 ? -16.770 17.942 -36.285 1.00 50.50 105 A 1 ATOM 862 C CG1 . VAL A 1 105 ? -17.177 17.670 -37.740 1.00 45.36 105 A 1 ATOM 863 C CG2 . VAL A 1 105 ? -16.307 19.405 -36.190 1.00 45.09 105 A 1 ATOM 864 N N . LEU A 1 106 ? -19.585 15.969 -35.941 1.00 54.64 106 A 1 ATOM 865 C CA . LEU A 1 106 ? -20.085 14.616 -36.149 1.00 55.24 106 A 1 ATOM 866 C C . LEU A 1 106 ? -19.301 13.967 -37.292 1.00 54.66 106 A 1 ATOM 867 O O . LEU A 1 106 ? -19.337 14.456 -38.419 1.00 53.53 106 A 1 ATOM 868 C CB . LEU A 1 106 ? -21.599 14.672 -36.432 1.00 53.15 106 A 1 ATOM 869 C CG . LEU A 1 106 ? -22.256 13.285 -36.588 1.00 49.21 106 A 1 ATOM 870 C CD1 . LEU A 1 106 ? -22.229 12.492 -35.282 1.00 47.08 106 A 1 ATOM 871 C CD2 . LEU A 1 106 ? -23.709 13.453 -37.021 1.00 45.62 106 A 1 ATOM 872 N N . VAL A 1 107 ? -18.579 12.884 -36.980 1.00 53.83 107 A 1 ATOM 873 C CA . VAL A 1 107 ? -17.769 12.146 -37.970 1.00 53.63 107 A 1 ATOM 874 C C . VAL A 1 107 ? -18.387 10.784 -38.283 1.00 53.49 107 A 1 ATOM 875 O O . VAL A 1 107 ? -18.270 10.284 -39.397 1.00 51.16 107 A 1 ATOM 876 C CB . VAL A 1 107 ? -16.312 11.997 -37.481 1.00 51.45 107 A 1 ATOM 877 C CG1 . VAL A 1 107 ? -15.412 11.328 -38.525 1.00 46.89 107 A 1 ATOM 878 C CG2 . VAL A 1 107 ? -15.677 13.356 -37.148 1.00 46.73 107 A 1 ATOM 879 N N . ALA A 1 108 ? -19.052 10.177 -37.297 1.00 49.92 108 A 1 ATOM 880 C CA . ALA A 1 108 ? -19.726 8.897 -37.441 1.00 49.97 108 A 1 ATOM 881 C C . ALA A 1 108 ? -20.871 8.775 -36.426 1.00 50.19 108 A 1 ATOM 882 O O . ALA A 1 108 ? -20.809 9.351 -35.339 1.00 48.87 108 A 1 ATOM 883 C CB . ALA A 1 108 ? -18.700 7.768 -37.257 1.00 47.95 108 A 1 ATOM 884 N N . TRP A 1 109 ? -21.884 7.969 -36.747 1.00 48.07 109 A 1 ATOM 885 C CA . TRP A 1 109 ? -22.945 7.567 -35.826 1.00 48.43 109 A 1 ATOM 886 C C . TRP A 1 109 ? -22.971 6.048 -35.665 1.00 48.10 109 A 1 ATOM 887 O O . TRP A 1 109 ? -22.533 5.303 -36.537 1.00 46.66 109 A 1 ATOM 888 C CB . TRP A 1 109 ? -24.298 8.120 -36.273 1.00 46.65 109 A 1 ATOM 889 C CG . TRP A 1 109 ? -24.805 7.581 -37.578 1.00 43.98 109 A 1 ATOM 890 C CD1 . TRP A 1 109 ? -25.563 6.475 -37.750 1.00 40.46 109 A 1 ATOM 891 C CD2 . TRP A 1 109 ? -24.592 8.121 -38.918 1.00 40.91 109 A 1 ATOM 892 N NE1 . TRP A 1 109 ? -25.834 6.290 -39.094 1.00 37.46 109 A 1 ATOM 893 C CE2 . TRP A 1 109 ? -25.257 7.279 -39.860 1.00 39.20 109 A 1 ATOM 894 C CE3 . TRP A 1 109 ? -23.910 9.242 -39.425 1.00 38.43 109 A 1 ATOM 895 C CZ2 . TRP A 1 109 ? -25.241 7.533 -41.239 1.00 37.91 109 A 1 ATOM 896 C CZ3 . TRP A 1 109 ? -23.886 9.509 -40.808 1.00 36.66 109 A 1 ATOM 897 C CH2 . TRP A 1 109 ? -24.545 8.658 -41.712 1.00 36.58 109 A 1 ATOM 898 N N . ARG A 1 110 ? -23.500 5.575 -34.539 1.00 46.18 110 A 1 ATOM 899 C CA . ARG A 1 110 ? -23.711 4.151 -34.277 1.00 46.44 110 A 1 ATOM 900 C C . ARG A 1 110 ? -25.184 3.806 -34.489 1.00 46.01 110 A 1 ATOM 901 O O . ARG A 1 110 ? -26.052 4.414 -33.885 1.00 45.54 110 A 1 ATOM 902 C CB . ARG A 1 110 ? -23.208 3.818 -32.867 1.00 44.33 110 A 1 ATOM 903 C CG . ARG A 1 110 ? -23.126 2.304 -32.633 1.00 40.25 110 A 1 ATOM 904 C CD . ARG A 1 110 ? -22.594 2.035 -31.224 1.00 38.03 110 A 1 ATOM 905 N NE . ARG A 1 110 ? -22.443 0.590 -30.971 1.00 35.85 110 A 1 ATOM 906 C CZ . ARG A 1 110 ? -22.129 0.036 -29.815 1.00 31.97 110 A 1 ATOM 907 N NH1 . ARG A 1 110 ? -21.908 0.749 -28.745 1.00 31.91 110 A 1 ATOM 908 N NH2 . ARG A 1 110 ? -22.029 -1.259 -29.713 1.00 30.51 110 A 1 ATOM 909 N N . ALA A 1 111 ? -25.458 2.812 -35.321 1.00 47.14 111 A 1 ATOM 910 C CA . ALA A 1 111 ? -26.791 2.248 -35.503 1.00 48.39 111 A 1 ATOM 911 C C . ALA A 1 111 ? -26.679 0.731 -35.694 1.00 48.05 111 A 1 ATOM 912 O O . ALA A 1 111 ? -25.740 0.249 -36.326 1.00 45.56 111 A 1 ATOM 913 C CB . ALA A 1 111 ? -27.488 2.934 -36.687 1.00 46.43 111 A 1 ATOM 914 N N . ASN A 1 112 ? -27.611 -0.038 -35.126 1.00 45.29 112 A 1 ATOM 915 C CA . ASN A 1 112 ? -27.649 -1.503 -35.235 1.00 47.16 112 A 1 ATOM 916 C C . ASN A 1 112 ? -26.315 -2.197 -34.877 1.00 47.64 112 A 1 ATOM 917 O O . ASN A 1 112 ? -25.909 -3.165 -35.514 1.00 44.94 112 A 1 ATOM 918 C CB . ASN A 1 112 ? -28.192 -1.893 -36.629 1.00 44.86 112 A 1 ATOM 919 C CG . ASN A 1 112 ? -29.570 -1.326 -36.899 1.00 40.70 112 A 1 ATOM 920 O OD1 . ASN A 1 112 ? -30.331 -1.016 -35.999 1.00 39.02 112 A 1 ATOM 921 N ND2 . ASN A 1 112 ? -29.934 -1.154 -38.147 1.00 37.94 112 A 1 ATOM 922 N N . GLY A 1 113 ? -25.589 -1.672 -33.869 1.00 48.99 113 A 1 ATOM 923 C CA . GLY A 1 113 ? -24.306 -2.222 -33.413 1.00 50.43 113 A 1 ATOM 924 C C . GLY A 1 113 ? -23.091 -1.906 -34.301 1.00 51.69 113 A 1 ATOM 925 O O . GLY A 1 113 ? -21.972 -2.241 -33.916 1.00 49.54 113 A 1 ATOM 926 N N . SER A 1 114 ? -23.278 -1.222 -35.435 1.00 45.20 114 A 1 ATOM 927 C CA . SER A 1 114 ? -22.228 -0.853 -36.391 1.00 47.99 114 A 1 ATOM 928 C C . SER A 1 114 ? -21.985 0.660 -36.410 1.00 48.73 114 A 1 ATOM 929 O O . SER A 1 114 ? -22.869 1.445 -36.074 1.00 47.56 114 A 1 ATOM 930 C CB . SER A 1 114 ? -22.587 -1.360 -37.787 1.00 46.34 114 A 1 ATOM 931 O OG . SER A 1 114 ? -22.606 -2.776 -37.787 1.00 41.77 114 A 1 ATOM 932 N N . TYR A 1 115 ? -20.779 1.068 -36.800 1.00 46.53 115 A 1 ATOM 933 C CA . TYR A 1 115 ? -20.428 2.475 -36.991 1.00 47.81 115 A 1 ATOM 934 C C . TYR A 1 115 ? -20.588 2.866 -38.459 1.00 48.63 115 A 1 ATOM 935 O O . TYR A 1 115 ? -20.050 2.202 -39.345 1.00 47.38 115 A 1 ATOM 936 C CB . TYR A 1 115 ? -19.007 2.754 -36.495 1.00 46.06 115 A 1 ATOM 937 C CG . TYR A 1 115 ? -18.858 2.662 -34.986 1.00 42.38 115 A 1 ATOM 938 C CD1 . TYR A 1 115 ? -19.168 3.775 -34.180 1.00 39.30 115 A 1 ATOM 939 C CD2 . TYR A 1 115 ? -18.418 1.464 -34.387 1.00 38.48 115 A 1 ATOM 940 C CE1 . TYR A 1 115 ? -19.032 3.696 -32.780 1.00 34.80 115 A 1 ATOM 941 C CE2 . TYR A 1 115 ? -18.286 1.379 -32.984 1.00 35.72 115 A 1 ATOM 942 C CZ . TYR A 1 115 ? -18.588 2.500 -32.180 1.00 34.74 115 A 1 ATOM 943 O OH . TYR A 1 115 ? -18.456 2.423 -30.831 1.00 35.01 115 A 1 ATOM 944 N N . TYR A 1 116 ? -21.283 3.964 -38.693 1.00 46.65 116 A 1 ATOM 945 C CA . TYR A 1 116 ? -21.511 4.535 -40.012 1.00 47.54 116 A 1 ATOM 946 C C . TYR A 1 116 ? -20.801 5.881 -40.094 1.00 47.34 116 A 1 ATOM 947 O O . TYR A 1 116 ? -20.976 6.722 -39.217 1.00 45.34 116 A 1 ATOM 948 C CB . TYR A 1 116 ? -23.015 4.677 -40.254 1.00 44.98 116 A 1 ATOM 949 C CG . TYR A 1 116 ? -23.744 3.345 -40.290 1.00 41.70 116 A 1 ATOM 950 C CD1 . TYR A 1 116 ? -23.885 2.649 -41.508 1.00 39.91 116 A 1 ATOM 951 C CD2 . TYR A 1 116 ? -24.253 2.786 -39.101 1.00 38.80 116 A 1 ATOM 952 C CE1 . TYR A 1 116 ? -24.542 1.403 -41.538 1.00 35.39 116 A 1 ATOM 953 C CE2 . TYR A 1 116 ? -24.903 1.537 -39.128 1.00 36.87 116 A 1 ATOM 954 C CZ . TYR A 1 116 ? -25.053 0.846 -40.348 1.00 35.65 116 A 1 ATOM 955 O OH . TYR A 1 116 ? -25.686 -0.356 -40.375 1.00 36.59 116 A 1 ATOM 956 N N . SER A 1 117 ? -19.976 6.081 -41.109 1.00 49.11 117 A 1 ATOM 957 C CA . SER A 1 117 ? -19.299 7.362 -41.338 1.00 50.00 117 A 1 ATOM 958 C C . SER A 1 117 ? -20.299 8.406 -41.820 1.00 50.72 117 A 1 ATOM 959 O O . SER A 1 117 ? -21.135 8.107 -42.676 1.00 48.76 117 A 1 ATOM 960 C CB . SER A 1 117 ? -18.167 7.191 -42.349 1.00 47.32 117 A 1 ATOM 961 O OG . SER A 1 117 ? -17.456 8.397 -42.522 1.00 43.49 117 A 1 ATOM 962 N N . ASP A 1 118 ? -20.208 9.632 -41.304 1.00 49.18 118 A 1 ATOM 963 C CA . ASP A 1 118 ? -20.942 10.771 -41.841 1.00 50.51 118 A 1 ATOM 964 C C . ASP A 1 118 ? -20.265 11.231 -43.138 1.00 50.13 118 A 1 ATOM 965 O O . ASP A 1 118 ? -19.278 11.964 -43.138 1.00 48.25 118 A 1 ATOM 966 C CB . ASP A 1 118 ? -21.068 11.894 -40.801 1.00 48.61 118 A 1 ATOM 967 C CG . ASP A 1 118 ? -22.087 12.958 -41.214 1.00 45.88 118 A 1 ATOM 968 O OD1 . ASP A 1 118 ? -22.666 12.855 -42.321 1.00 43.74 118 A 1 ATOM 969 O OD2 . ASP A 1 118 ? -22.335 13.886 -40.409 1.00 42.41 118 A 1 ATOM 970 N N . CYS A 1 119 ? -20.802 10.740 -44.266 1.00 49.72 119 A 1 ATOM 971 C CA . CYS A 1 119 ? -20.295 11.069 -45.602 1.00 49.40 119 A 1 ATOM 972 C C . CYS A 1 119 ? -20.929 12.336 -46.195 1.00 50.35 119 A 1 ATOM 973 O O . CYS A 1 119 ? -20.723 12.627 -47.373 1.00 46.76 119 A 1 ATOM 974 C CB . CYS A 1 119 ? -20.481 9.859 -46.527 1.00 44.95 119 A 1 ATOM 975 S SG . CYS A 1 119 ? -19.482 8.455 -45.966 1.00 39.36 119 A 1 ATOM 976 N N . ARG A 1 120 ? -21.718 13.092 -45.412 1.00 54.70 120 A 1 ATOM 977 C CA . ARG A 1 120 ? -22.293 14.350 -45.901 1.00 56.06 120 A 1 ATOM 978 C C . ARG A 1 120 ? -21.196 15.404 -46.087 1.00 56.21 120 A 1 ATOM 979 O O . ARG A 1 120 ? -20.232 15.450 -45.320 1.00 53.88 120 A 1 ATOM 980 C CB . ARG A 1 120 ? -23.445 14.810 -44.996 1.00 53.81 120 A 1 ATOM 981 C CG . ARG A 1 120 ? -22.978 15.487 -43.702 1.00 49.34 120 A 1 ATOM 982 C CD . ARG A 1 120 ? -24.101 15.648 -42.686 1.00 46.65 120 A 1 ATOM 983 N NE . ARG A 1 120 ? -23.590 16.262 -41.452 1.00 43.41 120 A 1 ATOM 984 C CZ . ARG A 1 120 ? -24.244 17.019 -40.599 1.00 38.75 120 A 1 ATOM 985 N NH1 . ARG A 1 120 ? -25.520 17.242 -40.702 1.00 38.02 120 A 1 ATOM 986 N NH2 . ARG A 1 120 ? -23.606 17.594 -39.627 1.00 36.18 120 A 1 ATOM 987 N N . PRO A 1 121 ? -21.330 16.290 -47.062 1.00 56.89 121 A 1 ATOM 988 C CA . PRO A 1 121 ? -20.435 17.436 -47.176 1.00 57.20 121 A 1 ATOM 989 C C . PRO A 1 121 ? -20.517 18.303 -45.917 1.00 58.90 121 A 1 ATOM 990 O O . PRO A 1 121 ? -21.600 18.735 -45.524 1.00 57.45 121 A 1 ATOM 991 C CB . PRO A 1 121 ? -20.885 18.198 -48.429 1.00 54.46 121 A 1 ATOM 992 C CG . PRO A 1 121 ? -21.675 17.167 -49.236 1.00 51.62 121 A 1 ATOM 993 C CD . PRO A 1 121 ? -22.296 16.284 -48.158 1.00 55.13 121 A 1 ATOM 994 N N . LEU A 1 122 ? -19.365 18.567 -45.284 1.00 58.18 122 A 1 ATOM 995 C CA . LEU A 1 122 ? -19.301 19.432 -44.110 1.00 59.40 122 A 1 ATOM 996 C C . LEU A 1 122 ? -19.671 20.872 -44.485 1.00 59.39 122 A 1 ATOM 997 O O . LEU A 1 122 ? -19.157 21.429 -45.463 1.00 57.53 122 A 1 ATOM 998 C CB . LEU A 1 122 ? -17.902 19.367 -43.475 1.00 57.45 122 A 1 ATOM 999 C CG . LEU A 1 122 ? -17.515 17.997 -42.884 1.00 54.57 122 A 1 ATOM 1000 C CD1 . LEU A 1 122 ? -16.056 18.026 -42.427 1.00 52.73 122 A 1 ATOM 1001 C CD2 . LEU A 1 122 ? -18.374 17.613 -41.682 1.00 51.81 122 A 1 ATOM 1002 N N . GLY A 1 123 ? -20.523 21.479 -43.666 1.00 63.25 123 A 1 ATOM 1003 C CA . GLY A 1 123 ? -20.854 22.893 -43.792 1.00 64.24 123 A 1 ATOM 1004 C C . GLY A 1 123 ? -19.646 23.798 -43.517 1.00 65.82 123 A 1 ATOM 1005 O O . GLY A 1 123 ? -18.648 23.393 -42.919 1.00 64.56 123 A 1 ATOM 1006 N N . LYS A 1 124 ? -19.735 25.076 -43.915 1.00 69.27 124 A 1 ATOM 1007 C CA . LYS A 1 124 ? -18.642 26.059 -43.755 1.00 70.28 124 A 1 ATOM 1008 C C . LYS A 1 124 ? -18.170 26.188 -42.298 1.00 69.63 124 A 1 ATOM 1009 O O . LYS A 1 124 ? -16.969 26.229 -42.038 1.00 67.09 124 A 1 ATOM 1010 C CB . LYS A 1 124 ? -19.116 27.407 -44.332 1.00 70.54 124 A 1 ATOM 1011 C CG . LYS A 1 124 ? -17.982 28.438 -44.459 1.00 65.43 124 A 1 ATOM 1012 C CD . LYS A 1 124 ? -18.514 29.738 -45.075 1.00 62.88 124 A 1 ATOM 1013 C CE . LYS A 1 124 ? -17.397 30.774 -45.209 1.00 55.94 124 A 1 ATOM 1014 N NZ . LYS A 1 124 ? -17.908 32.056 -45.771 1.00 49.44 124 A 1 ATOM 1015 N N . ASP A 1 125 ? -19.106 26.156 -41.334 1.00 69.59 125 A 1 ATOM 1016 C CA . ASP A 1 125 ? -18.818 26.259 -39.898 1.00 69.64 125 A 1 ATOM 1017 C C . ASP A 1 125 ? -18.250 24.959 -39.308 1.00 69.19 125 A 1 ATOM 1018 O O . ASP A 1 125 ? -17.452 24.993 -38.370 1.00 66.35 125 A 1 ATOM 1019 C CB . ASP A 1 125 ? -20.102 26.655 -39.156 1.00 68.94 125 A 1 ATOM 1020 C CG . ASP A 1 125 ? -20.633 28.031 -39.570 1.00 65.40 125 A 1 ATOM 1021 O OD1 . ASP A 1 125 ? -19.801 28.885 -39.963 1.00 60.90 125 A 1 ATOM 1022 O OD2 . ASP A 1 125 ? -21.864 28.205 -39.501 1.00 59.49 125 A 1 ATOM 1023 N N . GLU A 1 126 ? -18.645 23.793 -39.846 1.00 64.77 126 A 1 ATOM 1024 C CA . GLU A 1 126 ? -18.111 22.489 -39.460 1.00 64.61 126 A 1 ATOM 1025 C C . GLU A 1 126 ? -16.677 22.327 -39.965 1.00 64.83 126 A 1 ATOM 1026 O O . GLU A 1 126 ? -15.788 21.950 -39.197 1.00 63.57 126 A 1 ATOM 1027 C CB . GLU A 1 126 ? -19.013 21.368 -39.988 1.00 62.54 126 A 1 ATOM 1028 C CG . GLU A 1 126 ? -20.404 21.370 -39.340 1.00 56.70 126 A 1 ATOM 1029 C CD . GLU A 1 126 ? -21.330 20.311 -39.954 1.00 53.77 126 A 1 ATOM 1030 O OE1 . GLU A 1 126 ? -22.106 19.690 -39.195 1.00 51.56 126 A 1 ATOM 1031 O OE2 . GLU A 1 126 ? -21.292 20.152 -41.193 1.00 50.41 126 A 1 ATOM 1032 N N . MET A 1 127 ? -16.418 22.724 -41.199 1.00 63.99 127 A 1 ATOM 1033 C CA . MET A 1 127 ? -15.076 22.735 -41.778 1.00 63.91 127 A 1 ATOM 1034 C C . MET A 1 127 ? -14.127 23.652 -40.988 1.00 64.31 127 A 1 ATOM 1035 O O . MET A 1 127 ? -13.002 23.263 -40.675 1.00 63.23 127 A 1 ATOM 1036 C CB . MET A 1 127 ? -15.171 23.162 -43.253 1.00 62.30 127 A 1 ATOM 1037 C CG . MET A 1 127 ? -13.860 22.915 -43.999 1.00 57.28 127 A 1 ATOM 1038 S SD . MET A 1 127 ? -13.397 21.168 -44.188 1.00 53.87 127 A 1 ATOM 1039 C CE . MET A 1 127 ? -14.578 20.658 -45.466 1.00 49.76 127 A 1 ATOM 1040 N N . ALA A 1 128 ? -14.589 24.836 -40.579 1.00 67.71 128 A 1 ATOM 1041 C CA . ALA A 1 128 ? -13.817 25.758 -39.744 1.00 67.72 128 A 1 ATOM 1042 C C . ALA A 1 128 ? -13.509 25.184 -38.345 1.00 67.02 128 A 1 ATOM 1043 O O . ALA A 1 128 ? -12.460 25.482 -37.764 1.00 65.36 128 A 1 ATOM 1044 C CB . ALA A 1 128 ? -14.588 27.080 -39.649 1.00 67.58 128 A 1 ATOM 1045 N N . ARG A 1 129 ? -14.405 24.342 -37.785 1.00 66.66 129 A 1 ATOM 1046 C CA . ARG A 1 129 ? -14.169 23.608 -36.530 1.00 65.33 129 A 1 ATOM 1047 C C . ARG A 1 129 ? -13.124 22.507 -36.702 1.00 65.33 129 A 1 ATOM 1048 O O . ARG A 1 129 ? -12.159 22.491 -35.942 1.00 63.80 129 A 1 ATOM 1049 C CB . ARG A 1 129 ? -15.484 23.050 -35.974 1.00 62.67 129 A 1 ATOM 1050 C CG . ARG A 1 129 ? -16.258 24.124 -35.210 1.00 56.26 129 A 1 ATOM 1051 C CD . ARG A 1 129 ? -17.557 23.561 -34.618 1.00 54.08 129 A 1 ATOM 1052 N NE . ARG A 1 129 ? -18.662 23.557 -35.591 1.00 49.78 129 A 1 ATOM 1053 C CZ . ARG A 1 129 ? -19.861 23.037 -35.376 1.00 45.94 129 A 1 ATOM 1054 N NH1 . ARG A 1 129 ? -20.146 22.380 -34.287 1.00 43.80 129 A 1 ATOM 1055 N NH2 . ARG A 1 129 ? -20.810 23.170 -36.253 1.00 41.43 129 A 1 ATOM 1056 N N . VAL A 1 130 ? -13.266 21.663 -37.723 1.00 64.56 130 A 1 ATOM 1057 C CA . VAL A 1 130 ? -12.277 20.624 -38.052 1.00 63.73 130 A 1 ATOM 1058 C C . VAL A 1 130 ? -10.893 21.247 -38.235 1.00 63.54 130 A 1 ATOM 1059 O O . VAL A 1 130 ? -9.918 20.795 -37.639 1.00 62.22 130 A 1 ATOM 1060 C CB . VAL A 1 130 ? -12.696 19.845 -39.315 1.00 62.34 130 A 1 ATOM 1061 C CG1 . VAL A 1 130 ? -11.615 18.862 -39.775 1.00 58.00 130 A 1 ATOM 1062 C CG2 . VAL A 1 130 ? -13.963 19.027 -39.064 1.00 57.65 130 A 1 ATOM 1063 N N . GLN A 1 131 ? -10.807 22.343 -38.981 1.00 64.52 131 A 1 ATOM 1064 C CA . GLN A 1 131 ? -9.542 23.027 -39.237 1.00 63.97 131 A 1 ATOM 1065 C C . GLN A 1 131 ? -8.917 23.608 -37.959 1.00 63.90 131 A 1 ATOM 1066 O O . GLN A 1 131 ? -7.702 23.524 -37.775 1.00 62.79 131 A 1 ATOM 1067 C CB . GLN A 1 131 ? -9.784 24.085 -40.320 1.00 63.09 131 A 1 ATOM 1068 C CG . GLN A 1 131 ? -8.477 24.591 -40.949 1.00 58.27 131 A 1 ATOM 1069 C CD . GLN A 1 131 ? -8.723 25.465 -42.178 1.00 56.01 131 A 1 ATOM 1070 O OE1 . GLN A 1 131 ? -9.829 25.863 -42.503 1.00 51.87 131 A 1 ATOM 1071 N NE2 . GLN A 1 131 ? -7.693 25.805 -42.922 1.00 48.78 131 A 1 ATOM 1072 N N . ARG A 1 132 ? -9.729 24.130 -37.019 1.00 66.09 132 A 1 ATOM 1073 C CA . ARG A 1 132 ? -9.257 24.586 -35.697 1.00 64.68 132 A 1 ATOM 1074 C C . ARG A 1 132 ? -8.721 23.442 -34.833 1.00 64.05 132 A 1 ATOM 1075 O O . ARG A 1 132 ? -7.682 23.614 -34.200 1.00 62.42 132 A 1 ATOM 1076 C CB . ARG A 1 132 ? -10.369 25.340 -34.953 1.00 62.80 132 A 1 ATOM 1077 C CG . ARG A 1 132 ? -10.458 26.804 -35.405 1.00 57.55 132 A 1 ATOM 1078 C CD . ARG A 1 132 ? -11.525 27.579 -34.620 1.00 55.60 132 A 1 ATOM 1079 N NE . ARG A 1 132 ? -12.898 27.247 -35.056 1.00 51.61 132 A 1 ATOM 1080 C CZ . ARG A 1 132 ? -14.016 27.715 -34.520 1.00 46.55 132 A 1 ATOM 1081 N NH1 . ARG A 1 132 ? -14.014 28.533 -33.501 1.00 44.94 132 A 1 ATOM 1082 N NH2 . ARG A 1 132 ? -15.174 27.367 -34.996 1.00 42.01 132 A 1 ATOM 1083 N N . VAL A 1 133 ? -9.396 22.284 -34.817 1.00 62.99 133 A 1 ATOM 1084 C CA . VAL A 1 133 ? -8.950 21.096 -34.073 1.00 61.82 133 A 1 ATOM 1085 C C . VAL A 1 133 ? -7.639 20.556 -34.653 1.00 61.78 133 A 1 ATOM 1086 O O . VAL A 1 133 ? -6.679 20.339 -33.913 1.00 60.02 133 A 1 ATOM 1087 C CB . VAL A 1 133 ? -10.059 20.025 -34.052 1.00 59.37 133 A 1 ATOM 1088 C CG1 . VAL A 1 133 ? -9.589 18.711 -33.417 1.00 54.75 133 A 1 ATOM 1089 C CG2 . VAL A 1 133 ? -11.263 20.517 -33.237 1.00 53.90 133 A 1 ATOM 1090 N N . LEU A 1 134 ? -7.551 20.434 -35.974 1.00 61.21 134 A 1 ATOM 1091 C CA . LEU A 1 134 ? -6.351 19.938 -36.658 1.00 61.18 134 A 1 ATOM 1092 C C . LEU A 1 134 ? -5.143 20.884 -36.535 1.00 61.13 134 A 1 ATOM 1093 O O . LEU A 1 134 ? -4.002 20.426 -36.480 1.00 59.72 134 A 1 ATOM 1094 C CB . LEU A 1 134 ? -6.681 19.691 -38.142 1.00 59.35 134 A 1 ATOM 1095 C CG . LEU A 1 134 ? -7.654 18.524 -38.411 1.00 56.32 134 A 1 ATOM 1096 C CD1 . LEU A 1 134 ? -7.986 18.480 -39.902 1.00 54.18 134 A 1 ATOM 1097 C CD2 . LEU A 1 134 ? -7.067 17.168 -38.015 1.00 53.11 134 A 1 ATOM 1098 N N . THR A 1 135 ? -5.370 22.200 -36.474 1.00 63.76 135 A 1 ATOM 1099 C CA . THR A 1 135 ? -4.285 23.188 -36.316 1.00 62.93 135 A 1 ATOM 1100 C C . THR A 1 135 ? -3.790 23.312 -34.876 1.00 60.92 135 A 1 ATOM 1101 O O . THR A 1 135 ? -2.594 23.516 -34.678 1.00 57.39 135 A 1 ATOM 1102 C CB . THR A 1 135 ? -4.670 24.574 -36.852 1.00 61.46 135 A 1 ATOM 1103 O OG1 . THR A 1 135 ? -5.937 24.960 -36.387 1.00 56.82 135 A 1 ATOM 1104 C CG2 . THR A 1 135 ? -4.710 24.613 -38.382 1.00 57.32 135 A 1 ATOM 1105 N N . ARG A 1 136 ? -4.666 23.124 -33.871 1.00 62.15 136 A 1 ATOM 1106 C CA . ARG A 1 136 ? -4.276 23.105 -32.448 1.00 60.61 136 A 1 ATOM 1107 C C . ARG A 1 136 ? -3.483 21.853 -32.053 1.00 58.02 136 A 1 ATOM 1108 O O . ARG A 1 136 ? -2.675 21.932 -31.136 1.00 53.81 136 A 1 ATOM 1109 C CB . ARG A 1 136 ? -5.520 23.256 -31.554 1.00 57.80 136 A 1 ATOM 1110 C CG . ARG A 1 136 ? -5.919 24.723 -31.353 1.00 53.45 136 A 1 ATOM 1111 C CD . ARG A 1 136 ? -7.142 24.819 -30.429 1.00 51.73 136 A 1 ATOM 1112 N NE . ARG A 1 136 ? -7.423 26.212 -30.023 1.00 48.36 136 A 1 ATOM 1113 C CZ . ARG A 1 136 ? -8.416 26.609 -29.241 1.00 44.69 136 A 1 ATOM 1114 N NH1 . ARG A 1 136 ? -9.297 25.770 -28.769 1.00 43.07 136 A 1 ATOM 1115 N NH2 . ARG A 1 136 ? -8.540 27.867 -28.910 1.00 41.68 136 A 1 ATOM 1116 N N . GLY A 1 137 ? -3.699 20.720 -32.726 1.00 53.92 137 A 1 ATOM 1117 C CA . GLY A 1 137 ? -3.142 19.414 -32.358 1.00 53.68 137 A 1 ATOM 1118 C C . GLY A 1 137 ? -1.898 18.972 -33.134 1.00 53.54 137 A 1 ATOM 1119 O O . GLY A 1 137 ? -1.701 17.773 -33.290 1.00 50.82 137 A 1 ATOM 1120 N N . LYS A 1 138 ? -1.048 19.877 -33.649 1.00 52.73 138 A 1 ATOM 1121 C CA . LYS A 1 138 ? 0.212 19.475 -34.307 1.00 52.98 138 A 1 ATOM 1122 C C . LYS A 1 138 ? 1.115 18.724 -33.318 1.00 51.91 138 A 1 ATOM 1123 O O . LYS A 1 138 ? 1.867 19.340 -32.574 1.00 48.79 138 A 1 ATOM 1124 C CB . LYS A 1 138 ? 0.949 20.679 -34.938 1.00 51.33 138 A 1 ATOM 1125 C CG . LYS A 1 138 ? 0.496 20.963 -36.374 1.00 46.88 138 A 1 ATOM 1126 C CD . LYS A 1 138 ? 1.408 22.017 -37.030 1.00 44.94 138 A 1 ATOM 1127 C CE . LYS A 1 138 ? 1.019 22.241 -38.495 1.00 41.28 138 A 1 ATOM 1128 N NZ . LYS A 1 138 ? 1.931 23.201 -39.168 1.00 37.27 138 A 1 ATOM 1129 N N . GLY A 1 139 ? 1.022 17.384 -33.314 1.00 48.36 139 A 1 ATOM 1130 C CA . GLY A 1 139 ? 1.802 16.475 -32.475 1.00 49.57 139 A 1 ATOM 1131 C C . GLY A 1 139 ? 1.067 15.911 -31.250 1.00 50.37 139 A 1 ATOM 1132 O O . GLY A 1 139 ? 1.632 15.064 -30.557 1.00 47.98 139 A 1 ATOM 1133 N N . GLU A 1 140 ? -0.185 16.308 -30.987 1.00 49.33 140 A 1 ATOM 1134 C CA . GLU A 1 140 ? -1.007 15.763 -29.902 1.00 50.48 140 A 1 ATOM 1135 C C . GLU A 1 140 ? -2.026 14.731 -30.425 1.00 50.38 140 A 1 ATOM 1136 O O . GLU A 1 140 ? -2.499 14.797 -31.562 1.00 48.46 140 A 1 ATOM 1137 C CB . GLU A 1 140 ? -1.686 16.890 -29.109 1.00 48.91 140 A 1 ATOM 1138 C CG . GLU A 1 140 ? -0.669 17.753 -28.330 1.00 44.12 140 A 1 ATOM 1139 C CD . GLU A 1 140 ? -1.324 18.777 -27.389 1.00 41.44 140 A 1 ATOM 1140 O OE1 . GLU A 1 140 ? -0.588 19.331 -26.541 1.00 38.83 140 A 1 ATOM 1141 O OE2 . GLU A 1 140 ? -2.555 18.997 -27.493 1.00 38.60 140 A 1 ATOM 1142 N N . LYS A 1 141 ? -2.380 13.746 -29.586 1.00 43.38 141 A 1 ATOM 1143 C CA . LYS A 1 141 ? -3.434 12.773 -29.906 1.00 43.82 141 A 1 ATOM 1144 C C . LYS A 1 141 ? -4.788 13.487 -29.975 1.00 44.24 141 A 1 ATOM 1145 O O . LYS A 1 141 ? -5.303 13.932 -28.953 1.00 43.41 141 A 1 ATOM 1146 C CB . LYS A 1 141 ? -3.473 11.638 -28.870 1.00 41.67 141 A 1 ATOM 1147 C CG . LYS A 1 141 ? -2.293 10.661 -29.003 1.00 37.24 141 A 1 ATOM 1148 C CD . LYS A 1 141 ? -2.421 9.526 -27.976 1.00 35.38 141 A 1 ATOM 1149 C CE . LYS A 1 141 ? -1.262 8.534 -28.123 1.00 32.28 141 A 1 ATOM 1150 N NZ . LYS A 1 141 ? -1.344 7.434 -27.125 1.00 29.29 141 A 1 ATOM 1151 N N . ILE A 1 142 ? -5.389 13.558 -31.160 1.00 46.50 142 A 1 ATOM 1152 C CA . ILE A 1 142 ? -6.730 14.115 -31.364 1.00 47.50 142 A 1 ATOM 1153 C C . ILE A 1 142 ? -7.756 13.038 -30.986 1.00 46.99 142 A 1 ATOM 1154 O O . ILE A 1 142 ? -7.777 11.959 -31.577 1.00 46.34 142 A 1 ATOM 1155 C CB . ILE A 1 142 ? -6.911 14.631 -32.813 1.00 46.57 142 A 1 ATOM 1156 C CG1 . ILE A 1 142 ? -5.846 15.707 -33.148 1.00 43.81 142 A 1 ATOM 1157 C CG2 . ILE A 1 142 ? -8.331 15.195 -33.005 1.00 43.33 142 A 1 ATOM 1158 C CD1 . ILE A 1 142 ? -5.827 16.132 -34.623 1.00 40.96 142 A 1 ATOM 1159 N N . ALA A 1 143 ? -8.601 13.317 -29.987 1.00 49.12 143 A 1 ATOM 1160 C CA . ALA A 1 143 ? -9.716 12.448 -29.640 1.00 49.37 143 A 1 ATOM 1161 C C . ALA A 1 143 ? -10.873 12.670 -30.631 1.00 50.06 143 A 1 ATOM 1162 O O . ALA A 1 143 ? -11.406 13.773 -30.734 1.00 48.91 143 A 1 ATOM 1163 C CB . ALA A 1 143 ? -10.110 12.709 -28.184 1.00 46.71 143 A 1 ATOM 1164 N N . LEU A 1 144 ? -11.251 11.619 -31.359 1.00 48.47 144 A 1 ATOM 1165 C CA . LEU A 1 144 ? -12.436 11.611 -32.214 1.00 48.98 144 A 1 ATOM 1166 C C . LEU A 1 144 ? -13.620 11.081 -31.402 1.00 49.18 144 A 1 ATOM 1167 O O . LEU A 1 144 ? -13.524 10.010 -30.803 1.00 47.62 144 A 1 ATOM 1168 C CB . LEU A 1 144 ? -12.176 10.766 -33.473 1.00 46.75 144 A 1 ATOM 1169 C CG . LEU A 1 144 ? -11.073 11.313 -34.402 1.00 42.26 144 A 1 ATOM 1170 C CD1 . LEU A 1 144 ? -10.815 10.316 -35.534 1.00 40.00 144 A 1 ATOM 1171 C CD2 . LEU A 1 144 ? -11.444 12.663 -35.020 1.00 39.04 144 A 1 ATOM 1172 N N . TYR A 1 145 ? -14.724 11.827 -31.377 1.00 48.45 145 A 1 ATOM 1173 C CA . TYR A 1 145 ? -15.939 11.444 -30.665 1.00 49.41 145 A 1 ATOM 1174 C C . TYR A 1 145 ? -16.985 10.949 -31.670 1.00 48.55 145 A 1 ATOM 1175 O O . TYR A 1 145 ? -17.347 11.669 -32.598 1.00 47.57 145 A 1 ATOM 1176 C CB . TYR A 1 145 ? -16.453 12.614 -29.819 1.00 47.40 145 A 1 ATOM 1177 C CG . TYR A 1 145 ? -15.495 13.032 -28.711 1.00 43.60 145 A 1 ATOM 1178 C CD1 . TYR A 1 145 ? -15.567 12.417 -27.443 1.00 41.20 145 A 1 ATOM 1179 C CD2 . TYR A 1 145 ? -14.518 14.018 -28.954 1.00 40.59 145 A 1 ATOM 1180 C CE1 . TYR A 1 145 ? -14.671 12.791 -26.422 1.00 37.07 145 A 1 ATOM 1181 C CE2 . TYR A 1 145 ? -13.618 14.390 -27.938 1.00 38.42 145 A 1 ATOM 1182 C CZ . TYR A 1 145 ? -13.696 13.781 -26.668 1.00 36.95 145 A 1 ATOM 1183 O OH . TYR A 1 145 ? -12.832 14.146 -25.684 1.00 36.95 145 A 1 ATOM 1184 N N . ALA A 1 146 ? -17.467 9.717 -31.460 1.00 42.60 146 A 1 ATOM 1185 C CA . ALA A 1 146 ? -18.665 9.208 -32.110 1.00 42.32 146 A 1 ATOM 1186 C C . ALA A 1 146 ? -19.863 9.494 -31.192 1.00 42.98 146 A 1 ATOM 1187 O O . ALA A 1 146 ? -19.837 9.122 -30.019 1.00 40.86 146 A 1 ATOM 1188 C CB . ALA A 1 146 ? -18.483 7.716 -32.411 1.00 39.05 146 A 1 ATOM 1189 N N . LEU A 1 147 ? -20.884 10.170 -31.706 1.00 43.53 147 A 1 ATOM 1190 C CA . LEU A 1 147 ? -22.131 10.409 -30.980 1.00 44.29 147 A 1 ATOM 1191 C C . LEU A 1 147 ? -23.092 9.245 -31.246 1.00 45.14 147 A 1 ATOM 1192 O O . LEU A 1 147 ? -23.364 8.913 -32.398 1.00 42.91 147 A 1 ATOM 1193 C CB . LEU A 1 147 ? -22.725 11.773 -31.372 1.00 41.49 147 A 1 ATOM 1194 C CG . LEU A 1 147 ? -21.915 12.985 -30.867 1.00 37.57 147 A 1 ATOM 1195 C CD1 . LEU A 1 147 ? -22.442 14.269 -31.506 1.00 34.65 147 A 1 ATOM 1196 C CD2 . LEU A 1 147 ? -22.005 13.149 -29.347 1.00 34.28 147 A 1 ATOM 1197 N N . ASP A 1 148 ? -23.597 8.627 -30.178 1.00 38.30 148 A 1 ATOM 1198 C CA . ASP A 1 148 ? -24.714 7.695 -30.266 1.00 39.76 148 A 1 ATOM 1199 C C . ASP A 1 148 ? -26.004 8.516 -30.440 1.00 39.93 148 A 1 ATOM 1200 O O . ASP A 1 148 ? -26.272 9.380 -29.599 1.00 39.13 148 A 1 ATOM 1201 C CB . ASP A 1 148 ? -24.748 6.793 -29.017 1.00 38.84 148 A 1 ATOM 1202 C CG . ASP A 1 148 ? -25.663 5.573 -29.201 1.00 35.30 148 A 1 ATOM 1203 O OD1 . ASP A 1 148 ? -26.704 5.720 -29.874 1.00 32.84 148 A 1 ATOM 1204 O OD2 . ASP A 1 148 ? -25.272 4.484 -28.718 1.00 32.76 148 A 1 ATOM 1205 N N . PRO A 1 149 ? -26.796 8.293 -31.498 1.00 39.36 149 A 1 ATOM 1206 C CA . PRO A 1 149 ? -28.042 9.030 -31.717 1.00 39.59 149 A 1 ATOM 1207 C C . PRO A 1 149 ? -29.099 8.791 -30.627 1.00 39.73 149 A 1 ATOM 1208 O O . PRO A 1 149 ? -30.059 9.549 -30.554 1.00 37.90 149 A 1 ATOM 1209 C CB . PRO A 1 149 ? -28.530 8.595 -33.106 1.00 37.14 149 A 1 ATOM 1210 C CG . PRO A 1 149 ? -27.888 7.228 -33.319 1.00 36.19 149 A 1 ATOM 1211 C CD . PRO A 1 149 ? -26.562 7.342 -32.577 1.00 37.95 149 A 1 ATOM 1212 N N . GLN A 1 150 ? -28.934 7.778 -29.767 1.00 42.10 150 A 1 ATOM 1213 C CA . GLN A 1 150 ? -29.807 7.538 -28.609 1.00 42.90 150 A 1 ATOM 1214 C C . GLN A 1 150 ? -29.360 8.276 -27.337 1.00 42.14 150 A 1 ATOM 1215 O O . GLN A 1 150 ? -30.066 8.237 -26.333 1.00 39.48 150 A 1 ATOM 1216 C CB . GLN A 1 150 ? -29.935 6.033 -28.353 1.00 41.66 150 A 1 ATOM 1217 C CG . GLN A 1 150 ? -30.609 5.314 -29.530 1.00 38.24 150 A 1 ATOM 1218 C CD . GLN A 1 150 ? -31.000 3.875 -29.217 1.00 35.31 150 A 1 ATOM 1219 O OE1 . GLN A 1 150 ? -30.548 3.233 -28.287 1.00 34.11 150 A 1 ATOM 1220 N NE2 . GLN A 1 150 ? -31.881 3.294 -30.002 1.00 32.13 150 A 1 ATOM 1221 N N . ASN A 1 151 ? -28.211 8.945 -27.358 1.00 38.56 151 A 1 ATOM 1222 C CA . ASN A 1 151 ? -27.692 9.710 -26.230 1.00 38.92 151 A 1 ATOM 1223 C C . ASN A 1 151 ? -28.186 11.171 -26.294 1.00 39.20 151 A 1 ATOM 1224 O O . ASN A 1 151 ? -27.399 12.119 -26.323 1.00 37.34 151 A 1 ATOM 1225 C CB . ASN A 1 151 ? -26.166 9.496 -26.143 1.00 37.09 151 A 1 ATOM 1226 C CG . ASN A 1 151 ? -25.660 9.322 -24.722 1.00 34.21 151 A 1 ATOM 1227 O OD1 . ASN A 1 151 ? -26.379 9.249 -23.746 1.00 31.45 151 A 1 ATOM 1228 N ND2 . ASN A 1 151 ? -24.365 9.201 -24.555 1.00 30.80 151 A 1 ATOM 1229 N N . ASP A 1 152 ? -29.513 11.331 -26.378 1.00 37.03 152 A 1 ATOM 1230 C CA . ASP A 1 152 ? -30.185 12.606 -26.136 1.00 38.49 152 A 1 ATOM 1231 C C . ASP A 1 152 ? -30.058 12.912 -24.642 1.00 37.82 152 A 1 ATOM 1232 O O . ASP A 1 152 ? -30.620 12.224 -23.797 1.00 35.63 152 A 1 ATOM 1233 C CB . ASP A 1 152 ? -31.638 12.567 -26.633 1.00 36.89 152 A 1 ATOM 1234 C CG . ASP A 1 152 ? -31.751 12.656 -28.165 1.00 34.28 152 A 1 ATOM 1235 O OD1 . ASP A 1 152 ? -30.824 13.223 -28.798 1.00 31.38 152 A 1 ATOM 1236 O OD2 . ASP A 1 152 ? -32.803 12.223 -28.692 1.00 30.43 152 A 1 ATOM 1237 N N . GLY A 1 153 ? -29.200 13.867 -24.320 1.00 35.92 153 A 1 ATOM 1238 C CA . GLY A 1 153 ? -28.627 14.078 -23.000 1.00 37.08 153 A 1 ATOM 1239 C C . GLY A 1 153 ? -29.633 14.211 -21.853 1.00 37.06 153 A 1 ATOM 1240 O O . GLY A 1 153 ? -30.561 15.013 -21.926 1.00 34.51 153 A 1 ATOM 1241 N N . GLU A 1 154 ? -29.322 13.492 -20.776 1.00 29.02 154 A 1 ATOM 1242 C CA . GLU A 1 154 ? -29.452 13.998 -19.407 1.00 30.92 154 A 1 ATOM 1243 C C . GLU A 1 154 ? -28.053 14.347 -18.874 1.00 28.95 154 A 1 ATOM 1244 O O . GLU A 1 154 ? -27.099 13.572 -19.132 1.00 26.93 154 A 1 ATOM 1245 C CB . GLU A 1 154 ? -30.222 13.008 -18.511 1.00 29.24 154 A 1 ATOM 1246 C CG . GLU A 1 154 ? -31.745 13.014 -18.792 1.00 25.56 154 A 1 ATOM 1247 C CD . GLU A 1 154 ? -32.567 12.190 -17.772 1.00 23.57 154 A 1 ATOM 1248 O OE1 . GLU A 1 154 ? -33.755 12.541 -17.576 1.00 20.86 154 A 1 ATOM 1249 O OE2 . GLU A 1 154 ? -32.026 11.216 -17.198 1.00 23.81 154 A 1 ATOM 1250 O OXT . GLU A 1 154 ? -27.945 15.422 -18.230 1.00 25.58 154 A 1 #