# 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_acrib3 # _entry.id acrib3 # 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 ALA 3 1 n ILE 4 1 n LYS 5 1 n LEU 6 1 n ASN 7 1 n VAL 8 1 n TYR 9 1 n LEU 10 1 n GLU 11 1 n THR 12 1 n ALA 13 1 n ASN 14 1 n PHE 15 1 n ARG 16 1 n ASN 17 1 n PRO 18 1 n MET 19 1 n SER 20 1 n PHE 21 1 n GLN 22 1 n SER 23 1 n LYS 24 1 n GLU 25 1 n SER 26 1 n TYR 27 1 n PRO 28 1 n LEU 29 1 n PRO 30 1 n PRO 31 1 n PHE 32 1 n SER 33 1 n THR 34 1 n VAL 35 1 n ILE 36 1 n GLY 37 1 n MET 38 1 n VAL 39 1 n HIS 40 1 n VAL 41 1 n ALA 42 1 n CYS 43 1 n GLY 44 1 n PHE 45 1 n LYS 46 1 n SER 47 1 n TYR 48 1 n HIS 49 1 n ALA 50 1 n MET 51 1 n ASP 52 1 n VAL 53 1 n SER 54 1 n VAL 55 1 n ALA 56 1 n GLY 57 1 n ASN 58 1 n SER 59 1 n PHE 60 1 n SER 61 1 n THR 62 1 n VAL 63 1 n HIS 64 1 n ASP 65 1 n LEU 66 1 n ALA 67 1 n SER 68 1 n ARG 69 1 n TYR 70 1 n GLU 71 1 n PHE 72 1 n ASN 73 1 n PRO 74 1 n THR 75 1 n THR 76 1 n LYS 77 1 n TYR 78 1 n GLU 79 1 n SER 80 1 n ALA 81 1 n ARG 82 1 n HIS 83 1 n GLN 84 1 n MET 85 1 n LYS 86 1 n VAL 87 1 n TYR 88 1 n SER 89 1 n PRO 90 1 n GLN 91 1 n LYS 92 1 n ASP 93 1 n LYS 94 1 n MET 95 1 n ILE 96 1 n GLY 97 1 n ILE 98 1 n THR 99 1 n GLN 100 1 n GLY 101 1 n ILE 102 1 n SER 103 1 n HIS 104 1 n ILE 105 1 n HIS 106 1 n LEU 107 1 n ILE 108 1 n THR 109 1 n ASP 110 1 n LEU 111 1 n HIS 112 1 n LEU 113 1 n GLN 114 1 n LEU 115 1 n HIS 116 1 n ILE 117 1 n ILE 118 1 n PRO 119 1 n GLU 120 1 n ASP 121 1 n GLN 122 1 n SER 123 1 n GLU 124 1 n VAL 125 1 n TYR 126 1 n PHE 127 1 n ILE 128 1 n GLU 129 1 n SER 130 1 n LYS 131 1 n LEU 132 1 n LYS 133 1 n ASN 134 1 n PRO 135 1 n SER 136 1 n GLN 137 1 n PHE 138 1 n LEU 139 1 n SER 140 1 n LEU 141 1 n GLY 142 1 n ARG 143 1 n HIS 144 1 n GLU 145 1 n ASP 146 1 n VAL 147 1 n MET 148 1 n MET 149 1 n ILE 150 1 n LYS 151 1 n ASP 152 1 n VAL 153 1 n LYS 154 1 n VAL 155 1 n ILE 156 1 n ASP 157 1 n VAL 158 1 n GLN 159 1 n GLU 160 1 n GLU 161 1 n THR 162 1 n LEU 163 1 n PRO 164 1 n SER 165 1 n ASN 166 1 n ARG 167 1 n GLU 168 1 n LEU 169 1 n THR 170 1 n LYS 171 1 n ALA 172 1 n THR 173 1 n TYR 174 1 n VAL 175 1 n PRO 176 1 n VAL 177 1 n SER 178 1 n TYR 179 1 n LYS 180 1 n ILE 181 1 n GLY 182 1 n GLY 183 1 n ALA 184 1 n PHE 185 1 n PHE 186 1 n ARG 187 1 n LEU 188 1 n ASN 189 1 n LYS 190 1 n ASN 191 1 n TYR 192 1 n GLU 193 1 n LEU 194 1 n VAL 195 1 n GLU 196 1 n GLN 197 1 n LYS 198 1 n LYS 199 1 n LYS 200 1 n TRP 201 1 n TYR 202 1 n ARG 203 1 n LYS 204 1 n PHE 205 1 n SER 206 1 n LYS 207 1 n GLN 208 1 n GLU 209 1 n VAL 210 1 n LEU 211 1 n TYR 212 1 n ALA 213 1 n GLY 214 1 n GLU 215 1 n GLY 216 1 n THR 217 1 n ILE 218 1 n ILE 219 1 n PRO 220 1 n LYS 221 1 n ASP 222 1 n SER 223 1 n LEU 224 1 n ILE 225 1 n TRP 226 1 n VAL 227 1 n ASP 228 1 n GLU 229 1 n ASP 230 1 n GLY 231 1 n GLU 232 1 n VAL 233 1 n LEU 234 1 n PHE 235 1 n PRO 236 1 n VAL 237 # _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 @ 2025-04-06 19:34:45)" _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 91.68 _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 89.50 1 1 A LYS 2 2 94.43 1 2 A ALA 3 2 98.36 1 3 A ILE 4 2 97.55 1 4 A LYS 5 2 97.09 1 5 A LEU 6 2 97.40 1 6 A ASN 7 2 95.83 1 7 A VAL 8 2 95.74 1 8 A TYR 9 2 96.97 1 9 A LEU 10 2 96.61 1 10 A GLU 11 2 89.49 1 11 A THR 12 2 95.47 1 12 A ALA 13 2 97.09 1 13 A ASN 14 2 94.79 1 14 A PHE 15 2 97.13 1 15 A ARG 16 2 78.87 1 16 A ASN 17 2 89.06 1 17 A PRO 18 2 88.99 1 18 A MET 19 2 82.50 1 19 A SER 20 2 85.54 1 20 A PHE 21 2 71.47 1 21 A GLN 22 2 75.95 1 22 A SER 23 2 85.43 1 23 A LYS 24 2 85.87 1 24 A GLU 25 2 88.27 1 25 A SER 26 2 96.53 1 26 A TYR 27 2 96.40 1 27 A PRO 28 2 97.54 1 28 A LEU 29 2 97.81 1 29 A PRO 30 2 98.24 1 30 A PRO 31 2 97.59 1 31 A PHE 32 2 97.64 1 32 A SER 33 2 96.24 1 33 A THR 34 2 96.98 1 34 A VAL 35 2 98.01 1 35 A ILE 36 2 97.36 1 36 A GLY 37 2 96.94 1 37 A MET 38 2 96.50 1 38 A VAL 39 2 97.81 1 39 A HIS 40 2 95.43 1 40 A VAL 41 2 96.26 1 41 A ALA 42 2 97.04 1 42 A CYS 43 2 97.20 1 43 A GLY 44 2 96.17 1 44 A PHE 45 2 96.08 1 45 A LYS 46 2 89.00 1 46 A SER 47 2 93.40 1 47 A TYR 48 2 93.06 1 48 A HIS 49 2 94.54 1 49 A ALA 50 2 97.26 1 50 A MET 51 2 96.79 1 51 A ASP 52 2 96.00 1 52 A VAL 53 2 95.61 1 53 A SER 54 2 97.55 1 54 A VAL 55 2 98.05 1 55 A ALA 56 2 98.21 1 56 A GLY 57 2 97.51 1 57 A ASN 58 2 88.94 1 58 A SER 59 2 95.16 1 59 A PHE 60 2 83.53 1 60 A SER 61 2 92.03 1 61 A THR 62 2 92.89 1 62 A VAL 63 2 93.48 1 63 A HIS 64 2 86.91 1 64 A ASP 65 2 91.09 1 65 A LEU 66 2 90.79 1 66 A ALA 67 2 91.12 1 67 A SER 68 2 88.10 1 68 A ARG 69 2 80.58 1 69 A TYR 70 2 88.49 1 70 A GLU 71 2 83.25 1 71 A PHE 72 2 82.74 1 72 A ASN 73 2 81.83 1 73 A PRO 74 2 83.98 1 74 A THR 75 2 84.15 1 75 A THR 76 2 86.51 1 76 A LYS 77 2 83.40 1 77 A TYR 78 2 93.54 1 78 A GLU 79 2 87.43 1 79 A SER 80 2 92.48 1 80 A ALA 81 2 93.47 1 81 A ARG 82 2 78.77 1 82 A HIS 83 2 92.36 1 83 A GLN 84 2 90.06 1 84 A MET 85 2 91.09 1 85 A LYS 86 2 91.44 1 86 A VAL 87 2 91.00 1 87 A TYR 88 2 91.32 1 88 A SER 89 2 89.70 1 89 A PRO 90 2 90.15 1 90 A GLN 91 2 80.33 1 91 A LYS 92 2 82.90 1 92 A ASP 93 2 88.20 1 93 A LYS 94 2 83.83 1 94 A MET 95 2 90.43 1 95 A ILE 96 2 90.59 1 96 A GLY 97 2 93.80 1 97 A ILE 98 2 92.90 1 98 A THR 99 2 91.88 1 99 A GLN 100 2 87.05 1 100 A GLY 101 2 91.59 1 101 A ILE 102 2 87.96 1 102 A SER 103 2 89.76 1 103 A HIS 104 2 86.12 1 104 A ILE 105 2 91.57 1 105 A HIS 106 2 85.29 1 106 A LEU 107 2 96.06 1 107 A ILE 108 2 96.61 1 108 A THR 109 2 95.30 1 109 A ASP 110 2 93.58 1 110 A LEU 111 2 96.97 1 111 A HIS 112 2 95.13 1 112 A LEU 113 2 97.95 1 113 A GLN 114 2 95.49 1 114 A LEU 115 2 98.17 1 115 A HIS 116 2 97.12 1 116 A ILE 117 2 97.74 1 117 A ILE 118 2 97.61 1 118 A PRO 119 2 97.96 1 119 A GLU 120 2 90.53 1 120 A ASP 121 2 96.49 1 121 A GLN 122 2 96.79 1 122 A SER 123 2 97.63 1 123 A GLU 124 2 95.75 1 124 A VAL 125 2 97.93 1 125 A TYR 126 2 97.25 1 126 A PHE 127 2 97.19 1 127 A ILE 128 2 98.00 1 128 A GLU 129 2 96.03 1 129 A SER 130 2 96.75 1 130 A LYS 131 2 95.08 1 131 A LEU 132 2 97.34 1 132 A LYS 133 2 94.14 1 133 A ASN 134 2 90.97 1 134 A PRO 135 2 93.32 1 135 A SER 136 2 88.71 1 136 A GLN 137 2 87.29 1 137 A PHE 138 2 79.03 1 138 A LEU 139 2 95.16 1 139 A SER 140 2 95.42 1 140 A LEU 141 2 92.96 1 141 A GLY 142 2 91.84 1 142 A ARG 143 2 89.45 1 143 A HIS 144 2 81.62 1 144 A GLU 145 2 89.10 1 145 A ASP 146 2 91.53 1 146 A VAL 147 2 91.28 1 147 A MET 148 2 91.36 1 148 A MET 149 2 90.34 1 149 A ILE 150 2 96.31 1 150 A LYS 151 2 90.85 1 151 A ASP 152 2 91.87 1 152 A VAL 153 2 95.84 1 153 A LYS 154 2 89.15 1 154 A VAL 155 2 97.92 1 155 A ILE 156 2 93.83 1 156 A ASP 157 2 95.62 1 157 A VAL 158 2 97.22 1 158 A GLN 159 2 91.01 1 159 A GLU 160 2 90.70 1 160 A GLU 161 2 88.48 1 161 A THR 162 2 93.69 1 162 A LEU 163 2 92.75 1 163 A PRO 164 2 94.68 1 164 A SER 165 2 93.94 1 165 A ASN 166 2 93.67 1 166 A ARG 167 2 89.74 1 167 A GLU 168 2 89.49 1 168 A LEU 169 2 95.76 1 169 A THR 170 2 94.33 1 170 A LYS 171 2 93.60 1 171 A ALA 172 2 97.90 1 172 A THR 173 2 93.46 1 173 A TYR 174 2 97.75 1 174 A VAL 175 2 96.96 1 175 A PRO 176 2 96.50 1 176 A VAL 177 2 93.56 1 177 A SER 178 2 92.31 1 178 A TYR 179 2 89.91 1 179 A LYS 180 2 76.78 1 180 A ILE 181 2 86.99 1 181 A GLY 182 2 93.25 1 182 A GLY 183 2 95.85 1 183 A ALA 184 2 96.87 1 184 A PHE 185 2 94.43 1 185 A PHE 186 2 96.49 1 186 A ARG 187 2 85.24 1 187 A LEU 188 2 96.95 1 188 A ASN 189 2 93.93 1 189 A LYS 190 2 93.98 1 190 A ASN 191 2 90.63 1 191 A TYR 192 2 88.85 1 192 A GLU 193 2 82.85 1 193 A LEU 194 2 87.05 1 194 A VAL 195 2 88.59 1 195 A GLU 196 2 82.98 1 196 A GLN 197 2 82.55 1 197 A LYS 198 2 83.28 1 198 A LYS 199 2 81.26 1 199 A LYS 200 2 80.24 1 200 A TRP 201 2 84.66 1 201 A TYR 202 2 81.39 1 202 A ARG 203 2 83.59 1 203 A LYS 204 2 87.84 1 204 A PHE 205 2 90.25 1 205 A SER 206 2 91.98 1 206 A LYS 207 2 91.77 1 207 A GLN 208 2 92.38 1 208 A GLU 209 2 94.02 1 209 A VAL 210 2 97.24 1 210 A LEU 211 2 96.74 1 211 A TYR 212 2 97.28 1 212 A ALA 213 2 97.64 1 213 A GLY 214 2 96.80 1 214 A GLU 215 2 89.70 1 215 A GLY 216 2 95.63 1 216 A THR 217 2 95.89 1 217 A ILE 218 2 93.29 1 218 A ILE 219 2 94.58 1 219 A PRO 220 2 94.07 1 220 A LYS 221 2 89.55 1 221 A ASP 222 2 91.91 1 222 A SER 223 2 93.85 1 223 A LEU 224 2 91.22 1 224 A ILE 225 2 91.22 1 225 A TRP 226 2 94.81 1 226 A VAL 227 2 95.09 1 227 A ASP 228 2 95.34 1 228 A GLU 229 2 90.75 1 229 A ASP 230 2 94.32 1 230 A GLY 231 2 95.11 1 231 A GLU 232 2 89.66 1 232 A VAL 233 2 94.94 1 233 A LEU 234 2 93.69 1 234 A PHE 235 2 96.41 1 235 A PRO 236 2 96.18 1 236 A VAL 237 2 91.46 1 237 # _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 ALA . 3 A 3 A 4 1 n ILE . 4 A 4 A 5 1 n LYS . 5 A 5 A 6 1 n LEU . 6 A 6 A 7 1 n ASN . 7 A 7 A 8 1 n VAL . 8 A 8 A 9 1 n TYR . 9 A 9 A 10 1 n LEU . 10 A 10 A 11 1 n GLU . 11 A 11 A 12 1 n THR . 12 A 12 A 13 1 n ALA . 13 A 13 A 14 1 n ASN . 14 A 14 A 15 1 n PHE . 15 A 15 A 16 1 n ARG . 16 A 16 A 17 1 n ASN . 17 A 17 A 18 1 n PRO . 18 A 18 A 19 1 n MET . 19 A 19 A 20 1 n SER . 20 A 20 A 21 1 n PHE . 21 A 21 A 22 1 n GLN . 22 A 22 A 23 1 n SER . 23 A 23 A 24 1 n LYS . 24 A 24 A 25 1 n GLU . 25 A 25 A 26 1 n SER . 26 A 26 A 27 1 n TYR . 27 A 27 A 28 1 n PRO . 28 A 28 A 29 1 n LEU . 29 A 29 A 30 1 n PRO . 30 A 30 A 31 1 n PRO . 31 A 31 A 32 1 n PHE . 32 A 32 A 33 1 n SER . 33 A 33 A 34 1 n THR . 34 A 34 A 35 1 n VAL . 35 A 35 A 36 1 n ILE . 36 A 36 A 37 1 n GLY . 37 A 37 A 38 1 n MET . 38 A 38 A 39 1 n VAL . 39 A 39 A 40 1 n HIS . 40 A 40 A 41 1 n VAL . 41 A 41 A 42 1 n ALA . 42 A 42 A 43 1 n CYS . 43 A 43 A 44 1 n GLY . 44 A 44 A 45 1 n PHE . 45 A 45 A 46 1 n LYS . 46 A 46 A 47 1 n SER . 47 A 47 A 48 1 n TYR . 48 A 48 A 49 1 n HIS . 49 A 49 A 50 1 n ALA . 50 A 50 A 51 1 n MET . 51 A 51 A 52 1 n ASP . 52 A 52 A 53 1 n VAL . 53 A 53 A 54 1 n SER . 54 A 54 A 55 1 n VAL . 55 A 55 A 56 1 n ALA . 56 A 56 A 57 1 n GLY . 57 A 57 A 58 1 n ASN . 58 A 58 A 59 1 n SER . 59 A 59 A 60 1 n PHE . 60 A 60 A 61 1 n SER . 61 A 61 A 62 1 n THR . 62 A 62 A 63 1 n VAL . 63 A 63 A 64 1 n HIS . 64 A 64 A 65 1 n ASP . 65 A 65 A 66 1 n LEU . 66 A 66 A 67 1 n ALA . 67 A 67 A 68 1 n SER . 68 A 68 A 69 1 n ARG . 69 A 69 A 70 1 n TYR . 70 A 70 A 71 1 n GLU . 71 A 71 A 72 1 n PHE . 72 A 72 A 73 1 n ASN . 73 A 73 A 74 1 n PRO . 74 A 74 A 75 1 n THR . 75 A 75 A 76 1 n THR . 76 A 76 A 77 1 n LYS . 77 A 77 A 78 1 n TYR . 78 A 78 A 79 1 n GLU . 79 A 79 A 80 1 n SER . 80 A 80 A 81 1 n ALA . 81 A 81 A 82 1 n ARG . 82 A 82 A 83 1 n HIS . 83 A 83 A 84 1 n GLN . 84 A 84 A 85 1 n MET . 85 A 85 A 86 1 n LYS . 86 A 86 A 87 1 n VAL . 87 A 87 A 88 1 n TYR . 88 A 88 A 89 1 n SER . 89 A 89 A 90 1 n PRO . 90 A 90 A 91 1 n GLN . 91 A 91 A 92 1 n LYS . 92 A 92 A 93 1 n ASP . 93 A 93 A 94 1 n LYS . 94 A 94 A 95 1 n MET . 95 A 95 A 96 1 n ILE . 96 A 96 A 97 1 n GLY . 97 A 97 A 98 1 n ILE . 98 A 98 A 99 1 n THR . 99 A 99 A 100 1 n GLN . 100 A 100 A 101 1 n GLY . 101 A 101 A 102 1 n ILE . 102 A 102 A 103 1 n SER . 103 A 103 A 104 1 n HIS . 104 A 104 A 105 1 n ILE . 105 A 105 A 106 1 n HIS . 106 A 106 A 107 1 n LEU . 107 A 107 A 108 1 n ILE . 108 A 108 A 109 1 n THR . 109 A 109 A 110 1 n ASP . 110 A 110 A 111 1 n LEU . 111 A 111 A 112 1 n HIS . 112 A 112 A 113 1 n LEU . 113 A 113 A 114 1 n GLN . 114 A 114 A 115 1 n LEU . 115 A 115 A 116 1 n HIS . 116 A 116 A 117 1 n ILE . 117 A 117 A 118 1 n ILE . 118 A 118 A 119 1 n PRO . 119 A 119 A 120 1 n GLU . 120 A 120 A 121 1 n ASP . 121 A 121 A 122 1 n GLN . 122 A 122 A 123 1 n SER . 123 A 123 A 124 1 n GLU . 124 A 124 A 125 1 n VAL . 125 A 125 A 126 1 n TYR . 126 A 126 A 127 1 n PHE . 127 A 127 A 128 1 n ILE . 128 A 128 A 129 1 n GLU . 129 A 129 A 130 1 n SER . 130 A 130 A 131 1 n LYS . 131 A 131 A 132 1 n LEU . 132 A 132 A 133 1 n LYS . 133 A 133 A 134 1 n ASN . 134 A 134 A 135 1 n PRO . 135 A 135 A 136 1 n SER . 136 A 136 A 137 1 n GLN . 137 A 137 A 138 1 n PHE . 138 A 138 A 139 1 n LEU . 139 A 139 A 140 1 n SER . 140 A 140 A 141 1 n LEU . 141 A 141 A 142 1 n GLY . 142 A 142 A 143 1 n ARG . 143 A 143 A 144 1 n HIS . 144 A 144 A 145 1 n GLU . 145 A 145 A 146 1 n ASP . 146 A 146 A 147 1 n VAL . 147 A 147 A 148 1 n MET . 148 A 148 A 149 1 n MET . 149 A 149 A 150 1 n ILE . 150 A 150 A 151 1 n LYS . 151 A 151 A 152 1 n ASP . 152 A 152 A 153 1 n VAL . 153 A 153 A 154 1 n LYS . 154 A 154 A 155 1 n VAL . 155 A 155 A 156 1 n ILE . 156 A 156 A 157 1 n ASP . 157 A 157 A 158 1 n VAL . 158 A 158 A 159 1 n GLN . 159 A 159 A 160 1 n GLU . 160 A 160 A 161 1 n GLU . 161 A 161 A 162 1 n THR . 162 A 162 A 163 1 n LEU . 163 A 163 A 164 1 n PRO . 164 A 164 A 165 1 n SER . 165 A 165 A 166 1 n ASN . 166 A 166 A 167 1 n ARG . 167 A 167 A 168 1 n GLU . 168 A 168 A 169 1 n LEU . 169 A 169 A 170 1 n THR . 170 A 170 A 171 1 n LYS . 171 A 171 A 172 1 n ALA . 172 A 172 A 173 1 n THR . 173 A 173 A 174 1 n TYR . 174 A 174 A 175 1 n VAL . 175 A 175 A 176 1 n PRO . 176 A 176 A 177 1 n VAL . 177 A 177 A 178 1 n SER . 178 A 178 A 179 1 n TYR . 179 A 179 A 180 1 n LYS . 180 A 180 A 181 1 n ILE . 181 A 181 A 182 1 n GLY . 182 A 182 A 183 1 n GLY . 183 A 183 A 184 1 n ALA . 184 A 184 A 185 1 n PHE . 185 A 185 A 186 1 n PHE . 186 A 186 A 187 1 n ARG . 187 A 187 A 188 1 n LEU . 188 A 188 A 189 1 n ASN . 189 A 189 A 190 1 n LYS . 190 A 190 A 191 1 n ASN . 191 A 191 A 192 1 n TYR . 192 A 192 A 193 1 n GLU . 193 A 193 A 194 1 n LEU . 194 A 194 A 195 1 n VAL . 195 A 195 A 196 1 n GLU . 196 A 196 A 197 1 n GLN . 197 A 197 A 198 1 n LYS . 198 A 198 A 199 1 n LYS . 199 A 199 A 200 1 n LYS . 200 A 200 A 201 1 n TRP . 201 A 201 A 202 1 n TYR . 202 A 202 A 203 1 n ARG . 203 A 203 A 204 1 n LYS . 204 A 204 A 205 1 n PHE . 205 A 205 A 206 1 n SER . 206 A 206 A 207 1 n LYS . 207 A 207 A 208 1 n GLN . 208 A 208 A 209 1 n GLU . 209 A 209 A 210 1 n VAL . 210 A 210 A 211 1 n LEU . 211 A 211 A 212 1 n TYR . 212 A 212 A 213 1 n ALA . 213 A 213 A 214 1 n GLY . 214 A 214 A 215 1 n GLU . 215 A 215 A 216 1 n GLY . 216 A 216 A 217 1 n THR . 217 A 217 A 218 1 n ILE . 218 A 218 A 219 1 n ILE . 219 A 219 A 220 1 n PRO . 220 A 220 A 221 1 n LYS . 221 A 221 A 222 1 n ASP . 222 A 222 A 223 1 n SER . 223 A 223 A 224 1 n LEU . 224 A 224 A 225 1 n ILE . 225 A 225 A 226 1 n TRP . 226 A 226 A 227 1 n VAL . 227 A 227 A 228 1 n ASP . 228 A 228 A 229 1 n GLU . 229 A 229 A 230 1 n ASP . 230 A 230 A 231 1 n GLY . 231 A 231 A 232 1 n GLU . 232 A 232 A 233 1 n VAL . 233 A 233 A 234 1 n LEU . 234 A 234 A 235 1 n PHE . 235 A 235 A 236 1 n PRO . 236 A 236 A 237 1 n VAL . 237 A 237 # _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 ? -8.933 4.197 21.944 1.00 94.07 1 A 1 ATOM 2 C CA . MET A 1 1 ? -9.899 3.979 20.843 1.00 96.12 1 A 1 ATOM 3 C C . MET A 1 1 ? -9.729 2.563 20.311 1.00 97.51 1 A 1 ATOM 4 O O . MET A 1 1 ? -8.727 1.933 20.637 1.00 96.23 1 A 1 ATOM 5 C CB . MET A 1 1 ? -9.741 5.045 19.743 1.00 91.06 1 A 1 ATOM 6 C CG . MET A 1 1 ? -8.404 4.978 18.995 1.00 82.32 1 A 1 ATOM 7 S SD . MET A 1 1 ? -8.052 6.429 17.973 1.00 84.26 1 A 1 ATOM 8 C CE . MET A 1 1 ? -9.422 6.403 16.795 1.00 74.47 1 A 1 ATOM 9 N N . LYS A 1 2 ? -10.703 2.030 19.539 1.00 98.11 2 A 1 ATOM 10 C CA . LYS A 1 2 ? -10.607 0.668 19.006 1.00 98.18 2 A 1 ATOM 11 C C . LYS A 1 2 ? -10.016 0.656 17.603 1.00 98.42 2 A 1 ATOM 12 O O . LYS A 1 2 ? -10.344 1.506 16.780 1.00 97.89 2 A 1 ATOM 13 C CB . LYS A 1 2 ? -11.965 -0.047 19.066 1.00 97.63 2 A 1 ATOM 14 C CG . LYS A 1 2 ? -12.382 -0.305 20.520 1.00 95.56 2 A 1 ATOM 15 C CD . LYS A 1 2 ? -13.550 -1.286 20.640 1.00 92.96 2 A 1 ATOM 16 C CE . LYS A 1 2 ? -13.877 -1.585 22.111 1.00 89.39 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? -12.714 -2.179 22.849 1.00 81.70 2 A 1 ATOM 18 N N . ALA A 1 3 ? -9.204 -0.353 17.324 1.00 98.33 3 A 1 ATOM 19 C CA . ALA A 1 3 ? -8.622 -0.677 16.030 1.00 98.45 3 A 1 ATOM 20 C C . ALA A 1 3 ? -8.860 -2.157 15.693 1.00 98.63 3 A 1 ATOM 21 O O . ALA A 1 3 ? -9.123 -2.971 16.576 1.00 98.34 3 A 1 ATOM 22 C CB . ALA A 1 3 ? -7.127 -0.341 16.068 1.00 98.04 3 A 1 ATOM 23 N N . ILE A 1 4 ? -8.739 -2.516 14.421 1.00 98.68 4 A 1 ATOM 24 C CA . ILE A 1 4 ? -8.638 -3.910 13.989 1.00 98.73 4 A 1 ATOM 25 C C . ILE A 1 4 ? -7.168 -4.193 13.704 1.00 98.74 4 A 1 ATOM 26 O O . ILE A 1 4 ? -6.599 -3.619 12.776 1.00 98.57 4 A 1 ATOM 27 C CB . ILE A 1 4 ? -9.533 -4.228 12.774 1.00 98.60 4 A 1 ATOM 28 C CG1 . ILE A 1 4 ? -11.021 -3.862 12.977 1.00 97.26 4 A 1 ATOM 29 C CG2 . ILE A 1 4 ? -9.433 -5.732 12.459 1.00 97.62 4 A 1 ATOM 30 C CD1 . ILE A 1 4 ? -11.352 -2.439 12.515 1.00 92.20 4 A 1 ATOM 31 N N . LYS A 1 5 ? -6.563 -5.086 14.494 1.00 98.59 5 A 1 ATOM 32 C CA . LYS A 1 5 ? -5.225 -5.625 14.243 1.00 98.60 5 A 1 ATOM 33 C C . LYS A 1 5 ? -5.343 -6.828 13.321 1.00 98.61 5 A 1 ATOM 34 O O . LYS A 1 5 ? -6.028 -7.801 13.644 1.00 98.25 5 A 1 ATOM 35 C CB . LYS A 1 5 ? -4.545 -5.967 15.573 1.00 98.27 5 A 1 ATOM 36 C CG . LYS A 1 5 ? -3.067 -6.363 15.416 1.00 97.86 5 A 1 ATOM 37 C CD . LYS A 1 5 ? -2.456 -6.532 16.814 1.00 97.05 5 A 1 ATOM 38 C CE . LYS A 1 5 ? -0.940 -6.715 16.795 1.00 94.26 5 A 1 ATOM 39 N NZ . LYS A 1 5 ? -0.383 -6.512 18.159 1.00 92.30 5 A 1 ATOM 40 N N . LEU A 1 6 ? -4.675 -6.744 12.174 1.00 98.55 6 A 1 ATOM 41 C CA . LEU A 1 6 ? -4.714 -7.739 11.112 1.00 98.49 6 A 1 ATOM 42 C C . LEU A 1 6 ? -3.291 -8.209 10.803 1.00 98.58 6 A 1 ATOM 43 O O . LEU A 1 6 ? -2.478 -7.436 10.300 1.00 98.19 6 A 1 ATOM 44 C CB . LEU A 1 6 ? -5.421 -7.099 9.895 1.00 98.08 6 A 1 ATOM 45 C CG . LEU A 1 6 ? -5.412 -7.955 8.619 1.00 97.04 6 A 1 ATOM 46 C CD1 . LEU A 1 6 ? -6.207 -9.245 8.790 1.00 94.95 6 A 1 ATOM 47 C CD2 . LEU A 1 6 ? -6.033 -7.175 7.457 1.00 95.33 6 A 1 ATOM 48 N N . ASN A 1 7 ? -3.010 -9.482 11.067 1.00 98.47 7 A 1 ATOM 49 C CA . ASN A 1 7 ? -1.748 -10.122 10.713 1.00 98.37 7 A 1 ATOM 50 C C . ASN A 1 7 ? -1.941 -10.962 9.449 1.00 98.31 7 A 1 ATOM 51 O O . ASN A 1 7 ? -2.791 -11.859 9.409 1.00 97.68 7 A 1 ATOM 52 C CB . ASN A 1 7 ? -1.232 -10.950 11.898 1.00 98.08 7 A 1 ATOM 53 C CG . ASN A 1 7 ? -0.891 -10.088 13.100 1.00 97.08 7 A 1 ATOM 54 O OD1 . ASN A 1 7 ? -0.116 -9.150 13.015 1.00 89.65 7 A 1 ATOM 55 N ND2 . ASN A 1 7 ? -1.461 -10.372 14.246 1.00 89.01 7 A 1 ATOM 56 N N . VAL A 1 8 ? -1.146 -10.684 8.415 1.00 98.01 8 A 1 ATOM 57 C CA . VAL A 1 8 ? -1.241 -11.375 7.123 1.00 97.81 8 A 1 ATOM 58 C C . VAL A 1 8 ? 0.120 -11.827 6.614 1.00 98.23 8 A 1 ATOM 59 O O . VAL A 1 8 ? 1.158 -11.284 6.978 1.00 97.82 8 A 1 ATOM 60 C CB . VAL A 1 8 ? -1.985 -10.553 6.047 1.00 95.75 8 A 1 ATOM 61 C CG1 . VAL A 1 8 ? -3.371 -10.128 6.532 1.00 91.79 8 A 1 ATOM 62 C CG2 . VAL A 1 8 ? -1.230 -9.299 5.607 1.00 90.77 8 A 1 ATOM 63 N N . TYR A 1 9 ? 0.085 -12.823 5.737 1.00 98.07 9 A 1 ATOM 64 C CA . TYR A 1 9 ? 1.237 -13.325 5.004 1.00 98.06 9 A 1 ATOM 65 C C . TYR A 1 9 ? 0.947 -13.306 3.505 1.00 98.09 9 A 1 ATOM 66 O O . TYR A 1 9 ? -0.150 -13.673 3.080 1.00 97.60 9 A 1 ATOM 67 C CB . TYR A 1 9 ? 1.570 -14.736 5.492 1.00 97.84 9 A 1 ATOM 68 C CG . TYR A 1 9 ? 2.587 -15.459 4.633 1.00 97.75 9 A 1 ATOM 69 C CD1 . TYR A 1 9 ? 2.164 -16.459 3.730 1.00 96.25 9 A 1 ATOM 70 C CD2 . TYR A 1 9 ? 3.945 -15.109 4.712 1.00 96.56 9 A 1 ATOM 71 C CE1 . TYR A 1 9 ? 3.111 -17.128 2.931 1.00 95.87 9 A 1 ATOM 72 C CE2 . TYR A 1 9 ? 4.894 -15.775 3.912 1.00 95.98 9 A 1 ATOM 73 C CZ . TYR A 1 9 ? 4.478 -16.793 3.025 1.00 96.45 9 A 1 ATOM 74 O OH . TYR A 1 9 ? 5.394 -17.456 2.270 1.00 95.16 9 A 1 ATOM 75 N N . LEU A 1 10 ? 1.938 -12.912 2.711 1.00 98.21 10 A 1 ATOM 76 C CA . LEU A 1 10 ? 1.940 -13.026 1.261 1.00 98.15 10 A 1 ATOM 77 C C . LEU A 1 10 ? 3.222 -13.737 0.830 1.00 98.07 10 A 1 ATOM 78 O O . LEU A 1 10 ? 4.313 -13.331 1.222 1.00 97.49 10 A 1 ATOM 79 C CB . LEU A 1 10 ? 1.829 -11.648 0.587 1.00 97.98 10 A 1 ATOM 80 C CG . LEU A 1 10 ? 0.544 -10.853 0.901 1.00 96.71 10 A 1 ATOM 81 C CD1 . LEU A 1 10 ? 0.679 -9.978 2.155 1.00 93.18 10 A 1 ATOM 82 C CD2 . LEU A 1 10 ? 0.199 -9.924 -0.259 1.00 93.12 10 A 1 ATOM 83 N N . GLU A 1 11 ? 3.077 -14.763 -0.000 1.00 97.50 11 A 1 ATOM 84 C CA . GLU A 1 11 ? 4.229 -15.445 -0.600 1.00 97.08 11 A 1 ATOM 85 C C . GLU A 1 11 ? 4.997 -14.487 -1.517 1.00 97.24 11 A 1 ATOM 86 O O . GLU A 1 11 ? 6.219 -14.389 -1.448 1.00 96.37 11 A 1 ATOM 87 C CB . GLU A 1 11 ? 3.714 -16.668 -1.369 1.00 96.17 11 A 1 ATOM 88 C CG . GLU A 1 11 ? 4.848 -17.510 -1.975 1.00 88.54 11 A 1 ATOM 89 C CD . GLU A 1 11 ? 4.331 -18.731 -2.756 1.00 84.00 11 A 1 ATOM 90 O OE1 . GLU A 1 11 ? 5.183 -19.534 -3.193 1.00 74.15 11 A 1 ATOM 91 O OE2 . GLU A 1 11 ? 3.097 -18.850 -2.935 1.00 74.34 11 A 1 ATOM 92 N N . THR A 1 12 ? 4.262 -13.729 -2.330 1.00 97.38 12 A 1 ATOM 93 C CA . THR A 1 12 ? 4.815 -12.660 -3.161 1.00 97.16 12 A 1 ATOM 94 C C . THR A 1 12 ? 3.889 -11.451 -3.175 1.00 97.35 12 A 1 ATOM 95 O O . THR A 1 12 ? 2.675 -11.584 -3.027 1.00 96.60 12 A 1 ATOM 96 C CB . THR A 1 12 ? 5.088 -13.116 -4.602 1.00 96.17 12 A 1 ATOM 97 O OG1 . THR A 1 12 ? 3.912 -13.551 -5.235 1.00 92.23 12 A 1 ATOM 98 C CG2 . THR A 1 12 ? 6.113 -14.244 -4.700 1.00 91.43 12 A 1 ATOM 99 N N . ALA A 1 13 ? 4.453 -10.261 -3.378 1.00 97.23 13 A 1 ATOM 100 C CA . ALA A 1 13 ? 3.679 -9.040 -3.568 1.00 97.33 13 A 1 ATOM 101 C C . ALA A 1 13 ? 4.411 -8.008 -4.434 1.00 97.54 13 A 1 ATOM 102 O O . ALA A 1 13 ? 5.637 -7.901 -4.427 1.00 96.82 13 A 1 ATOM 103 C CB . ALA A 1 13 ? 3.322 -8.449 -2.197 1.00 96.54 13 A 1 ATOM 104 N N . ASN A 1 14 ? 3.634 -7.193 -5.145 1.00 97.49 14 A 1 ATOM 105 C CA . ASN A 1 14 ? 4.113 -5.999 -5.834 1.00 97.24 14 A 1 ATOM 106 C C . ASN A 1 14 ? 3.199 -4.794 -5.572 1.00 97.22 14 A 1 ATOM 107 O O . ASN A 1 14 ? 2.077 -4.712 -6.082 1.00 96.25 14 A 1 ATOM 108 C CB . ASN A 1 14 ? 4.266 -6.281 -7.331 1.00 96.52 14 A 1 ATOM 109 C CG . ASN A 1 14 ? 4.786 -5.065 -8.087 1.00 95.75 14 A 1 ATOM 110 O OD1 . ASN A 1 14 ? 4.037 -4.284 -8.663 1.00 89.06 14 A 1 ATOM 111 N ND2 . ASN A 1 14 ? 6.079 -4.863 -8.111 1.00 88.83 14 A 1 ATOM 112 N N . PHE A 1 15 ? 3.711 -3.807 -4.854 1.00 97.11 15 A 1 ATOM 113 C CA . PHE A 1 15 ? 3.043 -2.528 -4.600 1.00 96.99 15 A 1 ATOM 114 C C . PHE A 1 15 ? 3.563 -1.475 -5.575 1.00 96.57 15 A 1 ATOM 115 O O . PHE A 1 15 ? 4.533 -0.771 -5.296 1.00 95.47 15 A 1 ATOM 116 C CB . PHE A 1 15 ? 3.238 -2.123 -3.135 1.00 97.17 15 A 1 ATOM 117 C CG . PHE A 1 15 ? 2.904 -3.223 -2.155 1.00 97.78 15 A 1 ATOM 118 C CD1 . PHE A 1 15 ? 1.619 -3.798 -2.151 1.00 97.42 15 A 1 ATOM 119 C CD2 . PHE A 1 15 ? 3.899 -3.722 -1.296 1.00 97.50 15 A 1 ATOM 120 C CE1 . PHE A 1 15 ? 1.336 -4.873 -1.297 1.00 97.46 15 A 1 ATOM 121 C CE2 . PHE A 1 15 ? 3.610 -4.795 -0.438 1.00 97.32 15 A 1 ATOM 122 C CZ . PHE A 1 15 ? 2.331 -5.372 -0.441 1.00 97.61 15 A 1 ATOM 123 N N . ARG A 1 16 ? 2.936 -1.390 -6.746 1.00 95.60 16 A 1 ATOM 124 C CA . ARG A 1 16 ? 3.442 -0.650 -7.910 1.00 94.49 16 A 1 ATOM 125 C C . ARG A 1 16 ? 3.897 0.780 -7.581 1.00 94.73 16 A 1 ATOM 126 O O . ARG A 1 16 ? 3.070 1.643 -7.282 1.00 92.20 16 A 1 ATOM 127 C CB . ARG A 1 16 ? 2.354 -0.650 -8.995 1.00 92.42 16 A 1 ATOM 128 C CG . ARG A 1 16 ? 2.751 0.032 -10.315 1.00 82.95 16 A 1 ATOM 129 C CD . ARG A 1 16 ? 3.860 -0.754 -11.025 1.00 76.03 16 A 1 ATOM 130 N NE . ARG A 1 16 ? 4.203 -0.141 -12.326 1.00 69.68 16 A 1 ATOM 131 C CZ . ARG A 1 16 ? 5.425 0.075 -12.782 1.00 60.80 16 A 1 ATOM 132 N NH1 . ARG A 1 16 ? 6.481 -0.276 -12.115 1.00 55.55 16 A 1 ATOM 133 N NH2 . ARG A 1 16 ? 5.623 0.669 -13.918 1.00 53.09 16 A 1 ATOM 134 N N . ASN A 1 17 ? 5.188 1.061 -7.772 1.00 95.10 17 A 1 ATOM 135 C CA . ASN A 1 17 ? 5.734 2.412 -7.780 1.00 94.13 17 A 1 ATOM 136 C C . ASN A 1 17 ? 5.438 3.088 -9.136 1.00 93.29 17 A 1 ATOM 137 O O . ASN A 1 17 ? 5.950 2.641 -10.166 1.00 90.83 17 A 1 ATOM 138 C CB . ASN A 1 17 ? 7.237 2.353 -7.445 1.00 93.02 17 A 1 ATOM 139 C CG . ASN A 1 17 ? 7.900 3.714 -7.397 1.00 87.88 17 A 1 ATOM 140 O OD1 . ASN A 1 17 ? 7.311 4.746 -7.695 1.00 78.75 17 A 1 ATOM 141 N ND2 . ASN A 1 17 ? 9.160 3.760 -7.037 1.00 79.51 17 A 1 ATOM 142 N N . PRO A 1 18 ? 4.636 4.169 -9.179 1.00 92.47 18 A 1 ATOM 143 C CA . PRO A 1 18 ? 4.285 4.832 -10.433 1.00 89.98 18 A 1 ATOM 144 C C . PRO A 1 18 ? 5.463 5.559 -11.098 1.00 89.50 18 A 1 ATOM 145 O O . PRO A 1 18 ? 5.382 5.857 -12.284 1.00 85.64 18 A 1 ATOM 146 C CB . PRO A 1 18 ? 3.162 5.807 -10.063 1.00 88.02 18 A 1 ATOM 147 C CG . PRO A 1 18 ? 3.461 6.156 -8.609 1.00 86.95 18 A 1 ATOM 148 C CD . PRO A 1 18 ? 4.002 4.841 -8.055 1.00 90.35 18 A 1 ATOM 149 N N . MET A 1 19 ? 6.543 5.844 -10.370 1.00 90.70 19 A 1 ATOM 150 C CA . MET A 1 19 ? 7.743 6.502 -10.907 1.00 89.45 19 A 1 ATOM 151 C C . MET A 1 19 ? 8.708 5.530 -11.599 1.00 89.68 19 A 1 ATOM 152 O O . MET A 1 19 ? 9.652 5.964 -12.257 1.00 86.46 19 A 1 ATOM 153 C CB . MET A 1 19 ? 8.466 7.272 -9.788 1.00 87.34 19 A 1 ATOM 154 C CG . MET A 1 19 ? 7.618 8.384 -9.149 1.00 80.58 19 A 1 ATOM 155 S SD . MET A 1 19 ? 7.170 9.766 -10.244 1.00 72.17 19 A 1 ATOM 156 C CE . MET A 1 19 ? 5.511 9.291 -10.779 1.00 63.65 19 A 1 ATOM 157 N N . SER A 1 20 ? 8.461 4.227 -11.491 1.00 90.14 20 A 1 ATOM 158 C CA . SER A 1 20 ? 9.240 3.210 -12.191 1.00 88.86 20 A 1 ATOM 159 C C . SER A 1 20 ? 8.672 2.988 -13.599 1.00 87.27 20 A 1 ATOM 160 O O . SER A 1 20 ? 7.514 2.590 -13.752 1.00 82.98 20 A 1 ATOM 161 C CB . SER A 1 20 ? 9.231 1.930 -11.374 1.00 87.56 20 A 1 ATOM 162 O OG . SER A 1 20 ? 9.941 0.935 -12.061 1.00 76.40 20 A 1 ATOM 163 N N . PHE A 1 21 ? 9.464 3.239 -14.640 1.00 84.78 21 A 1 ATOM 164 C CA . PHE A 1 21 ? 9.004 3.170 -16.034 1.00 81.40 21 A 1 ATOM 165 C C . PHE A 1 21 ? 9.385 1.858 -16.734 1.00 81.90 21 A 1 ATOM 166 O O . PHE A 1 21 ? 8.537 1.249 -17.389 1.00 77.02 21 A 1 ATOM 167 C CB . PHE A 1 21 ? 9.525 4.390 -16.808 1.00 77.33 21 A 1 ATOM 168 C CG . PHE A 1 21 ? 9.013 5.715 -16.267 1.00 71.79 21 A 1 ATOM 169 C CD1 . PHE A 1 21 ? 7.715 6.155 -16.586 1.00 67.19 21 A 1 ATOM 170 C CD2 . PHE A 1 21 ? 9.826 6.494 -15.427 1.00 66.22 21 A 1 ATOM 171 C CE1 . PHE A 1 21 ? 7.230 7.367 -16.066 1.00 59.28 21 A 1 ATOM 172 C CE2 . PHE A 1 21 ? 9.339 7.707 -14.901 1.00 60.05 21 A 1 ATOM 173 C CZ . PHE A 1 21 ? 8.041 8.143 -15.221 1.00 59.16 21 A 1 ATOM 174 N N . GLN A 1 22 ? 10.637 1.417 -16.595 1.00 84.92 22 A 1 ATOM 175 C CA . GLN A 1 22 ? 11.164 0.242 -17.303 1.00 83.92 22 A 1 ATOM 176 C C . GLN A 1 22 ? 10.881 -1.065 -16.558 1.00 85.73 22 A 1 ATOM 177 O O . GLN A 1 22 ? 10.385 -2.026 -17.151 1.00 82.66 22 A 1 ATOM 178 C CB . GLN A 1 22 ? 12.673 0.419 -17.537 1.00 80.64 22 A 1 ATOM 179 C CG . GLN A 1 22 ? 13.019 1.593 -18.470 1.00 74.11 22 A 1 ATOM 180 C CD . GLN A 1 22 ? 12.475 1.431 -19.889 1.00 68.86 22 A 1 ATOM 181 O OE1 . GLN A 1 22 ? 12.153 0.351 -20.357 1.00 63.35 22 A 1 ATOM 182 N NE2 . GLN A 1 22 ? 12.345 2.498 -20.639 1.00 59.36 22 A 1 ATOM 183 N N . SER A 1 23 ? 11.162 -1.092 -15.255 1.00 88.34 23 A 1 ATOM 184 C CA . SER A 1 23 ? 10.831 -2.212 -14.371 1.00 88.35 23 A 1 ATOM 185 C C . SER A 1 23 ? 9.594 -1.868 -13.544 1.00 89.55 23 A 1 ATOM 186 O O . SER A 1 23 ? 9.407 -0.719 -13.156 1.00 86.36 23 A 1 ATOM 187 C CB . SER A 1 23 ? 12.020 -2.546 -13.463 1.00 84.91 23 A 1 ATOM 188 O OG . SER A 1 23 ? 11.709 -3.701 -12.715 1.00 75.07 23 A 1 ATOM 189 N N . LYS A 1 24 ? 8.724 -2.848 -13.265 1.00 91.63 24 A 1 ATOM 190 C CA . LYS A 1 24 ? 7.594 -2.651 -12.347 1.00 92.41 24 A 1 ATOM 191 C C . LYS A 1 24 ? 8.076 -2.759 -10.892 1.00 94.28 24 A 1 ATOM 192 O O . LYS A 1 24 ? 7.769 -3.736 -10.219 1.00 93.42 24 A 1 ATOM 193 C CB . LYS A 1 24 ? 6.442 -3.615 -12.670 1.00 91.01 24 A 1 ATOM 194 C CG . LYS A 1 24 ? 5.817 -3.415 -14.053 1.00 86.64 24 A 1 ATOM 195 C CD . LYS A 1 24 ? 4.693 -4.446 -14.251 1.00 81.62 24 A 1 ATOM 196 C CE . LYS A 1 24 ? 4.084 -4.357 -15.651 1.00 75.94 24 A 1 ATOM 197 N NZ . LYS A 1 24 ? 3.170 -5.508 -15.904 1.00 65.88 24 A 1 ATOM 198 N N . GLU A 1 25 ? 8.832 -1.768 -10.433 1.00 95.18 25 A 1 ATOM 199 C CA . GLU A 1 25 ? 9.307 -1.701 -9.047 1.00 95.27 25 A 1 ATOM 200 C C . GLU A 1 25 ? 8.153 -1.649 -8.040 1.00 95.89 25 A 1 ATOM 201 O O . GLU A 1 25 ? 7.053 -1.159 -8.340 1.00 95.26 25 A 1 ATOM 202 C CB . GLU A 1 25 ? 10.223 -0.494 -8.833 1.00 94.24 25 A 1 ATOM 203 C CG . GLU A 1 25 ? 11.565 -0.626 -9.567 1.00 88.34 25 A 1 ATOM 204 C CD . GLU A 1 25 ? 12.396 0.662 -9.510 1.00 83.36 25 A 1 ATOM 205 O OE1 . GLU A 1 25 ? 13.468 0.670 -10.152 1.00 73.53 25 A 1 ATOM 206 O OE2 . GLU A 1 25 ? 11.889 1.672 -8.956 1.00 73.37 25 A 1 ATOM 207 N N . SER A 1 26 ? 8.425 -2.160 -6.843 1.00 96.53 26 A 1 ATOM 208 C CA . SER A 1 26 ? 7.502 -2.188 -5.715 1.00 96.85 26 A 1 ATOM 209 C C . SER A 1 26 ? 7.912 -1.178 -4.648 1.00 97.10 26 A 1 ATOM 210 O O . SER A 1 26 ? 9.099 -0.991 -4.387 1.00 96.52 26 A 1 ATOM 211 C CB . SER A 1 26 ? 7.465 -3.596 -5.113 1.00 96.71 26 A 1 ATOM 212 O OG . SER A 1 26 ? 6.385 -3.707 -4.215 1.00 95.49 26 A 1 ATOM 213 N N . TYR A 1 27 ? 6.923 -0.562 -3.991 1.00 97.50 27 A 1 ATOM 214 C CA . TYR A 1 27 ? 7.142 -0.007 -2.656 1.00 97.61 27 A 1 ATOM 215 C C . TYR A 1 27 ? 7.487 -1.138 -1.673 1.00 97.78 27 A 1 ATOM 216 O O . TYR A 1 27 ? 7.026 -2.262 -1.884 1.00 97.44 27 A 1 ATOM 217 C CB . TYR A 1 27 ? 5.892 0.750 -2.192 1.00 97.45 27 A 1 ATOM 218 C CG . TYR A 1 27 ? 5.615 2.032 -2.954 1.00 97.29 27 A 1 ATOM 219 C CD1 . TYR A 1 27 ? 6.523 3.107 -2.859 1.00 95.99 27 A 1 ATOM 220 C CD2 . TYR A 1 27 ? 4.451 2.161 -3.733 1.00 95.89 27 A 1 ATOM 221 C CE1 . TYR A 1 27 ? 6.264 4.308 -3.543 1.00 95.25 27 A 1 ATOM 222 C CE2 . TYR A 1 27 ? 4.190 3.364 -4.415 1.00 95.08 27 A 1 ATOM 223 C CZ . TYR A 1 27 ? 5.097 4.440 -4.319 1.00 95.50 27 A 1 ATOM 224 O OH . TYR A 1 27 ? 4.841 5.605 -4.970 1.00 93.97 27 A 1 ATOM 225 N N . PRO A 1 28 ? 8.246 -0.863 -0.594 1.00 97.84 28 A 1 ATOM 226 C CA . PRO A 1 28 ? 8.684 -1.896 0.353 1.00 97.76 28 A 1 ATOM 227 C C . PRO A 1 28 ? 7.544 -2.478 1.201 1.00 98.04 28 A 1 ATOM 228 O O . PRO A 1 28 ? 7.619 -3.617 1.643 1.00 97.61 28 A 1 ATOM 229 C CB . PRO A 1 28 ? 9.742 -1.207 1.223 1.00 97.28 28 A 1 ATOM 230 C CG . PRO A 1 28 ? 9.341 0.264 1.183 1.00 96.57 28 A 1 ATOM 231 C CD . PRO A 1 28 ? 8.809 0.431 -0.232 1.00 97.68 28 A 1 ATOM 232 N N . LEU A 1 29 ? 6.477 -1.703 1.410 1.00 98.08 29 A 1 ATOM 233 C CA . LEU A 1 29 ? 5.251 -2.085 2.114 1.00 98.22 29 A 1 ATOM 234 C C . LEU A 1 29 ? 4.034 -1.567 1.323 1.00 98.33 29 A 1 ATOM 235 O O . LEU A 1 29 ? 4.189 -0.651 0.502 1.00 98.13 29 A 1 ATOM 236 C CB . LEU A 1 29 ? 5.280 -1.495 3.538 1.00 98.09 29 A 1 ATOM 237 C CG . LEU A 1 29 ? 6.348 -2.052 4.497 1.00 97.70 29 A 1 ATOM 238 C CD1 . LEU A 1 29 ? 6.304 -1.253 5.808 1.00 96.96 29 A 1 ATOM 239 C CD2 . LEU A 1 29 ? 6.119 -3.524 4.832 1.00 96.98 29 A 1 ATOM 240 N N . PRO A 1 30 ? 2.815 -2.107 1.543 1.00 98.38 30 A 1 ATOM 241 C CA . PRO A 1 30 ? 1.623 -1.635 0.845 1.00 98.45 30 A 1 ATOM 242 C C . PRO A 1 30 ? 1.334 -0.156 1.161 1.00 98.50 30 A 1 ATOM 243 O O . PRO A 1 30 ? 1.300 0.229 2.332 1.00 98.25 30 A 1 ATOM 244 C CB . PRO A 1 30 ? 0.478 -2.551 1.298 1.00 98.27 30 A 1 ATOM 245 C CG . PRO A 1 30 ? 0.955 -3.102 2.643 1.00 97.44 30 A 1 ATOM 246 C CD . PRO A 1 30 ? 2.467 -3.176 2.467 1.00 98.42 30 A 1 ATOM 247 N N . PRO A 1 31 ? 1.060 0.687 0.157 1.00 98.26 31 A 1 ATOM 248 C CA . PRO A 1 31 ? 0.538 2.030 0.381 1.00 98.12 31 A 1 ATOM 249 C C . PRO A 1 31 ? -0.797 2.005 1.138 1.00 98.28 31 A 1 ATOM 250 O O . PRO A 1 31 ? -1.595 1.084 0.965 1.00 97.90 31 A 1 ATOM 251 C CB . PRO A 1 31 ? 0.369 2.651 -1.010 1.00 97.33 31 A 1 ATOM 252 C CG . PRO A 1 31 ? 1.349 1.856 -1.876 1.00 95.73 31 A 1 ATOM 253 C CD . PRO A 1 31 ? 1.302 0.467 -1.261 1.00 97.54 31 A 1 ATOM 254 N N . PHE A 1 32 ? -1.099 3.068 1.880 1.00 98.10 32 A 1 ATOM 255 C CA . PHE A 1 32 ? -2.334 3.180 2.672 1.00 98.16 32 A 1 ATOM 256 C C . PHE A 1 32 ? -3.597 2.942 1.837 1.00 98.17 32 A 1 ATOM 257 O O . PHE A 1 32 ? -4.469 2.167 2.227 1.00 97.74 32 A 1 ATOM 258 C CB . PHE A 1 32 ? -2.382 4.565 3.330 1.00 97.99 32 A 1 ATOM 259 C CG . PHE A 1 32 ? -1.136 4.914 4.122 1.00 98.12 32 A 1 ATOM 260 C CD1 . PHE A 1 32 ? -0.739 4.107 5.202 1.00 97.38 32 A 1 ATOM 261 C CD2 . PHE A 1 32 ? -0.353 6.026 3.754 1.00 97.39 32 A 1 ATOM 262 C CE1 . PHE A 1 32 ? 0.437 4.402 5.914 1.00 96.92 32 A 1 ATOM 263 C CE2 . PHE A 1 32 ? 0.821 6.322 4.469 1.00 96.83 32 A 1 ATOM 264 C CZ . PHE A 1 32 ? 1.215 5.509 5.552 1.00 97.23 32 A 1 ATOM 265 N N . SER A 1 33 ? -3.659 3.510 0.631 1.00 97.68 33 A 1 ATOM 266 C CA . SER A 1 33 ? -4.786 3.311 -0.287 1.00 97.23 33 A 1 ATOM 267 C C . SER A 1 33 ? -4.991 1.854 -0.708 1.00 97.29 33 A 1 ATOM 268 O O . SER A 1 33 ? -6.114 1.470 -1.026 1.00 96.51 33 A 1 ATOM 269 C CB . SER A 1 33 ? -4.606 4.167 -1.546 1.00 96.17 33 A 1 ATOM 270 O OG . SER A 1 33 ? -3.410 3.837 -2.235 1.00 92.53 33 A 1 ATOM 271 N N . THR A 1 34 ? -3.933 1.043 -0.729 1.00 97.57 34 A 1 ATOM 272 C CA . THR A 1 34 ? -4.014 -0.390 -1.034 1.00 97.62 34 A 1 ATOM 273 C C . THR A 1 34 ? -4.659 -1.143 0.125 1.00 97.87 34 A 1 ATOM 274 O O . THR A 1 34 ? -5.563 -1.942 -0.103 1.00 97.58 34 A 1 ATOM 275 C CB . THR A 1 34 ? -2.623 -0.960 -1.349 1.00 97.28 34 A 1 ATOM 276 O OG1 . THR A 1 34 ? -2.055 -0.258 -2.434 1.00 95.45 34 A 1 ATOM 277 C CG2 . THR A 1 34 ? -2.652 -2.429 -1.752 1.00 95.47 34 A 1 ATOM 278 N N . VAL A 1 35 ? -4.263 -0.827 1.361 1.00 97.88 35 A 1 ATOM 279 C CA . VAL A 1 35 ? -4.854 -1.416 2.574 1.00 98.17 35 A 1 ATOM 280 C C . VAL A 1 35 ? -6.317 -0.997 2.713 1.00 98.19 35 A 1 ATOM 281 O O . VAL A 1 35 ? -7.193 -1.853 2.828 1.00 98.02 35 A 1 ATOM 282 C CB . VAL A 1 35 ? -4.041 -1.032 3.829 1.00 98.26 35 A 1 ATOM 283 C CG1 . VAL A 1 35 ? -4.639 -1.658 5.094 1.00 97.78 35 A 1 ATOM 284 C CG2 . VAL A 1 35 ? -2.584 -1.505 3.704 1.00 97.75 35 A 1 ATOM 285 N N . ILE A 1 36 ? -6.605 0.302 2.604 1.00 98.14 36 A 1 ATOM 286 C CA . ILE A 1 36 ? -7.972 0.840 2.660 1.00 97.98 36 A 1 ATOM 287 C C . ILE A 1 36 ? -8.845 0.211 1.562 1.00 97.75 36 A 1 ATOM 288 O O . ILE A 1 36 ? -9.967 -0.217 1.818 1.00 97.29 36 A 1 ATOM 289 C CB . ILE A 1 36 ? -7.938 2.387 2.562 1.00 97.89 36 A 1 ATOM 290 C CG1 . ILE A 1 36 ? -7.236 2.997 3.802 1.00 97.28 36 A 1 ATOM 291 C CG2 . ILE A 1 36 ? -9.358 2.970 2.421 1.00 97.19 36 A 1 ATOM 292 C CD1 . ILE A 1 36 ? -6.907 4.492 3.673 1.00 95.36 36 A 1 ATOM 293 N N . GLY A 1 37 ? -8.323 0.092 0.336 1.00 97.27 37 A 1 ATOM 294 C CA . GLY A 1 37 ? -9.025 -0.559 -0.774 1.00 96.71 37 A 1 ATOM 295 C C . GLY A 1 37 ? -9.366 -2.024 -0.488 1.00 97.06 37 A 1 ATOM 296 O O . GLY A 1 37 ? -10.489 -2.452 -0.758 1.00 96.73 37 A 1 ATOM 297 N N . MET A 1 38 ? -8.440 -2.772 0.100 1.00 97.45 38 A 1 ATOM 298 C CA . MET A 1 38 ? -8.668 -4.156 0.516 1.00 97.70 38 A 1 ATOM 299 C C . MET A 1 38 ? -9.789 -4.255 1.565 1.00 97.92 38 A 1 ATOM 300 O O . MET A 1 38 ? -10.683 -5.085 1.411 1.00 97.68 38 A 1 ATOM 301 C CB . MET A 1 38 ? -7.338 -4.765 0.992 1.00 97.60 38 A 1 ATOM 302 C CG . MET A 1 38 ? -7.464 -6.175 1.577 1.00 96.69 38 A 1 ATOM 303 S SD . MET A 1 38 ? -8.086 -6.284 3.281 1.00 95.83 38 A 1 ATOM 304 C CE . MET A 1 38 ? -6.732 -5.505 4.204 1.00 91.11 38 A 1 ATOM 305 N N . VAL A 1 39 ? -9.809 -3.370 2.563 1.00 97.86 39 A 1 ATOM 306 C CA . VAL A 1 39 ? -10.881 -3.328 3.578 1.00 98.03 39 A 1 ATOM 307 C C . VAL A 1 39 ? -12.234 -3.042 2.928 1.00 97.96 39 A 1 ATOM 308 O O . VAL A 1 39 ? -13.218 -3.722 3.220 1.00 97.62 39 A 1 ATOM 309 C CB . VAL A 1 39 ? -10.576 -2.288 4.676 1.00 98.12 39 A 1 ATOM 310 C CG1 . VAL A 1 39 ? -11.717 -2.175 5.698 1.00 97.54 39 A 1 ATOM 311 C CG2 . VAL A 1 39 ? -9.308 -2.660 5.452 1.00 97.55 39 A 1 ATOM 312 N N . HIS A 1 40 ? -12.297 -2.099 1.980 1.00 97.73 40 A 1 ATOM 313 C CA . HIS A 1 40 ? -13.529 -1.803 1.242 1.00 97.44 40 A 1 ATOM 314 C C . HIS A 1 40 ? -14.038 -3.013 0.453 1.00 97.30 40 A 1 ATOM 315 O O . HIS A 1 40 ? -15.240 -3.281 0.441 1.00 96.69 40 A 1 ATOM 316 C CB . HIS A 1 40 ? -13.314 -0.612 0.301 1.00 97.18 40 A 1 ATOM 317 C CG . HIS A 1 40 ? -13.321 0.714 1.016 1.00 96.93 40 A 1 ATOM 318 N ND1 . HIS A 1 40 ? -12.389 1.143 1.942 1.00 91.63 40 A 1 ATOM 319 C CD2 . HIS A 1 40 ? -14.262 1.697 0.887 1.00 92.31 40 A 1 ATOM 320 C CE1 . HIS A 1 40 ? -12.770 2.351 2.368 1.00 93.21 40 A 1 ATOM 321 N NE2 . HIS A 1 40 ? -13.895 2.734 1.747 1.00 93.92 40 A 1 ATOM 322 N N . VAL A 1 41 ? -13.135 -3.777 -0.172 1.00 97.07 41 A 1 ATOM 323 C CA . VAL A 1 41 ? -13.470 -5.026 -0.872 1.00 96.90 41 A 1 ATOM 324 C C . VAL A 1 41 ? -13.997 -6.077 0.104 1.00 97.30 41 A 1 ATOM 325 O O . VAL A 1 41 ? -15.042 -6.671 -0.162 1.00 96.95 41 A 1 ATOM 326 C CB . VAL A 1 41 ? -12.260 -5.546 -1.673 1.00 96.40 41 A 1 ATOM 327 C CG1 . VAL A 1 41 ? -12.459 -6.971 -2.205 1.00 94.56 41 A 1 ATOM 328 C CG2 . VAL A 1 41 ? -12.000 -4.644 -2.890 1.00 94.64 41 A 1 ATOM 329 N N . ALA A 1 42 ? -13.331 -6.275 1.242 1.00 96.90 42 A 1 ATOM 330 C CA . ALA A 1 42 ? -13.742 -7.239 2.263 1.00 97.08 42 A 1 ATOM 331 C C . ALA A 1 42 ? -15.148 -6.939 2.809 1.00 97.24 42 A 1 ATOM 332 O O . ALA A 1 42 ? -15.976 -7.839 2.961 1.00 96.76 42 A 1 ATOM 333 C CB . ALA A 1 42 ? -12.704 -7.224 3.394 1.00 97.24 42 A 1 ATOM 334 N N . CYS A 1 43 ? -15.439 -5.656 3.052 1.00 97.44 43 A 1 ATOM 335 C CA . CYS A 1 43 ? -16.715 -5.190 3.598 1.00 97.40 43 A 1 ATOM 336 C C . CYS A 1 43 ? -17.822 -5.044 2.545 1.00 97.25 43 A 1 ATOM 337 O O . CYS A 1 43 ? -18.999 -4.942 2.900 1.00 96.27 43 A 1 ATOM 338 C CB . CYS A 1 43 ? -16.464 -3.877 4.342 1.00 97.57 43 A 1 ATOM 339 S SG . CYS A 1 43 ? -15.349 -4.191 5.737 1.00 97.30 43 A 1 ATOM 340 N N . GLY A 1 44 ? -17.472 -5.040 1.261 1.00 96.80 44 A 1 ATOM 341 C CA . GLY A 1 44 ? -18.415 -4.771 0.174 1.00 96.32 44 A 1 ATOM 342 C C . GLY A 1 44 ? -18.876 -3.307 0.100 1.00 96.50 44 A 1 ATOM 343 O O . GLY A 1 44 ? -19.928 -3.035 -0.497 1.00 95.07 44 A 1 ATOM 344 N N . PHE A 1 45 ? -18.118 -2.372 0.684 1.00 96.35 45 A 1 ATOM 345 C CA . PHE A 1 45 ? -18.434 -0.944 0.684 1.00 96.17 45 A 1 ATOM 346 C C . PHE A 1 45 ? -18.519 -0.380 -0.741 1.00 95.63 45 A 1 ATOM 347 O O . PHE A 1 45 ? -17.719 -0.702 -1.624 1.00 94.30 45 A 1 ATOM 348 C CB . PHE A 1 45 ? -17.419 -0.170 1.546 1.00 96.46 45 A 1 ATOM 349 C CG . PHE A 1 45 ? -17.452 -0.436 3.048 1.00 97.14 45 A 1 ATOM 350 C CD1 . PHE A 1 45 ? -18.660 -0.685 3.727 1.00 95.98 45 A 1 ATOM 351 C CD2 . PHE A 1 45 ? -16.255 -0.354 3.790 1.00 96.08 45 A 1 ATOM 352 C CE1 . PHE A 1 45 ? -18.670 -0.852 5.126 1.00 95.84 45 A 1 ATOM 353 C CE2 . PHE A 1 45 ? -16.267 -0.517 5.188 1.00 96.10 45 A 1 ATOM 354 C CZ . PHE A 1 45 ? -17.476 -0.764 5.857 1.00 96.87 45 A 1 ATOM 355 N N . LYS A 1 46 ? -19.528 0.466 -0.976 1.00 95.37 46 A 1 ATOM 356 C CA . LYS A 1 46 ? -19.785 1.104 -2.284 1.00 94.47 46 A 1 ATOM 357 C C . LYS A 1 46 ? -19.448 2.593 -2.303 1.00 94.75 46 A 1 ATOM 358 O O . LYS A 1 46 ? -19.338 3.181 -3.380 1.00 92.10 46 A 1 ATOM 359 C CB . LYS A 1 46 ? -21.249 0.878 -2.708 1.00 93.64 46 A 1 ATOM 360 C CG . LYS A 1 46 ? -21.667 -0.600 -2.824 1.00 91.82 46 A 1 ATOM 361 C CD . LYS A 1 46 ? -20.749 -1.403 -3.751 1.00 85.43 46 A 1 ATOM 362 C CE . LYS A 1 46 ? -21.194 -2.861 -3.813 1.00 82.06 46 A 1 ATOM 363 N NZ . LYS A 1 46 ? -20.144 -3.706 -4.424 1.00 71.39 46 A 1 ATOM 364 N N . SER A 1 47 ? -19.285 3.193 -1.141 1.00 94.01 47 A 1 ATOM 365 C CA . SER A 1 47 ? -18.797 4.550 -0.918 1.00 94.24 47 A 1 ATOM 366 C C . SER A 1 47 ? -17.513 4.504 -0.093 1.00 95.12 47 A 1 ATOM 367 O O . SER A 1 47 ? -17.122 3.453 0.408 1.00 94.09 47 A 1 ATOM 368 C CB . SER A 1 47 ? -19.874 5.393 -0.222 1.00 93.32 47 A 1 ATOM 369 O OG . SER A 1 47 ? -20.377 4.720 0.915 1.00 89.60 47 A 1 ATOM 370 N N . TYR A 1 48 ? -16.836 5.641 -0.002 1.00 94.38 48 A 1 ATOM 371 C CA . TYR A 1 48 ? -15.652 5.761 0.842 1.00 94.91 48 A 1 ATOM 372 C C . TYR A 1 48 ? -16.060 5.801 2.316 1.00 95.61 48 A 1 ATOM 373 O O . TYR A 1 48 ? -16.880 6.635 2.694 1.00 94.75 48 A 1 ATOM 374 C CB . TYR A 1 48 ? -14.850 7.003 0.435 1.00 94.19 48 A 1 ATOM 375 C CG . TYR A 1 48 ? -13.566 7.170 1.224 1.00 94.24 48 A 1 ATOM 376 C CD1 . TYR A 1 48 ? -13.439 8.220 2.158 1.00 92.02 48 A 1 ATOM 377 C CD2 . TYR A 1 48 ? -12.512 6.253 1.053 1.00 92.16 48 A 1 ATOM 378 C CE1 . TYR A 1 48 ? -12.260 8.349 2.914 1.00 91.22 48 A 1 ATOM 379 C CE2 . TYR A 1 48 ? -11.334 6.375 1.813 1.00 91.16 48 A 1 ATOM 380 C CZ . TYR A 1 48 ? -11.205 7.426 2.745 1.00 91.95 48 A 1 ATOM 381 O OH . TYR A 1 48 ? -10.069 7.540 3.484 1.00 90.16 48 A 1 ATOM 382 N N . HIS A 1 49 ? -15.460 4.917 3.113 1.00 96.40 49 A 1 ATOM 383 C CA . HIS A 1 49 ? -15.538 4.906 4.574 1.00 97.05 49 A 1 ATOM 384 C C . HIS A 1 49 ? -14.168 5.323 5.104 1.00 97.34 49 A 1 ATOM 385 O O . HIS A 1 49 ? -13.157 4.683 4.791 1.00 96.38 49 A 1 ATOM 386 C CB . HIS A 1 49 ? -15.960 3.517 5.066 1.00 97.00 49 A 1 ATOM 387 C CG . HIS A 1 49 ? -17.391 3.173 4.732 1.00 97.22 49 A 1 ATOM 388 N ND1 . HIS A 1 49 ? -18.417 3.044 5.643 1.00 88.60 49 A 1 ATOM 389 C CD2 . HIS A 1 49 ? -17.937 2.973 3.495 1.00 90.68 49 A 1 ATOM 390 C CE1 . HIS A 1 49 ? -19.541 2.778 4.968 1.00 91.43 49 A 1 ATOM 391 N NE2 . HIS A 1 49 ? -19.302 2.728 3.653 1.00 93.33 49 A 1 ATOM 392 N N . ALA A 1 50 ? -14.128 6.446 5.814 1.00 97.05 50 A 1 ATOM 393 C CA . ALA A 1 50 ? -12.876 7.024 6.261 1.00 97.45 50 A 1 ATOM 394 C C . ALA A 1 50 ? -12.257 6.183 7.386 1.00 98.01 50 A 1 ATOM 395 O O . ALA A 1 50 ? -12.943 5.713 8.291 1.00 97.53 50 A 1 ATOM 396 C CB . ALA A 1 50 ? -13.111 8.481 6.655 1.00 96.25 50 A 1 ATOM 397 N N . MET A 1 51 ? -10.948 5.970 7.286 1.00 97.78 51 A 1 ATOM 398 C CA . MET A 1 51 ? -10.188 5.209 8.269 1.00 97.95 51 A 1 ATOM 399 C C . MET A 1 51 ? -8.720 5.600 8.212 1.00 98.01 51 A 1 ATOM 400 O O . MET A 1 51 ? -8.183 5.873 7.134 1.00 97.19 51 A 1 ATOM 401 C CB . MET A 1 51 ? -10.375 3.692 8.052 1.00 97.19 51 A 1 ATOM 402 C CG . MET A 1 51 ? -9.855 3.176 6.696 1.00 96.29 51 A 1 ATOM 403 S SD . MET A 1 51 ? -10.345 1.481 6.260 1.00 96.92 51 A 1 ATOM 404 C CE . MET A 1 51 ? -12.113 1.728 5.948 1.00 93.01 51 A 1 ATOM 405 N N . ASP A 1 52 ? -8.069 5.563 9.352 1.00 98.13 52 A 1 ATOM 406 C CA . ASP A 1 52 ? -6.621 5.604 9.446 1.00 98.17 52 A 1 ATOM 407 C C . ASP A 1 52 ? -6.058 4.187 9.460 1.00 98.47 52 A 1 ATOM 408 O O . ASP A 1 52 ? -6.690 3.235 9.927 1.00 98.06 52 A 1 ATOM 409 C CB . ASP A 1 52 ? -6.177 6.430 10.660 1.00 97.48 52 A 1 ATOM 410 C CG . ASP A 1 52 ? -6.473 7.923 10.494 1.00 95.94 52 A 1 ATOM 411 O OD1 . ASP A 1 52 ? -6.519 8.400 9.331 1.00 91.21 52 A 1 ATOM 412 O OD2 . ASP A 1 52 ? -6.607 8.596 11.529 1.00 90.56 52 A 1 ATOM 413 N N . VAL A 1 53 ? -4.864 4.034 8.907 1.00 98.04 53 A 1 ATOM 414 C CA . VAL A 1 53 ? -4.178 2.741 8.863 1.00 98.05 53 A 1 ATOM 415 C C . VAL A 1 53 ? -2.710 2.893 9.244 1.00 98.24 53 A 1 ATOM 416 O O . VAL A 1 53 ? -2.039 3.821 8.812 1.00 97.52 53 A 1 ATOM 417 C CB . VAL A 1 53 ? -4.349 2.007 7.515 1.00 96.76 53 A 1 ATOM 418 C CG1 . VAL A 1 53 ? -5.817 1.656 7.236 1.00 90.59 53 A 1 ATOM 419 C CG2 . VAL A 1 53 ? -3.827 2.796 6.315 1.00 90.07 53 A 1 ATOM 420 N N . SER A 1 54 ? -2.208 1.947 10.018 1.00 98.51 54 A 1 ATOM 421 C CA . SER A 1 54 ? -0.782 1.771 10.285 1.00 98.53 54 A 1 ATOM 422 C C . SER A 1 54 ? -0.293 0.511 9.583 1.00 98.63 54 A 1 ATOM 423 O O . SER A 1 54 ? -0.979 -0.515 9.581 1.00 98.29 54 A 1 ATOM 424 C CB . SER A 1 54 ? -0.512 1.718 11.785 1.00 98.05 54 A 1 ATOM 425 O OG . SER A 1 54 ? 0.861 1.491 12.035 1.00 93.27 54 A 1 ATOM 426 N N . VAL A 1 55 ? 0.880 0.603 8.950 1.00 98.45 55 A 1 ATOM 427 C CA . VAL A 1 55 ? 1.458 -0.456 8.119 1.00 98.54 55 A 1 ATOM 428 C C . VAL A 1 55 ? 2.864 -0.768 8.606 1.00 98.50 55 A 1 ATOM 429 O O . VAL A 1 55 ? 3.770 0.054 8.463 1.00 98.03 55 A 1 ATOM 430 C CB . VAL A 1 55 ? 1.472 -0.058 6.632 1.00 98.31 55 A 1 ATOM 431 C CG1 . VAL A 1 55 ? 2.038 -1.186 5.765 1.00 97.20 55 A 1 ATOM 432 C CG2 . VAL A 1 55 ? 0.069 0.279 6.108 1.00 97.31 55 A 1 ATOM 433 N N . ALA A 1 56 ? 3.045 -1.977 9.115 1.00 98.41 56 A 1 ATOM 434 C CA . ALA A 1 56 ? 4.327 -2.531 9.522 1.00 98.42 56 A 1 ATOM 435 C C . ALA A 1 56 ? 4.516 -3.933 8.934 1.00 98.48 56 A 1 ATOM 436 O O . ALA A 1 56 ? 3.540 -4.633 8.642 1.00 97.86 56 A 1 ATOM 437 C CB . ALA A 1 56 ? 4.410 -2.530 11.049 1.00 97.87 56 A 1 ATOM 438 N N . GLY A 1 57 ? 5.758 -4.361 8.750 1.00 97.99 57 A 1 ATOM 439 C CA . GLY A 1 57 ? 6.022 -5.715 8.280 1.00 97.67 57 A 1 ATOM 440 C C . GLY A 1 57 ? 7.477 -6.007 7.965 1.00 97.71 57 A 1 ATOM 441 O O . GLY A 1 57 ? 8.315 -5.115 7.902 1.00 96.68 57 A 1 ATOM 442 N N . ASN A 1 58 ? 7.745 -7.280 7.724 1.00 97.44 58 A 1 ATOM 443 C CA . ASN A 1 58 ? 9.064 -7.787 7.385 1.00 96.91 58 A 1 ATOM 444 C C . ASN A 1 58 ? 8.935 -8.691 6.154 1.00 97.65 58 A 1 ATOM 445 O O . ASN A 1 58 ? 7.944 -9.408 5.992 1.00 96.61 58 A 1 ATOM 446 C CB . ASN A 1 58 ? 9.690 -8.532 8.585 1.00 93.80 58 A 1 ATOM 447 C CG . ASN A 1 58 ? 9.835 -7.688 9.845 1.00 83.16 58 A 1 ATOM 448 O OD1 . ASN A 1 58 ? 8.870 -7.135 10.345 1.00 71.31 58 A 1 ATOM 449 N ND2 . ASN A 1 58 ? 10.998 -7.581 10.424 1.00 74.60 58 A 1 ATOM 450 N N . SER A 1 59 ? 9.944 -8.671 5.286 1.00 96.38 59 A 1 ATOM 451 C CA . SER A 1 59 ? 10.056 -9.556 4.128 1.00 96.15 59 A 1 ATOM 452 C C . SER A 1 59 ? 11.406 -10.257 4.143 1.00 95.74 59 A 1 ATOM 453 O O . SER A 1 59 ? 12.385 -9.692 4.624 1.00 92.86 59 A 1 ATOM 454 C CB . SER A 1 59 ? 9.872 -8.775 2.829 1.00 95.49 59 A 1 ATOM 455 O OG . SER A 1 59 ? 10.852 -7.762 2.691 1.00 94.31 59 A 1 ATOM 456 N N . PHE A 1 60 ? 11.482 -11.464 3.570 1.00 94.63 60 A 1 ATOM 457 C CA . PHE A 1 60 ? 12.746 -12.195 3.505 1.00 93.23 60 A 1 ATOM 458 C C . PHE A 1 60 ? 13.690 -11.617 2.442 1.00 93.30 60 A 1 ATOM 459 O O . PHE A 1 60 ? 14.858 -11.349 2.715 1.00 88.63 60 A 1 ATOM 460 C CB . PHE A 1 60 ? 12.445 -13.674 3.251 1.00 91.29 60 A 1 ATOM 461 C CG . PHE A 1 60 ? 13.690 -14.531 3.179 1.00 85.32 60 A 1 ATOM 462 C CD1 . PHE A 1 60 ? 14.172 -14.985 1.934 1.00 79.13 60 A 1 ATOM 463 C CD2 . PHE A 1 60 ? 14.392 -14.848 4.354 1.00 78.24 60 A 1 ATOM 464 C CE1 . PHE A 1 60 ? 15.344 -15.756 1.869 1.00 71.01 60 A 1 ATOM 465 C CE2 . PHE A 1 60 ? 15.567 -15.619 4.289 1.00 72.08 60 A 1 ATOM 466 C CZ . PHE A 1 60 ? 16.040 -16.074 3.047 1.00 71.95 60 A 1 ATOM 467 N N . SER A 1 61 ? 13.191 -11.424 1.226 1.00 94.32 61 A 1 ATOM 468 C CA . SER A 1 61 ? 14.000 -10.913 0.114 1.00 94.35 61 A 1 ATOM 469 C C . SER A 1 61 ? 13.138 -10.260 -0.969 1.00 95.56 61 A 1 ATOM 470 O O . SER A 1 61 ? 11.922 -10.093 -0.827 1.00 94.01 61 A 1 ATOM 471 C CB . SER A 1 61 ? 14.870 -12.046 -0.453 1.00 91.83 61 A 1 ATOM 472 O OG . SER A 1 61 ? 14.119 -12.976 -1.205 1.00 82.13 61 A 1 ATOM 473 N N . THR A 1 62 ? 13.792 -9.875 -2.063 1.00 95.97 62 A 1 ATOM 474 C CA . THR A 1 62 ? 13.121 -9.431 -3.282 1.00 95.51 62 A 1 ATOM 475 C C . THR A 1 62 ? 13.696 -10.149 -4.496 1.00 95.95 62 A 1 ATOM 476 O O . THR A 1 62 ? 14.887 -10.453 -4.542 1.00 94.51 62 A 1 ATOM 477 C CB . THR A 1 62 ? 13.186 -7.913 -3.467 1.00 93.96 62 A 1 ATOM 478 O OG1 . THR A 1 62 ? 14.505 -7.462 -3.659 1.00 87.27 62 A 1 ATOM 479 C CG2 . THR A 1 62 ? 12.612 -7.143 -2.276 1.00 87.08 62 A 1 ATOM 480 N N . VAL A 1 63 ? 12.857 -10.407 -5.499 1.00 96.10 63 A 1 ATOM 481 C CA . VAL A 1 63 ? 13.248 -11.066 -6.749 1.00 95.94 63 A 1 ATOM 482 C C . VAL A 1 63 ? 12.729 -10.289 -7.956 1.00 96.33 63 A 1 ATOM 483 O O . VAL A 1 63 ? 11.743 -9.552 -7.878 1.00 95.56 63 A 1 ATOM 484 C CB . VAL A 1 63 ? 12.805 -12.545 -6.799 1.00 94.66 63 A 1 ATOM 485 C CG1 . VAL A 1 63 ? 13.445 -13.356 -5.668 1.00 87.75 63 A 1 ATOM 486 C CG2 . VAL A 1 63 ? 11.285 -12.722 -6.747 1.00 87.99 63 A 1 ATOM 487 N N . HIS A 1 64 ? 13.407 -10.468 -9.092 1.00 96.03 64 A 1 ATOM 488 C CA . HIS A 1 64 ? 12.911 -10.000 -10.380 1.00 95.02 64 A 1 ATOM 489 C C . HIS A 1 64 ? 12.307 -11.166 -11.149 1.00 95.41 64 A 1 ATOM 490 O O . HIS A 1 64 ? 12.972 -12.174 -11.362 1.00 93.52 64 A 1 ATOM 491 C CB . HIS A 1 64 ? 14.029 -9.320 -11.172 1.00 93.01 64 A 1 ATOM 492 C CG . HIS A 1 64 ? 14.380 -7.966 -10.618 1.00 89.37 64 A 1 ATOM 493 N ND1 . HIS A 1 64 ? 13.717 -6.793 -10.890 1.00 75.98 64 A 1 ATOM 494 C CD2 . HIS A 1 64 ? 15.399 -7.664 -9.757 1.00 76.15 64 A 1 ATOM 495 C CE1 . HIS A 1 64 ? 14.331 -5.801 -10.215 1.00 76.01 64 A 1 ATOM 496 N NE2 . HIS A 1 64 ? 15.360 -6.284 -9.506 1.00 78.60 64 A 1 ATOM 497 N N . ASP A 1 65 ? 11.066 -10.993 -11.607 1.00 94.80 65 A 1 ATOM 498 C CA . ASP A 1 65 ? 10.370 -11.970 -12.434 1.00 94.50 65 A 1 ATOM 499 C C . ASP A 1 65 ? 9.938 -11.341 -13.769 1.00 94.89 65 A 1 ATOM 500 O O . ASP A 1 65 ? 10.000 -10.117 -13.970 1.00 93.63 65 A 1 ATOM 501 C CB . ASP A 1 65 ? 9.202 -12.581 -11.632 1.00 93.12 65 A 1 ATOM 502 C CG . ASP A 1 65 ? 8.663 -13.889 -12.226 1.00 89.25 65 A 1 ATOM 503 O OD1 . ASP A 1 65 ? 9.298 -14.424 -13.165 1.00 84.69 65 A 1 ATOM 504 O OD2 . ASP A 1 65 ? 7.583 -14.321 -11.767 1.00 83.88 65 A 1 ATOM 505 N N . LEU A 1 66 ? 9.529 -12.188 -14.714 1.00 93.81 66 A 1 ATOM 506 C CA . LEU A 1 66 ? 9.047 -11.789 -16.029 1.00 93.34 66 A 1 ATOM 507 C C . LEU A 1 66 ? 7.528 -11.601 -16.013 1.00 93.09 66 A 1 ATOM 508 O O . LEU A 1 66 ? 6.771 -12.428 -15.521 1.00 91.72 66 A 1 ATOM 509 C CB . LEU A 1 66 ? 9.481 -12.817 -17.084 1.00 92.35 66 A 1 ATOM 510 C CG . LEU A 1 66 ? 11.010 -12.949 -17.261 1.00 89.55 66 A 1 ATOM 511 C CD1 . LEU A 1 66 ? 11.300 -14.029 -18.305 1.00 86.28 66 A 1 ATOM 512 C CD2 . LEU A 1 66 ? 11.659 -11.646 -17.727 1.00 86.16 66 A 1 ATOM 513 N N . ALA A 1 67 ? 7.067 -10.529 -16.630 1.00 92.35 67 A 1 ATOM 514 C CA . ALA A 1 67 ? 5.649 -10.269 -16.827 1.00 91.16 67 A 1 ATOM 515 C C . ALA A 1 67 ? 5.355 -9.967 -18.301 1.00 91.95 67 A 1 ATOM 516 O O . ALA A 1 67 ? 6.083 -9.222 -18.966 1.00 90.73 67 A 1 ATOM 517 C CB . ALA A 1 67 ? 5.218 -9.125 -15.900 1.00 89.41 67 A 1 ATOM 518 N N . SER A 1 68 ? 4.223 -10.476 -18.797 1.00 90.28 68 A 1 ATOM 519 C CA . SER A 1 68 ? 3.706 -10.071 -20.104 1.00 89.82 68 A 1 ATOM 520 C C . SER A 1 68 ? 3.274 -8.604 -20.083 1.00 90.44 68 A 1 ATOM 521 O O . SER A 1 68 ? 2.564 -8.149 -19.182 1.00 89.26 68 A 1 ATOM 522 C CB . SER A 1 68 ? 2.537 -10.959 -20.531 1.00 89.04 68 A 1 ATOM 523 O OG . SER A 1 68 ? 3.000 -12.273 -20.747 1.00 79.74 68 A 1 ATOM 524 N N . ARG A 1 69 ? 3.682 -7.860 -21.098 1.00 91.15 69 A 1 ATOM 525 C CA . ARG A 1 69 ? 3.328 -6.455 -21.295 1.00 91.07 69 A 1 ATOM 526 C C . ARG A 1 69 ? 2.513 -6.308 -22.573 1.00 92.48 69 A 1 ATOM 527 O O . ARG A 1 69 ? 2.958 -6.722 -23.636 1.00 91.62 69 A 1 ATOM 528 C CB . ARG A 1 69 ? 4.604 -5.609 -21.324 1.00 88.49 69 A 1 ATOM 529 C CG . ARG A 1 69 ? 4.305 -4.108 -21.250 1.00 82.59 69 A 1 ATOM 530 C CD . ARG A 1 69 ? 5.598 -3.293 -21.060 1.00 80.27 69 A 1 ATOM 531 N NE . ARG A 1 69 ? 6.300 -3.050 -22.328 1.00 73.67 69 A 1 ATOM 532 C CZ . ARG A 1 69 ? 7.482 -2.482 -22.493 1.00 69.32 69 A 1 ATOM 533 N NH1 . ARG A 1 69 ? 8.263 -2.186 -21.493 1.00 65.02 69 A 1 ATOM 534 N NH2 . ARG A 1 69 ? 7.894 -2.184 -23.689 1.00 60.68 69 A 1 ATOM 535 N N . TYR A 1 70 ? 1.349 -5.689 -22.463 1.00 90.85 70 A 1 ATOM 536 C CA . TYR A 1 70 ? 0.491 -5.340 -23.591 1.00 90.50 70 A 1 ATOM 537 C C . TYR A 1 70 ? 0.456 -3.822 -23.739 1.00 90.44 70 A 1 ATOM 538 O O . TYR A 1 70 ? 0.050 -3.110 -22.821 1.00 88.78 70 A 1 ATOM 539 C CB . TYR A 1 70 ? -0.909 -5.926 -23.395 1.00 90.20 70 A 1 ATOM 540 C CG . TYR A 1 70 ? -0.919 -7.438 -23.269 1.00 90.27 70 A 1 ATOM 541 C CD1 . TYR A 1 70 ? -0.901 -8.243 -24.424 1.00 87.33 70 A 1 ATOM 542 C CD2 . TYR A 1 70 ? -0.919 -8.041 -21.992 1.00 88.26 70 A 1 ATOM 543 C CE1 . TYR A 1 70 ? -0.889 -9.645 -24.307 1.00 86.10 70 A 1 ATOM 544 C CE2 . TYR A 1 70 ? -0.902 -9.442 -21.874 1.00 86.42 70 A 1 ATOM 545 C CZ . TYR A 1 70 ? -0.887 -10.246 -23.032 1.00 87.53 70 A 1 ATOM 546 O OH . TYR A 1 70 ? -0.869 -11.602 -22.920 1.00 85.24 70 A 1 ATOM 547 N N . GLU A 1 71 ? 0.897 -3.334 -24.882 1.00 91.66 71 A 1 ATOM 548 C CA . GLU A 1 71 ? 0.982 -1.903 -25.159 1.00 91.07 71 A 1 ATOM 549 C C . GLU A 1 71 ? 0.204 -1.561 -26.424 1.00 91.83 71 A 1 ATOM 550 O O . GLU A 1 71 ? 0.322 -2.225 -27.456 1.00 90.66 71 A 1 ATOM 551 C CB . GLU A 1 71 ? 2.443 -1.455 -25.288 1.00 88.42 71 A 1 ATOM 552 C CG . GLU A 1 71 ? 3.180 -1.608 -23.961 1.00 79.72 71 A 1 ATOM 553 C CD . GLU A 1 71 ? 4.635 -1.163 -24.055 1.00 77.63 71 A 1 ATOM 554 O OE1 . GLU A 1 71 ? 5.048 -0.318 -23.239 1.00 69.61 71 A 1 ATOM 555 O OE2 . GLU A 1 71 ? 5.397 -1.752 -24.851 1.00 68.68 71 A 1 ATOM 556 N N . PHE A 1 72 ? -0.585 -0.505 -26.350 1.00 92.30 72 A 1 ATOM 557 C CA . PHE A 1 72 ? -1.311 0.009 -27.501 1.00 90.73 72 A 1 ATOM 558 C C . PHE A 1 72 ? -1.518 1.512 -27.366 1.00 90.94 72 A 1 ATOM 559 O O . PHE A 1 72 ? -1.648 2.053 -26.268 1.00 88.66 72 A 1 ATOM 560 C CB . PHE A 1 72 ? -2.646 -0.736 -27.673 1.00 87.70 72 A 1 ATOM 561 C CG . PHE A 1 72 ? -3.655 -0.524 -26.562 1.00 83.79 72 A 1 ATOM 562 C CD1 . PHE A 1 72 ? -3.591 -1.294 -25.387 1.00 78.68 72 A 1 ATOM 563 C CD2 . PHE A 1 72 ? -4.664 0.447 -26.702 1.00 79.15 72 A 1 ATOM 564 C CE1 . PHE A 1 72 ? -4.522 -1.092 -24.358 1.00 72.06 72 A 1 ATOM 565 C CE2 . PHE A 1 72 ? -5.599 0.649 -25.673 1.00 73.39 72 A 1 ATOM 566 C CZ . PHE A 1 72 ? -5.527 -0.119 -24.499 1.00 72.74 72 A 1 ATOM 567 N N . ASN A 1 73 ? -1.616 2.185 -28.499 1.00 90.02 73 A 1 ATOM 568 C CA . ASN A 1 73 ? -2.084 3.559 -28.558 1.00 87.47 73 A 1 ATOM 569 C C . ASN A 1 73 ? -3.473 3.551 -29.216 1.00 87.68 73 A 1 ATOM 570 O O . ASN A 1 73 ? -3.597 3.037 -30.330 1.00 85.39 73 A 1 ATOM 571 C CB . ASN A 1 73 ? -1.031 4.400 -29.301 1.00 84.50 73 A 1 ATOM 572 C CG . ASN A 1 73 ? -1.392 5.870 -29.429 1.00 77.75 73 A 1 ATOM 573 O OD1 . ASN A 1 73 ? -2.543 6.261 -29.537 1.00 72.03 73 A 1 ATOM 574 N ND2 . ASN A 1 73 ? -0.414 6.742 -29.439 1.00 69.82 73 A 1 ATOM 575 N N . PRO A 1 74 ? -4.512 4.152 -28.596 1.00 87.54 74 A 1 ATOM 576 C CA . PRO A 1 74 ? -5.869 4.190 -29.154 1.00 85.06 74 A 1 ATOM 577 C C . PRO A 1 74 ? -5.975 4.808 -30.560 1.00 86.78 74 A 1 ATOM 578 O O . PRO A 1 74 ? -6.994 4.659 -31.235 1.00 84.11 74 A 1 ATOM 579 C CB . PRO A 1 74 ? -6.690 5.007 -28.150 1.00 82.60 74 A 1 ATOM 580 C CG . PRO A 1 74 ? -5.956 4.808 -26.827 1.00 79.47 74 A 1 ATOM 581 C CD . PRO A 1 74 ? -4.496 4.730 -27.255 1.00 82.31 74 A 1 ATOM 582 N N . THR A 1 75 ? -4.942 5.512 -31.011 1.00 88.03 75 A 1 ATOM 583 C CA . THR A 1 75 ? -4.888 6.126 -32.342 1.00 87.03 75 A 1 ATOM 584 C C . THR A 1 75 ? -4.119 5.294 -33.373 1.00 88.85 75 A 1 ATOM 585 O O . THR A 1 75 ? -4.310 5.513 -34.568 1.00 85.84 75 A 1 ATOM 586 C CB . THR A 1 75 ? -4.333 7.555 -32.277 1.00 84.13 75 A 1 ATOM 587 O OG1 . THR A 1 75 ? -2.991 7.569 -31.871 1.00 78.27 75 A 1 ATOM 588 C CG2 . THR A 1 75 ? -5.134 8.443 -31.316 1.00 76.90 75 A 1 ATOM 589 N N . THR A 1 76 ? -3.323 4.320 -32.943 1.00 88.64 76 A 1 ATOM 590 C CA . THR A 1 76 ? -2.477 3.511 -33.834 1.00 88.51 76 A 1 ATOM 591 C C . THR A 1 76 ? -3.284 2.394 -34.494 1.00 91.13 76 A 1 ATOM 592 O O . THR A 1 76 ? -3.767 1.486 -33.824 1.00 90.52 76 A 1 ATOM 593 C CB . THR A 1 76 ? -1.273 2.936 -33.079 1.00 85.89 76 A 1 ATOM 594 O OG1 . THR A 1 76 ? -0.521 3.998 -32.535 1.00 80.80 76 A 1 ATOM 595 C CG2 . THR A 1 76 ? -0.318 2.168 -33.987 1.00 80.09 76 A 1 ATOM 596 N N . LYS A 1 77 ? -3.422 2.448 -35.812 1.00 91.92 77 A 1 ATOM 597 C CA . LYS A 1 77 ? -4.069 1.396 -36.609 1.00 91.90 77 A 1 ATOM 598 C C . LYS A 1 77 ? -3.258 0.099 -36.535 1.00 93.29 77 A 1 ATOM 599 O O . LYS A 1 77 ? -2.032 0.143 -36.455 1.00 91.93 77 A 1 ATOM 600 C CB . LYS A 1 77 ? -4.258 1.891 -38.056 1.00 89.65 77 A 1 ATOM 601 C CG . LYS A 1 77 ? -5.142 0.958 -38.900 1.00 82.25 77 A 1 ATOM 602 C CD . LYS A 1 77 ? -5.347 1.499 -40.324 1.00 78.26 77 A 1 ATOM 603 C CE . LYS A 1 77 ? -6.199 0.523 -41.143 1.00 70.07 77 A 1 ATOM 604 N NZ . LYS A 1 77 ? -6.391 0.982 -42.549 1.00 61.32 77 A 1 ATOM 605 N N . TYR A 1 78 ? -3.953 -1.040 -36.576 1.00 93.10 78 A 1 ATOM 606 C CA . TYR A 1 78 ? -3.315 -2.350 -36.650 1.00 93.75 78 A 1 ATOM 607 C C . TYR A 1 78 ? -2.520 -2.521 -37.953 1.00 94.30 78 A 1 ATOM 608 O O . TYR A 1 78 ? -3.025 -2.239 -39.039 1.00 93.72 78 A 1 ATOM 609 C CB . TYR A 1 78 ? -4.380 -3.446 -36.517 1.00 94.03 78 A 1 ATOM 610 C CG . TYR A 1 78 ? -3.848 -4.846 -36.765 1.00 94.98 78 A 1 ATOM 611 C CD1 . TYR A 1 78 ? -4.127 -5.507 -37.979 1.00 92.32 78 A 1 ATOM 612 C CD2 . TYR A 1 78 ? -3.038 -5.472 -35.799 1.00 93.66 78 A 1 ATOM 613 C CE1 . TYR A 1 78 ? -3.612 -6.795 -38.215 1.00 92.82 78 A 1 ATOM 614 C CE2 . TYR A 1 78 ? -2.518 -6.760 -36.034 1.00 92.95 78 A 1 ATOM 615 C CZ . TYR A 1 78 ? -2.809 -7.424 -37.240 1.00 94.05 78 A 1 ATOM 616 O OH . TYR A 1 78 ? -2.318 -8.673 -37.465 1.00 92.78 78 A 1 ATOM 617 N N . GLU A 1 79 ? -1.312 -3.055 -37.820 1.00 94.64 79 A 1 ATOM 618 C CA . GLU A 1 79 ? -0.414 -3.438 -38.913 1.00 93.67 79 A 1 ATOM 619 C C . GLU A 1 79 ? 0.126 -4.843 -38.621 1.00 94.22 79 A 1 ATOM 620 O O . GLU A 1 79 ? 0.739 -5.066 -37.577 1.00 93.29 79 A 1 ATOM 621 C CB . GLU A 1 79 ? 0.751 -2.439 -39.016 1.00 92.14 79 A 1 ATOM 622 C CG . GLU A 1 79 ? 0.334 -1.035 -39.486 1.00 85.00 79 A 1 ATOM 623 C CD . GLU A 1 79 ? 1.448 0.006 -39.294 1.00 83.69 79 A 1 ATOM 624 O OE1 . GLU A 1 79 ? 1.096 1.199 -39.123 1.00 74.70 79 A 1 ATOM 625 O OE2 . GLU A 1 79 ? 2.630 -0.392 -39.234 1.00 75.51 79 A 1 ATOM 626 N N . SER A 1 80 ? -0.113 -5.800 -39.515 1.00 95.06 80 A 1 ATOM 627 C CA . SER A 1 80 ? 0.232 -7.215 -39.290 1.00 94.02 80 A 1 ATOM 628 C C . SER A 1 80 ? 1.733 -7.473 -39.125 1.00 93.60 80 A 1 ATOM 629 O O . SER A 1 80 ? 2.114 -8.386 -38.401 1.00 90.81 80 A 1 ATOM 630 C CB . SER A 1 80 ? -0.294 -8.074 -40.444 1.00 93.61 80 A 1 ATOM 631 O OG . SER A 1 80 ? 0.170 -7.563 -41.684 1.00 87.80 80 A 1 ATOM 632 N N . ALA A 1 81 ? 2.569 -6.647 -39.753 1.00 94.62 81 A 1 ATOM 633 C CA . ALA A 1 81 ? 4.025 -6.750 -39.628 1.00 93.76 81 A 1 ATOM 634 C C . ALA A 1 81 ? 4.574 -6.207 -38.291 1.00 93.69 81 A 1 ATOM 635 O O . ALA A 1 81 ? 5.729 -6.448 -37.963 1.00 91.22 81 A 1 ATOM 636 C CB . ALA A 1 81 ? 4.643 -6.017 -40.820 1.00 94.04 81 A 1 ATOM 637 N N . ARG A 1 82 ? 3.762 -5.449 -37.539 1.00 94.03 82 A 1 ATOM 638 C CA . ARG A 1 82 ? 4.190 -4.731 -36.331 1.00 93.10 82 A 1 ATOM 639 C C . ARG A 1 82 ? 3.532 -5.236 -35.051 1.00 94.55 82 A 1 ATOM 640 O O . ARG A 1 82 ? 4.164 -5.229 -34.003 1.00 93.01 82 A 1 ATOM 641 C CB . ARG A 1 82 ? 3.909 -3.239 -36.552 1.00 89.32 82 A 1 ATOM 642 C CG . ARG A 1 82 ? 4.360 -2.374 -35.370 1.00 77.88 82 A 1 ATOM 643 C CD . ARG A 1 82 ? 4.042 -0.908 -35.648 1.00 76.28 82 A 1 ATOM 644 N NE . ARG A 1 82 ? 4.392 -0.066 -34.495 1.00 68.19 82 A 1 ATOM 645 C CZ . ARG A 1 82 ? 4.194 1.231 -34.409 1.00 64.93 82 A 1 ATOM 646 N NH1 . ARG A 1 82 ? 3.638 1.909 -35.381 1.00 59.98 82 A 1 ATOM 647 N NH2 . ARG A 1 82 ? 4.555 1.877 -33.332 1.00 55.16 82 A 1 ATOM 648 N N . HIS A 1 83 ? 2.256 -5.610 -35.119 1.00 94.72 83 A 1 ATOM 649 C CA . HIS A 1 83 ? 1.458 -5.917 -33.939 1.00 94.62 83 A 1 ATOM 650 C C . HIS A 1 83 ? 1.114 -7.407 -33.869 1.00 94.48 83 A 1 ATOM 651 O O . HIS A 1 83 ? 0.653 -7.988 -34.851 1.00 93.20 83 A 1 ATOM 652 C CB . HIS A 1 83 ? 0.187 -5.068 -33.939 1.00 93.91 83 A 1 ATOM 653 C CG . HIS A 1 83 ? 0.418 -3.582 -34.032 1.00 94.22 83 A 1 ATOM 654 N ND1 . HIS A 1 83 ? 0.164 -2.798 -35.136 1.00 88.17 83 A 1 ATOM 655 C CD2 . HIS A 1 83 ? 0.869 -2.752 -33.045 1.00 89.67 83 A 1 ATOM 656 C CE1 . HIS A 1 83 ? 0.447 -1.524 -34.816 1.00 89.91 83 A 1 ATOM 657 N NE2 . HIS A 1 83 ? 0.883 -1.446 -33.549 1.00 90.74 83 A 1 ATOM 658 N N . GLN A 1 84 ? 1.253 -7.996 -32.684 1.00 95.75 84 A 1 ATOM 659 C CA . GLN A 1 84 ? 0.935 -9.403 -32.432 1.00 94.56 84 A 1 ATOM 660 C C . GLN A 1 84 ? -0.569 -9.628 -32.227 1.00 94.92 84 A 1 ATOM 661 O O . GLN A 1 84 ? -1.080 -10.708 -32.506 1.00 93.42 84 A 1 ATOM 662 C CB . GLN A 1 84 ? 1.716 -9.906 -31.206 1.00 93.34 84 A 1 ATOM 663 C CG . GLN A 1 84 ? 3.248 -9.901 -31.374 1.00 90.10 84 A 1 ATOM 664 C CD . GLN A 1 84 ? 3.896 -8.520 -31.251 1.00 88.12 84 A 1 ATOM 665 O OE1 . GLN A 1 84 ? 3.323 -7.563 -30.748 1.00 81.20 84 A 1 ATOM 666 N NE2 . GLN A 1 84 ? 5.110 -8.352 -31.711 1.00 79.11 84 A 1 ATOM 667 N N . MET A 1 85 ? -1.288 -8.599 -31.756 1.00 95.36 85 A 1 ATOM 668 C CA . MET A 1 85 ? -2.719 -8.676 -31.468 1.00 94.86 85 A 1 ATOM 669 C C . MET A 1 85 ? -3.455 -7.455 -32.029 1.00 95.59 85 A 1 ATOM 670 O O . MET A 1 85 ? -2.859 -6.428 -32.352 1.00 94.62 85 A 1 ATOM 671 C CB . MET A 1 85 ? -2.962 -8.804 -29.954 1.00 93.68 85 A 1 ATOM 672 C CG . MET A 1 85 ? -2.211 -9.954 -29.282 1.00 90.38 85 A 1 ATOM 673 S SD . MET A 1 85 ? -2.433 -10.001 -27.482 1.00 87.71 85 A 1 ATOM 674 C CE . MET A 1 85 ? -4.123 -10.640 -27.366 1.00 76.49 85 A 1 ATOM 675 N N . LYS A 1 86 ? -4.797 -7.572 -32.105 1.00 94.96 86 A 1 ATOM 676 C CA . LYS A 1 86 ? -5.664 -6.481 -32.562 1.00 94.48 86 A 1 ATOM 677 C C . LYS A 1 86 ? -6.993 -6.473 -31.817 1.00 94.33 86 A 1 ATOM 678 O O . LYS A 1 86 ? -7.524 -7.527 -31.479 1.00 93.30 86 A 1 ATOM 679 C CB . LYS A 1 86 ? -5.860 -6.564 -34.087 1.00 93.52 86 A 1 ATOM 680 C CG . LYS A 1 86 ? -6.562 -7.845 -34.566 1.00 92.56 86 A 1 ATOM 681 C CD . LYS A 1 86 ? -6.588 -7.919 -36.099 1.00 91.83 86 A 1 ATOM 682 C CE . LYS A 1 86 ? -7.274 -9.206 -36.572 1.00 86.99 86 A 1 ATOM 683 N NZ . LYS A 1 86 ? -7.220 -9.348 -38.049 1.00 81.02 86 A 1 ATOM 684 N N . VAL A 1 87 ? -7.574 -5.289 -31.634 1.00 95.01 87 A 1 ATOM 685 C CA . VAL A 1 87 ? -8.911 -5.097 -31.060 1.00 93.89 87 A 1 ATOM 686 C C . VAL A 1 87 ? -9.666 -4.043 -31.864 1.00 94.63 87 A 1 ATOM 687 O O . VAL A 1 87 ? -9.092 -3.027 -32.258 1.00 94.40 87 A 1 ATOM 688 C CB . VAL A 1 87 ? -8.821 -4.757 -29.559 1.00 92.09 87 A 1 ATOM 689 C CG1 . VAL A 1 87 ? -8.126 -3.415 -29.276 1.00 82.50 87 A 1 ATOM 690 C CG2 . VAL A 1 87 ? -10.199 -4.758 -28.899 1.00 84.51 87 A 1 ATOM 691 N N . TYR A 1 88 ? -10.955 -4.280 -32.136 1.00 93.67 88 A 1 ATOM 692 C CA . TYR A 1 88 ? -11.790 -3.290 -32.807 1.00 93.12 88 A 1 ATOM 693 C C . TYR A 1 88 ? -12.194 -2.177 -31.829 1.00 92.75 88 A 1 ATOM 694 O O . TYR A 1 88 ? -12.621 -2.452 -30.712 1.00 91.68 88 A 1 ATOM 695 C CB . TYR A 1 88 ? -13.012 -3.964 -33.434 1.00 93.13 88 A 1 ATOM 696 C CG . TYR A 1 88 ? -13.948 -2.995 -34.132 1.00 92.80 88 A 1 ATOM 697 C CD1 . TYR A 1 88 ? -15.229 -2.755 -33.604 1.00 89.60 88 A 1 ATOM 698 C CD2 . TYR A 1 88 ? -13.536 -2.318 -35.300 1.00 90.82 88 A 1 ATOM 699 C CE1 . TYR A 1 88 ? -16.101 -1.860 -34.250 1.00 89.07 88 A 1 ATOM 700 C CE2 . TYR A 1 88 ? -14.407 -1.418 -35.946 1.00 89.65 88 A 1 ATOM 701 C CZ . TYR A 1 88 ? -15.695 -1.193 -35.423 1.00 90.66 88 A 1 ATOM 702 O OH . TYR A 1 88 ? -16.555 -0.338 -36.039 1.00 88.93 88 A 1 ATOM 703 N N . SER A 1 89 ? -12.046 -0.920 -32.241 1.00 92.51 89 A 1 ATOM 704 C CA . SER A 1 89 ? -12.490 0.252 -31.488 1.00 90.72 89 A 1 ATOM 705 C C . SER A 1 89 ? -13.724 0.854 -32.156 1.00 91.05 89 A 1 ATOM 706 O O . SER A 1 89 ? -13.567 1.555 -33.162 1.00 90.77 89 A 1 ATOM 707 C CB . SER A 1 89 ? -11.366 1.281 -31.404 1.00 89.32 89 A 1 ATOM 708 O OG . SER A 1 89 ? -11.807 2.441 -30.720 1.00 83.82 89 A 1 ATOM 709 N N . PRO A 1 90 ? -14.944 0.676 -31.587 1.00 92.14 90 A 1 ATOM 710 C CA . PRO A 1 90 ? -16.172 1.252 -32.145 1.00 90.51 90 A 1 ATOM 711 C C . PRO A 1 90 ? -16.122 2.783 -32.235 1.00 90.54 90 A 1 ATOM 712 O O . PRO A 1 90 ? -16.570 3.372 -33.207 1.00 88.56 90 A 1 ATOM 713 C CB . PRO A 1 90 ? -17.305 0.784 -31.222 1.00 89.79 90 A 1 ATOM 714 C CG . PRO A 1 90 ? -16.757 -0.485 -30.579 1.00 88.35 90 A 1 ATOM 715 C CD . PRO A 1 90 ? -15.268 -0.193 -30.459 1.00 91.19 90 A 1 ATOM 716 N N . GLN A 1 91 ? -15.502 3.430 -31.242 1.00 90.49 91 A 1 ATOM 717 C CA . GLN A 1 91 ? -15.381 4.895 -31.203 1.00 88.61 91 A 1 ATOM 718 C C . GLN A 1 91 ? -14.471 5.477 -32.296 1.00 89.35 91 A 1 ATOM 719 O O . GLN A 1 91 ? -14.529 6.673 -32.585 1.00 87.54 91 A 1 ATOM 720 C CB . GLN A 1 91 ? -14.808 5.320 -29.843 1.00 86.59 91 A 1 ATOM 721 C CG . GLN A 1 91 ? -15.724 5.008 -28.653 1.00 77.42 91 A 1 ATOM 722 C CD . GLN A 1 91 ? -15.109 5.462 -27.330 1.00 72.80 91 A 1 ATOM 723 O OE1 . GLN A 1 91 ? -13.998 5.978 -27.260 1.00 67.19 91 A 1 ATOM 724 N NE2 . GLN A 1 91 ? -15.801 5.278 -26.231 1.00 62.99 91 A 1 ATOM 725 N N . LYS A 1 92 ? -13.565 4.670 -32.830 1.00 88.99 92 A 1 ATOM 726 C CA . LYS A 1 92 ? -12.584 5.082 -33.847 1.00 88.01 92 A 1 ATOM 727 C C . LYS A 1 92 ? -12.815 4.413 -35.197 1.00 89.71 92 A 1 ATOM 728 O O . LYS A 1 92 ? -12.063 4.712 -36.116 1.00 86.97 92 A 1 ATOM 729 C CB . LYS A 1 92 ? -11.156 4.810 -33.326 1.00 86.41 92 A 1 ATOM 730 C CG . LYS A 1 92 ? -10.772 5.588 -32.058 1.00 83.73 92 A 1 ATOM 731 C CD . LYS A 1 92 ? -10.814 7.111 -32.265 1.00 78.83 92 A 1 ATOM 732 C CE . LYS A 1 92 ? -10.322 7.825 -31.001 1.00 76.06 92 A 1 ATOM 733 N NZ . LYS A 1 92 ? -10.483 9.294 -31.121 1.00 67.37 92 A 1 ATOM 734 N N . ASP A 1 93 ? -13.793 3.510 -35.261 1.00 90.58 93 A 1 ATOM 735 C CA . ASP A 1 93 ? -14.129 2.680 -36.417 1.00 90.81 93 A 1 ATOM 736 C C . ASP A 1 93 ? -12.889 2.062 -37.099 1.00 91.32 93 A 1 ATOM 737 O O . ASP A 1 93 ? -12.662 2.182 -38.301 1.00 88.30 93 A 1 ATOM 738 C CB . ASP A 1 93 ? -15.070 3.430 -37.369 1.00 90.16 93 A 1 ATOM 739 C CG . ASP A 1 93 ? -15.679 2.477 -38.400 1.00 87.35 93 A 1 ATOM 740 O OD1 . ASP A 1 93 ? -15.811 1.272 -38.066 1.00 83.38 93 A 1 ATOM 741 O OD2 . ASP A 1 93 ? -15.993 2.962 -39.506 1.00 83.74 93 A 1 ATOM 742 N N . LYS A 1 94 ? -12.011 1.453 -36.292 1.00 92.40 94 A 1 ATOM 743 C CA . LYS A 1 94 ? -10.794 0.820 -36.801 1.00 91.91 94 A 1 ATOM 744 C C . LYS A 1 94 ? -10.252 -0.246 -35.856 1.00 93.92 94 A 1 ATOM 745 O O . LYS A 1 94 ? -10.491 -0.224 -34.651 1.00 92.80 94 A 1 ATOM 746 C CB . LYS A 1 94 ? -9.726 1.881 -37.126 1.00 88.10 94 A 1 ATOM 747 C CG . LYS A 1 94 ? -9.172 2.599 -35.894 1.00 79.65 94 A 1 ATOM 748 C CD . LYS A 1 94 ? -8.200 3.702 -36.331 1.00 79.40 94 A 1 ATOM 749 C CE . LYS A 1 94 ? -7.644 4.407 -35.103 1.00 71.70 94 A 1 ATOM 750 N NZ . LYS A 1 94 ? -6.592 5.376 -35.496 1.00 64.61 94 A 1 ATOM 751 N N . MET A 1 95 ? -9.440 -1.137 -36.421 1.00 93.00 95 A 1 ATOM 752 C CA . MET A 1 95 ? -8.633 -2.066 -35.639 1.00 93.88 95 A 1 ATOM 753 C C . MET A 1 95 ? -7.440 -1.325 -35.023 1.00 94.51 95 A 1 ATOM 754 O O . MET A 1 95 ? -6.680 -0.663 -35.738 1.00 93.15 95 A 1 ATOM 755 C CB . MET A 1 95 ? -8.164 -3.242 -36.505 1.00 93.47 95 A 1 ATOM 756 C CG . MET A 1 95 ? -9.328 -4.040 -37.113 1.00 90.03 95 A 1 ATOM 757 S SD . MET A 1 95 ? -10.527 -4.721 -35.936 1.00 88.08 95 A 1 ATOM 758 C CE . MET A 1 95 ? -9.581 -6.066 -35.193 1.00 77.28 95 A 1 ATOM 759 N N . ILE A 1 96 ? -7.282 -1.462 -33.710 1.00 93.51 96 A 1 ATOM 760 C CA . ILE A 1 96 ? -6.142 -0.959 -32.944 1.00 92.56 96 A 1 ATOM 761 C C . ILE A 1 96 ? -5.125 -2.092 -32.792 1.00 93.82 96 A 1 ATOM 762 O O . ILE A 1 96 ? -5.493 -3.203 -32.411 1.00 93.67 96 A 1 ATOM 763 C CB . ILE A 1 96 ? -6.605 -0.409 -31.576 1.00 91.66 96 A 1 ATOM 764 C CG1 . ILE A 1 96 ? -7.679 0.698 -31.697 1.00 89.12 96 A 1 ATOM 765 C CG2 . ILE A 1 96 ? -5.412 0.099 -30.750 1.00 88.92 96 A 1 ATOM 766 C CD1 . ILE A 1 96 ? -7.278 1.912 -32.535 1.00 81.46 96 A 1 ATOM 767 N N . GLY A 1 97 ? -3.862 -1.808 -33.090 1.00 94.09 97 A 1 ATOM 768 C CA . GLY A 1 97 ? -2.770 -2.752 -32.888 1.00 93.53 97 A 1 ATOM 769 C C . GLY A 1 97 ? -2.320 -2.809 -31.430 1.00 94.17 97 A 1 ATOM 770 O O . GLY A 1 97 ? -2.185 -1.771 -30.785 1.00 93.41 97 A 1 ATOM 771 N N . ILE A 1 98 ? -2.087 -4.022 -30.934 1.00 94.62 98 A 1 ATOM 772 C CA . ILE A 1 98 ? -1.548 -4.293 -29.600 1.00 94.16 98 A 1 ATOM 773 C C . ILE A 1 98 ? -0.210 -5.004 -29.778 1.00 94.48 98 A 1 ATOM 774 O O . ILE A 1 98 ? -0.121 -6.021 -30.468 1.00 94.34 98 A 1 ATOM 775 C CB . ILE A 1 98 ? -2.526 -5.131 -28.744 1.00 93.56 98 A 1 ATOM 776 C CG1 . ILE A 1 98 ? -3.910 -4.446 -28.632 1.00 91.80 98 A 1 ATOM 777 C CG2 . ILE A 1 98 ? -1.928 -5.397 -27.351 1.00 91.79 98 A 1 ATOM 778 C CD1 . ILE A 1 98 ? -4.980 -5.304 -27.952 1.00 88.45 98 A 1 ATOM 779 N N . THR A 1 99 ? 0.817 -4.464 -29.138 1.00 95.31 99 A 1 ATOM 780 C CA . THR A 1 99 ? 2.136 -5.086 -29.068 1.00 93.91 99 A 1 ATOM 781 C C . THR A 1 99 ? 2.237 -5.866 -27.768 1.00 93.73 99 A 1 ATOM 782 O O . THR A 1 99 ? 2.002 -5.313 -26.691 1.00 92.99 99 A 1 ATOM 783 C CB . THR A 1 99 ? 3.247 -4.036 -29.172 1.00 92.94 99 A 1 ATOM 784 O OG1 . THR A 1 99 ? 3.092 -3.325 -30.381 1.00 87.68 99 A 1 ATOM 785 C CG2 . THR A 1 99 ? 4.639 -4.651 -29.196 1.00 86.59 99 A 1 ATOM 786 N N . GLN A 1 100 ? 2.580 -7.148 -27.873 1.00 94.14 100 A 1 ATOM 787 C CA . GLN A 1 100 ? 2.922 -7.986 -26.729 1.00 92.95 100 A 1 ATOM 788 C C . GLN A 1 100 ? 4.440 -8.027 -26.579 1.00 92.62 100 A 1 ATOM 789 O O . GLN A 1 100 ? 5.159 -8.328 -27.533 1.00 90.94 100 A 1 ATOM 790 C CB . GLN A 1 100 ? 2.315 -9.382 -26.913 1.00 91.59 100 A 1 ATOM 791 C CG . GLN A 1 100 ? 2.494 -10.257 -25.664 1.00 84.55 100 A 1 ATOM 792 C CD . GLN A 1 100 ? 1.845 -11.631 -25.818 1.00 83.57 100 A 1 ATOM 793 O OE1 . GLN A 1 100 ? 1.412 -12.040 -26.887 1.00 77.76 100 A 1 ATOM 794 N NE2 . GLN A 1 100 ? 1.744 -12.403 -24.760 1.00 75.35 100 A 1 ATOM 795 N N . GLY A 1 101 ? 4.915 -7.744 -25.379 1.00 92.30 101 A 1 ATOM 796 C CA . GLY A 1 101 ? 6.329 -7.799 -25.037 1.00 91.01 101 A 1 ATOM 797 C C . GLY A 1 101 ? 6.542 -8.395 -23.650 1.00 92.05 101 A 1 ATOM 798 O O . GLY A 1 101 ? 5.597 -8.787 -22.965 1.00 90.98 101 A 1 ATOM 799 N N . ILE A 1 102 ? 7.797 -8.430 -23.241 1.00 90.95 102 A 1 ATOM 800 C CA . ILE A 1 102 ? 8.218 -8.860 -21.907 1.00 91.26 102 A 1 ATOM 801 C C . ILE A 1 102 ? 8.564 -7.609 -21.093 1.00 91.63 102 A 1 ATOM 802 O O . ILE A 1 102 ? 9.139 -6.648 -21.610 1.00 90.21 102 A 1 ATOM 803 C CB . ILE A 1 102 ? 9.382 -9.873 -22.003 1.00 90.03 102 A 1 ATOM 804 C CG1 . ILE A 1 102 ? 8.948 -11.111 -22.833 1.00 85.51 102 A 1 ATOM 805 C CG2 . ILE A 1 102 ? 9.845 -10.296 -20.599 1.00 85.90 102 A 1 ATOM 806 C CD1 . ILE A 1 102 ? 10.085 -12.097 -23.137 1.00 78.18 102 A 1 ATOM 807 N N . SER A 1 103 ? 8.189 -7.616 -19.821 1.00 91.97 103 A 1 ATOM 808 C CA . SER A 1 103 ? 8.636 -6.628 -18.843 1.00 91.62 103 A 1 ATOM 809 C C . SER A 1 103 ? 9.122 -7.325 -17.588 1.00 93.09 103 A 1 ATOM 810 O O . SER A 1 103 ? 8.641 -8.403 -17.266 1.00 92.45 103 A 1 ATOM 811 C CB . SER A 1 103 ? 7.524 -5.640 -18.496 1.00 89.39 103 A 1 ATOM 812 O OG . SER A 1 103 ? 6.403 -6.258 -17.890 1.00 80.07 103 A 1 ATOM 813 N N . HIS A 1 104 ? 9.998 -6.670 -16.842 1.00 93.90 104 A 1 ATOM 814 C CA . HIS A 1 104 ? 10.415 -7.143 -15.530 1.00 94.02 104 A 1 ATOM 815 C C . HIS A 1 104 ? 9.505 -6.573 -14.445 1.00 94.76 104 A 1 ATOM 816 O O . HIS A 1 104 ? 9.085 -5.412 -14.507 1.00 93.80 104 A 1 ATOM 817 C CB . HIS A 1 104 ? 11.886 -6.799 -15.301 1.00 92.43 104 A 1 ATOM 818 C CG . HIS A 1 104 ? 12.782 -7.461 -16.321 1.00 87.80 104 A 1 ATOM 819 N ND1 . HIS A 1 104 ? 13.092 -6.968 -17.569 1.00 75.89 104 A 1 ATOM 820 C CD2 . HIS A 1 104 ? 13.391 -8.679 -16.204 1.00 76.21 104 A 1 ATOM 821 C CE1 . HIS A 1 104 ? 13.873 -7.868 -18.190 1.00 75.14 104 A 1 ATOM 822 N NE2 . HIS A 1 104 ? 14.084 -8.930 -17.396 1.00 77.21 104 A 1 ATOM 823 N N . ILE A 1 105 ? 9.223 -7.402 -13.447 1.00 95.21 105 A 1 ATOM 824 C CA . ILE A 1 105 ? 8.493 -7.030 -12.243 1.00 95.51 105 A 1 ATOM 825 C C . ILE A 1 105 ? 9.338 -7.353 -11.018 1.00 95.95 105 A 1 ATOM 826 O O . ILE A 1 105 ? 9.966 -8.401 -10.943 1.00 95.14 105 A 1 ATOM 827 C CB . ILE A 1 105 ? 7.089 -7.671 -12.234 1.00 94.50 105 A 1 ATOM 828 C CG1 . ILE A 1 105 ? 6.265 -7.125 -11.046 1.00 86.80 105 A 1 ATOM 829 C CG2 . ILE A 1 105 ? 7.128 -9.211 -12.230 1.00 87.01 105 A 1 ATOM 830 C CD1 . ILE A 1 105 ? 4.768 -7.371 -11.205 1.00 82.42 105 A 1 ATOM 831 N N . HIS A 1 106 ? 9.365 -6.415 -10.073 1.00 96.59 106 A 1 ATOM 832 C CA . HIS A 1 106 ? 10.049 -6.570 -8.797 1.00 96.30 106 A 1 ATOM 833 C C . HIS A 1 106 ? 9.043 -7.084 -7.765 1.00 96.71 106 A 1 ATOM 834 O O . HIS A 1 106 ? 8.047 -6.412 -7.486 1.00 96.25 106 A 1 ATOM 835 C CB . HIS A 1 106 ? 10.658 -5.220 -8.411 1.00 94.76 106 A 1 ATOM 836 C CG . HIS A 1 106 ? 11.442 -5.227 -7.128 1.00 84.59 106 A 1 ATOM 837 N ND1 . HIS A 1 106 ? 11.429 -4.222 -6.179 1.00 71.26 106 A 1 ATOM 838 C CD2 . HIS A 1 106 ? 12.332 -6.175 -6.729 1.00 72.54 106 A 1 ATOM 839 C CE1 . HIS A 1 106 ? 12.311 -4.560 -5.237 1.00 69.69 106 A 1 ATOM 840 N NE2 . HIS A 1 106 ? 12.885 -5.737 -5.530 1.00 74.18 106 A 1 ATOM 841 N N . LEU A 1 107 ? 9.289 -8.270 -7.239 1.00 96.91 107 A 1 ATOM 842 C CA . LEU A 1 107 ? 8.440 -8.938 -6.262 1.00 97.00 107 A 1 ATOM 843 C C . LEU A 1 107 ? 9.130 -8.944 -4.901 1.00 97.31 107 A 1 ATOM 844 O O . LEU A 1 107 ? 10.318 -9.240 -4.802 1.00 96.81 107 A 1 ATOM 845 C CB . LEU A 1 107 ? 8.117 -10.370 -6.722 1.00 96.54 107 A 1 ATOM 846 C CG . LEU A 1 107 ? 7.383 -10.479 -8.071 1.00 95.67 107 A 1 ATOM 847 C CD1 . LEU A 1 107 ? 7.168 -11.948 -8.429 1.00 94.24 107 A 1 ATOM 848 C CD2 . LEU A 1 107 ? 6.017 -9.788 -8.032 1.00 94.04 107 A 1 ATOM 849 N N . ILE A 1 108 ? 8.358 -8.628 -3.870 1.00 97.66 108 A 1 ATOM 850 C CA . ILE A 1 108 ? 8.732 -8.887 -2.478 1.00 97.73 108 A 1 ATOM 851 C C . ILE A 1 108 ? 8.356 -10.339 -2.183 1.00 97.71 108 A 1 ATOM 852 O O . ILE A 1 108 ? 7.281 -10.771 -2.595 1.00 97.27 108 A 1 ATOM 853 C CB . ILE A 1 108 ? 7.996 -7.909 -1.544 1.00 97.62 108 A 1 ATOM 854 C CG1 . ILE A 1 108 ? 8.315 -6.438 -1.908 1.00 96.50 108 A 1 ATOM 855 C CG2 . ILE A 1 108 ? 8.373 -8.191 -0.081 1.00 96.58 108 A 1 ATOM 856 C CD1 . ILE A 1 108 ? 7.390 -5.444 -1.207 1.00 91.77 108 A 1 ATOM 857 N N . THR A 1 109 ? 9.207 -11.074 -1.468 1.00 97.75 109 A 1 ATOM 858 C CA . THR A 1 109 ? 8.961 -12.479 -1.111 1.00 97.54 109 A 1 ATOM 859 C C . THR A 1 109 ? 8.842 -12.657 0.397 1.00 97.64 109 A 1 ATOM 860 O O . THR A 1 109 ? 9.476 -11.924 1.156 1.00 96.80 109 A 1 ATOM 861 C CB . THR A 1 109 ? 10.047 -13.419 -1.661 1.00 96.77 109 A 1 ATOM 862 O OG1 . THR A 1 109 ? 11.297 -13.126 -1.085 1.00 91.15 109 A 1 ATOM 863 C CG2 . THR A 1 109 ? 10.202 -13.297 -3.174 1.00 89.44 109 A 1 ATOM 864 N N . ASP A 1 110 ? 8.040 -13.646 0.814 1.00 97.67 110 A 1 ATOM 865 C CA . ASP A 1 110 ? 7.807 -14.003 2.218 1.00 97.74 110 A 1 ATOM 866 C C . ASP A 1 110 ? 7.457 -12.784 3.081 1.00 98.02 110 A 1 ATOM 867 O O . ASP A 1 110 ? 8.113 -12.461 4.077 1.00 97.04 110 A 1 ATOM 868 C CB . ASP A 1 110 ? 8.987 -14.818 2.765 1.00 96.68 110 A 1 ATOM 869 C CG . ASP A 1 110 ? 9.136 -16.166 2.061 1.00 91.27 110 A 1 ATOM 870 O OD1 . ASP A 1 110 ? 8.099 -16.864 1.963 1.00 85.45 110 A 1 ATOM 871 O OD2 . ASP A 1 110 ? 10.277 -16.493 1.672 1.00 84.80 110 A 1 ATOM 872 N N . LEU A 1 111 ? 6.428 -12.054 2.653 1.00 97.75 111 A 1 ATOM 873 C CA . LEU A 1 111 ? 6.025 -10.805 3.285 1.00 97.96 111 A 1 ATOM 874 C C . LEU A 1 111 ? 5.038 -11.069 4.425 1.00 98.22 111 A 1 ATOM 875 O O . LEU A 1 111 ? 3.914 -11.531 4.213 1.00 98.02 111 A 1 ATOM 876 C CB . LEU A 1 111 ? 5.472 -9.863 2.205 1.00 97.75 111 A 1 ATOM 877 C CG . LEU A 1 111 ? 4.938 -8.527 2.739 1.00 96.82 111 A 1 ATOM 878 C CD1 . LEU A 1 111 ? 6.024 -7.674 3.395 1.00 94.36 111 A 1 ATOM 879 C CD2 . LEU A 1 111 ? 4.348 -7.721 1.579 1.00 94.89 111 A 1 ATOM 880 N N . HIS A 1 112 ? 5.446 -10.709 5.631 1.00 98.32 112 A 1 ATOM 881 C CA . HIS A 1 112 ? 4.618 -10.700 6.832 1.00 98.33 112 A 1 ATOM 882 C C . HIS A 1 112 ? 4.219 -9.263 7.153 1.00 98.40 112 A 1 ATOM 883 O O . HIS A 1 112 ? 5.088 -8.418 7.355 1.00 97.89 112 A 1 ATOM 884 C CB . HIS A 1 112 ? 5.393 -11.329 7.988 1.00 97.95 112 A 1 ATOM 885 C CG . HIS A 1 112 ? 5.667 -12.796 7.782 1.00 97.50 112 A 1 ATOM 886 N ND1 . HIS A 1 112 ? 4.902 -13.831 8.268 1.00 88.48 112 A 1 ATOM 887 C CD2 . HIS A 1 112 ? 6.700 -13.351 7.083 1.00 90.23 112 A 1 ATOM 888 C CE1 . HIS A 1 112 ? 5.474 -14.987 7.880 1.00 91.23 112 A 1 ATOM 889 N NE2 . HIS A 1 112 ? 6.570 -14.743 7.151 1.00 92.99 112 A 1 ATOM 890 N N . LEU A 1 113 ? 2.925 -8.989 7.221 1.00 98.42 113 A 1 ATOM 891 C CA . LEU A 1 113 ? 2.407 -7.663 7.549 1.00 98.44 113 A 1 ATOM 892 C C . LEU A 1 113 ? 1.609 -7.693 8.844 1.00 98.50 113 A 1 ATOM 893 O O . LEU A 1 113 ? 0.836 -8.620 9.098 1.00 98.21 113 A 1 ATOM 894 C CB . LEU A 1 113 ? 1.544 -7.104 6.408 1.00 98.33 113 A 1 ATOM 895 C CG . LEU A 1 113 ? 2.257 -6.928 5.062 1.00 97.78 113 A 1 ATOM 896 C CD1 . LEU A 1 113 ? 1.226 -6.577 3.989 1.00 97.04 113 A 1 ATOM 897 C CD2 . LEU A 1 113 ? 3.294 -5.809 5.121 1.00 96.87 113 A 1 ATOM 898 N N . GLN A 1 114 ? 1.749 -6.622 9.603 1.00 98.48 114 A 1 ATOM 899 C CA . GLN A 1 114 ? 0.887 -6.249 10.712 1.00 98.50 114 A 1 ATOM 900 C C . GLN A 1 114 ? 0.245 -4.908 10.375 1.00 98.59 114 A 1 ATOM 901 O O . GLN A 1 114 ? 0.924 -3.893 10.220 1.00 98.31 114 A 1 ATOM 902 C CB . GLN A 1 114 ? 1.712 -6.219 12.000 1.00 98.08 114 A 1 ATOM 903 C CG . GLN A 1 114 ? 0.884 -5.787 13.222 1.00 96.44 114 A 1 ATOM 904 C CD . GLN A 1 114 ? 1.742 -5.929 14.481 1.00 95.83 114 A 1 ATOM 905 O OE1 . GLN A 1 114 ? 2.571 -5.102 14.804 1.00 88.48 114 A 1 ATOM 906 N NE2 . GLN A 1 114 ? 1.622 -7.024 15.200 1.00 86.73 114 A 1 ATOM 907 N N . LEU A 1 115 ? -1.069 -4.929 10.220 1.00 98.55 115 A 1 ATOM 908 C CA . LEU A 1 115 ? -1.860 -3.767 9.852 1.00 98.59 115 A 1 ATOM 909 C C . LEU A 1 115 ? -2.772 -3.402 11.020 1.00 98.64 115 A 1 ATOM 910 O O . LEU A 1 115 ? -3.434 -4.275 11.574 1.00 98.40 115 A 1 ATOM 911 C CB . LEU A 1 115 ? -2.666 -4.065 8.573 1.00 98.51 115 A 1 ATOM 912 C CG . LEU A 1 115 ? -1.848 -4.616 7.386 1.00 98.07 115 A 1 ATOM 913 C CD1 . LEU A 1 115 ? -2.779 -4.945 6.220 1.00 97.37 115 A 1 ATOM 914 C CD2 . LEU A 1 115 ? -0.802 -3.612 6.895 1.00 97.21 115 A 1 ATOM 915 N N . HIS A 1 116 ? -2.841 -2.123 11.360 1.00 98.67 116 A 1 ATOM 916 C CA . HIS A 1 116 ? -3.885 -1.597 12.232 1.00 98.66 116 A 1 ATOM 917 C C . HIS A 1 116 ? -4.837 -0.755 11.394 1.00 98.66 116 A 1 ATOM 918 O O . HIS A 1 116 ? -4.397 0.107 10.640 1.00 98.36 116 A 1 ATOM 919 C CB . HIS A 1 116 ? -3.294 -0.806 13.400 1.00 98.50 116 A 1 ATOM 920 C CG . HIS A 1 116 ? -2.410 -1.633 14.293 1.00 98.39 116 A 1 ATOM 921 N ND1 . HIS A 1 116 ? -1.074 -1.923 14.061 1.00 94.10 116 A 1 ATOM 922 C CD2 . HIS A 1 116 ? -2.772 -2.213 15.473 1.00 94.84 116 A 1 ATOM 923 C CE1 . HIS A 1 116 ? -0.646 -2.658 15.095 1.00 95.17 116 A 1 ATOM 924 N NE2 . HIS A 1 116 ? -1.642 -2.855 15.975 1.00 95.81 116 A 1 ATOM 925 N N . ILE A 1 117 ? -6.133 -1.029 11.511 1.00 98.70 117 A 1 ATOM 926 C CA . ILE A 1 117 ? -7.199 -0.335 10.791 1.00 98.71 117 A 1 ATOM 927 C C . ILE A 1 117 ? -8.068 0.354 11.836 1.00 98.74 117 A 1 ATOM 928 O O . ILE A 1 117 ? -8.634 -0.313 12.702 1.00 98.57 117 A 1 ATOM 929 C CB . ILE A 1 117 ? -8.010 -1.332 9.937 1.00 98.56 117 A 1 ATOM 930 C CG1 . ILE A 1 117 ? -7.131 -2.086 8.911 1.00 97.54 117 A 1 ATOM 931 C CG2 . ILE A 1 117 ? -9.165 -0.606 9.217 1.00 98.09 117 A 1 ATOM 932 C CD1 . ILE A 1 117 ? -7.690 -3.471 8.570 1.00 93.00 117 A 1 ATOM 933 N N . ILE A 1 118 ? -8.179 1.675 11.749 1.00 98.57 118 A 1 ATOM 934 C CA . ILE A 1 118 ? -8.870 2.523 12.717 1.00 98.55 118 A 1 ATOM 935 C C . ILE A 1 118 ? -9.966 3.294 11.971 1.00 98.54 118 A 1 ATOM 936 O O . ILE A 1 118 ? -9.685 4.349 11.399 1.00 98.14 118 A 1 ATOM 937 C CB . ILE A 1 118 ? -7.869 3.461 13.434 1.00 98.33 118 A 1 ATOM 938 C CG1 . ILE A 1 118 ? -6.691 2.670 14.056 1.00 97.30 118 A 1 ATOM 939 C CG2 . ILE A 1 118 ? -8.616 4.262 14.511 1.00 97.20 118 A 1 ATOM 940 C CD1 . ILE A 1 118 ? -5.592 3.552 14.656 1.00 94.23 118 A 1 ATOM 941 N N . PRO A 1 119 ? -11.202 2.774 11.913 1.00 98.49 119 A 1 ATOM 942 C CA . PRO A 1 119 ? -12.309 3.493 11.297 1.00 98.38 119 A 1 ATOM 943 C C . PRO A 1 119 ? -12.595 4.802 12.041 1.00 98.27 119 A 1 ATOM 944 O O . PRO A 1 119 ? -12.578 4.825 13.275 1.00 97.69 119 A 1 ATOM 945 C CB . PRO A 1 119 ? -13.508 2.540 11.346 1.00 98.02 119 A 1 ATOM 946 C CG . PRO A 1 119 ? -12.870 1.165 11.550 1.00 96.59 119 A 1 ATOM 947 C CD . PRO A 1 119 ? -11.638 1.474 12.379 1.00 98.28 119 A 1 ATOM 948 N N . GLU A 1 120 ? -12.899 5.877 11.306 1.00 98.10 120 A 1 ATOM 949 C CA . GLU A 1 120 ? -13.384 7.115 11.937 1.00 97.74 120 A 1 ATOM 950 C C . GLU A 1 120 ? -14.726 6.870 12.640 1.00 97.90 120 A 1 ATOM 951 O O . GLU A 1 120 ? -14.909 7.277 13.790 1.00 96.80 120 A 1 ATOM 952 C CB . GLU A 1 120 ? -13.540 8.237 10.898 1.00 96.86 120 A 1 ATOM 953 C CG . GLU A 1 120 ? -12.199 8.849 10.459 1.00 87.88 120 A 1 ATOM 954 C CD . GLU A 1 120 ? -12.366 10.025 9.471 1.00 85.34 120 A 1 ATOM 955 O OE1 . GLU A 1 120 ? -11.345 10.430 8.866 1.00 75.81 120 A 1 ATOM 956 O OE2 . GLU A 1 120 ? -13.507 10.508 9.278 1.00 78.33 120 A 1 ATOM 957 N N . ASP A 1 121 ? -15.628 6.133 11.990 1.00 97.59 121 A 1 ATOM 958 C CA . ASP A 1 121 ? -16.835 5.624 12.632 1.00 97.93 121 A 1 ATOM 959 C C . ASP A 1 121 ? -16.521 4.342 13.421 1.00 98.22 121 A 1 ATOM 960 O O . ASP A 1 121 ? -16.445 3.229 12.887 1.00 97.51 121 A 1 ATOM 961 C CB . ASP A 1 121 ? -17.961 5.421 11.609 1.00 97.55 121 A 1 ATOM 962 C CG . ASP A 1 121 ? -19.289 5.036 12.282 1.00 96.61 121 A 1 ATOM 963 O OD1 . ASP A 1 121 ? -19.307 4.796 13.516 1.00 93.57 121 A 1 ATOM 964 O OD2 . ASP A 1 121 ? -20.311 5.000 11.565 1.00 92.92 121 A 1 ATOM 965 N N . GLN A 1 122 ? -16.359 4.493 14.723 1.00 98.34 122 A 1 ATOM 966 C CA . GLN A 1 122 ? -16.046 3.385 15.631 1.00 98.38 122 A 1 ATOM 967 C C . GLN A 1 122 ? -17.166 2.328 15.725 1.00 98.50 122 A 1 ATOM 968 O O . GLN A 1 122 ? -16.912 1.230 16.221 1.00 97.89 122 A 1 ATOM 969 C CB . GLN A 1 122 ? -15.701 3.951 17.013 1.00 97.85 122 A 1 ATOM 970 C CG . GLN A 1 122 ? -14.368 4.725 17.030 1.00 96.85 122 A 1 ATOM 971 C CD . GLN A 1 122 ? -13.164 3.795 16.886 1.00 97.53 122 A 1 ATOM 972 O OE1 . GLN A 1 122 ? -12.849 3.030 17.790 1.00 92.79 122 A 1 ATOM 973 N NE2 . GLN A 1 122 ? -12.466 3.811 15.770 1.00 92.96 122 A 1 ATOM 974 N N . SER A 1 123 ? -18.378 2.615 15.251 1.00 98.05 123 A 1 ATOM 975 C CA . SER A 1 123 ? -19.451 1.612 15.192 1.00 98.06 123 A 1 ATOM 976 C C . SER A 1 123 ? -19.185 0.515 14.152 1.00 98.27 123 A 1 ATOM 977 O O . SER A 1 123 ? -19.673 -0.605 14.293 1.00 97.48 123 A 1 ATOM 978 C CB . SER A 1 123 ? -20.811 2.288 14.965 1.00 97.79 123 A 1 ATOM 979 O OG . SER A 1 123 ? -21.009 2.673 13.623 1.00 96.14 123 A 1 ATOM 980 N N . GLU A 1 124 ? -18.327 0.796 13.158 1.00 97.75 124 A 1 ATOM 981 C CA . GLU A 1 124 ? -17.976 -0.139 12.085 1.00 97.84 124 A 1 ATOM 982 C C . GLU A 1 124 ? -16.911 -1.173 12.487 1.00 98.21 124 A 1 ATOM 983 O O . GLU A 1 124 ? -16.741 -2.176 11.791 1.00 97.76 124 A 1 ATOM 984 C CB . GLU A 1 124 ? -17.510 0.632 10.841 1.00 97.27 124 A 1 ATOM 985 C CG . GLU A 1 124 ? -18.601 1.548 10.263 1.00 96.28 124 A 1 ATOM 986 C CD . GLU A 1 124 ? -18.207 2.162 8.915 1.00 96.12 124 A 1 ATOM 987 O OE1 . GLU A 1 124 ? -19.130 2.531 8.160 1.00 89.39 124 A 1 ATOM 988 O OE2 . GLU A 1 124 ? -17.000 2.198 8.581 1.00 91.09 124 A 1 ATOM 989 N N . VAL A 1 125 ? -16.217 -0.984 13.606 1.00 98.46 125 A 1 ATOM 990 C CA . VAL A 1 125 ? -15.059 -1.802 14.023 1.00 98.58 125 A 1 ATOM 991 C C . VAL A 1 125 ? -15.368 -3.305 13.997 1.00 98.66 125 A 1 ATOM 992 O O . VAL A 1 125 ? -14.685 -4.075 13.324 1.00 98.40 125 A 1 ATOM 993 C CB . VAL A 1 125 ? -14.566 -1.361 15.418 1.00 98.26 125 A 1 ATOM 994 C CG1 . VAL A 1 125 ? -13.526 -2.309 16.020 1.00 96.63 125 A 1 ATOM 995 C CG2 . VAL A 1 125 ? -13.919 0.025 15.350 1.00 96.51 125 A 1 ATOM 996 N N . TYR A 1 126 ? -16.431 -3.735 14.677 1.00 98.50 126 A 1 ATOM 997 C CA . TYR A 1 126 ? -16.795 -5.158 14.752 1.00 98.48 126 A 1 ATOM 998 C C . TYR A 1 126 ? -17.350 -5.701 13.429 1.00 98.53 126 A 1 ATOM 999 O O . TYR A 1 126 ? -17.193 -6.886 13.126 1.00 98.03 126 A 1 ATOM 1000 C CB . TYR A 1 126 ? -17.809 -5.368 15.882 1.00 98.27 126 A 1 ATOM 1001 C CG . TYR A 1 126 ? -17.237 -5.144 17.264 1.00 98.12 126 A 1 ATOM 1002 C CD1 . TYR A 1 126 ? -16.366 -6.100 17.825 1.00 96.43 126 A 1 ATOM 1003 C CD2 . TYR A 1 126 ? -17.561 -3.981 17.993 1.00 96.83 126 A 1 ATOM 1004 C CE1 . TYR A 1 126 ? -15.827 -5.901 19.113 1.00 95.96 126 A 1 ATOM 1005 C CE2 . TYR A 1 126 ? -17.025 -3.778 19.279 1.00 96.15 126 A 1 ATOM 1006 C CZ . TYR A 1 126 ? -16.158 -4.742 19.841 1.00 96.71 126 A 1 ATOM 1007 O OH . TYR A 1 126 ? -15.642 -4.553 21.085 1.00 94.94 126 A 1 ATOM 1008 N N . PHE A 1 127 ? -17.978 -4.844 12.616 1.00 98.30 127 A 1 ATOM 1009 C CA . PHE A 1 127 ? -18.412 -5.223 11.277 1.00 98.22 127 A 1 ATOM 1010 C C . PHE A 1 127 ? -17.205 -5.511 10.372 1.00 98.38 127 A 1 ATOM 1011 O O . PHE A 1 127 ? -17.158 -6.565 9.737 1.00 97.98 127 A 1 ATOM 1012 C CB . PHE A 1 127 ? -19.317 -4.129 10.697 1.00 97.92 127 A 1 ATOM 1013 C CG . PHE A 1 127 ? -19.695 -4.378 9.250 1.00 97.70 127 A 1 ATOM 1014 C CD1 . PHE A 1 127 ? -19.033 -3.687 8.217 1.00 96.13 127 A 1 ATOM 1015 C CD2 . PHE A 1 127 ? -20.686 -5.324 8.934 1.00 96.65 127 A 1 ATOM 1016 C CE1 . PHE A 1 127 ? -19.373 -3.935 6.874 1.00 95.66 127 A 1 ATOM 1017 C CE2 . PHE A 1 127 ? -21.024 -5.573 7.592 1.00 95.84 127 A 1 ATOM 1018 C CZ . PHE A 1 127 ? -20.370 -4.875 6.562 1.00 96.30 127 A 1 ATOM 1019 N N . ILE A 1 128 ? -16.213 -4.619 10.355 1.00 98.30 128 A 1 ATOM 1020 C CA . ILE A 1 128 ? -14.976 -4.792 9.584 1.00 98.34 128 A 1 ATOM 1021 C C . ILE A 1 128 ? -14.213 -6.036 10.059 1.00 98.40 128 A 1 ATOM 1022 O O . ILE A 1 128 ? -13.819 -6.857 9.231 1.00 98.25 128 A 1 ATOM 1023 C CB . ILE A 1 128 ? -14.112 -3.511 9.651 1.00 98.35 128 A 1 ATOM 1024 C CG1 . ILE A 1 128 ? -14.830 -2.329 8.957 1.00 97.83 128 A 1 ATOM 1025 C CG2 . ILE A 1 128 ? -12.740 -3.745 8.991 1.00 97.90 128 A 1 ATOM 1026 C CD1 . ILE A 1 128 ? -14.192 -0.965 9.235 1.00 96.67 128 A 1 ATOM 1027 N N . GLU A 1 129 ? -14.074 -6.236 11.366 1.00 98.25 129 A 1 ATOM 1028 C CA . GLU A 1 129 ? -13.456 -7.446 11.927 1.00 98.14 129 A 1 ATOM 1029 C C . GLU A 1 129 ? -14.153 -8.721 11.423 1.00 98.06 129 A 1 ATOM 1030 O O . GLU A 1 129 ? -13.506 -9.635 10.909 1.00 97.65 129 A 1 ATOM 1031 C CB . GLU A 1 129 ? -13.520 -7.399 13.465 1.00 97.78 129 A 1 ATOM 1032 C CG . GLU A 1 129 ? -12.752 -8.560 14.111 1.00 96.81 129 A 1 ATOM 1033 C CD . GLU A 1 129 ? -13.206 -8.905 15.536 1.00 96.41 129 A 1 ATOM 1034 O OE1 . GLU A 1 129 ? -12.407 -9.553 16.246 1.00 89.83 129 A 1 ATOM 1035 O OE2 . GLU A 1 129 ? -14.386 -8.674 15.873 1.00 91.30 129 A 1 ATOM 1036 N N . SER A 1 130 ? -15.486 -8.771 11.522 1.00 98.34 130 A 1 ATOM 1037 C CA . SER A 1 130 ? -16.279 -9.921 11.067 1.00 98.19 130 A 1 ATOM 1038 C C . SER A 1 130 ? -16.084 -10.199 9.572 1.00 98.20 130 A 1 ATOM 1039 O O . SER A 1 130 ? -15.969 -11.359 9.164 1.00 97.44 130 A 1 ATOM 1040 C CB . SER A 1 130 ? -17.757 -9.665 11.374 1.00 97.75 130 A 1 ATOM 1041 O OG . SER A 1 130 ? -18.555 -10.746 10.928 1.00 90.55 130 A 1 ATOM 1042 N N . LYS A 1 131 ? -16.012 -9.150 8.744 1.00 97.97 131 A 1 ATOM 1043 C CA . LYS A 1 131 ? -15.787 -9.272 7.298 1.00 97.71 131 A 1 ATOM 1044 C C . LYS A 1 131 ? -14.368 -9.712 6.945 1.00 97.73 131 A 1 ATOM 1045 O O . LYS A 1 131 ? -14.204 -10.450 5.979 1.00 96.93 131 A 1 ATOM 1046 C CB . LYS A 1 131 ? -16.143 -7.953 6.597 1.00 97.66 131 A 1 ATOM 1047 C CG . LYS A 1 131 ? -17.647 -7.642 6.607 1.00 96.71 131 A 1 ATOM 1048 C CD . LYS A 1 131 ? -18.456 -8.695 5.848 1.00 94.83 131 A 1 ATOM 1049 C CE . LYS A 1 131 ? -19.929 -8.291 5.796 1.00 91.77 131 A 1 ATOM 1050 N NZ . LYS A 1 131 ? -20.721 -9.329 5.111 1.00 84.40 131 A 1 ATOM 1051 N N . LEU A 1 132 ? -13.373 -9.310 7.723 1.00 97.91 132 A 1 ATOM 1052 C CA . LEU A 1 132 ? -11.995 -9.772 7.547 1.00 97.76 132 A 1 ATOM 1053 C C . LEU A 1 132 ? -11.810 -11.223 8.015 1.00 97.51 132 A 1 ATOM 1054 O O . LEU A 1 132 ? -11.081 -11.975 7.377 1.00 96.78 132 A 1 ATOM 1055 C CB . LEU A 1 132 ? -11.047 -8.817 8.288 1.00 97.86 132 A 1 ATOM 1056 C CG . LEU A 1 132 ? -10.907 -7.428 7.639 1.00 97.57 132 A 1 ATOM 1057 C CD1 . LEU A 1 132 ? -10.150 -6.499 8.577 1.00 96.67 132 A 1 ATOM 1058 C CD2 . LEU A 1 132 ? -10.145 -7.492 6.310 1.00 96.66 132 A 1 ATOM 1059 N N . LYS A 1 133 ? -12.518 -11.651 9.071 1.00 97.41 133 A 1 ATOM 1060 C CA . LYS A 1 133 ? -12.528 -13.055 9.519 1.00 96.76 133 A 1 ATOM 1061 C C . LYS A 1 133 ? -13.223 -13.987 8.525 1.00 96.34 133 A 1 ATOM 1062 O O . LYS A 1 133 ? -12.811 -15.133 8.371 1.00 94.69 133 A 1 ATOM 1063 C CB . LYS A 1 133 ? -13.193 -13.164 10.904 1.00 96.61 133 A 1 ATOM 1064 C CG . LYS A 1 133 ? -12.260 -12.671 12.017 1.00 95.70 133 A 1 ATOM 1065 C CD . LYS A 1 133 ? -12.908 -12.734 13.409 1.00 93.86 133 A 1 ATOM 1066 C CE . LYS A 1 133 ? -11.829 -12.397 14.443 1.00 90.93 133 A 1 ATOM 1067 N NZ . LYS A 1 133 ? -12.353 -12.180 15.809 1.00 84.99 133 A 1 ATOM 1068 N N . ASN A 1 134 ? -14.266 -13.503 7.852 1.00 96.61 134 A 1 ATOM 1069 C CA . ASN A 1 134 ? -15.085 -14.298 6.936 1.00 95.79 134 A 1 ATOM 1070 C C . ASN A 1 134 ? -15.316 -13.542 5.611 1.00 95.53 134 A 1 ATOM 1071 O O . ASN A 1 134 ? -16.443 -13.109 5.332 1.00 93.07 134 A 1 ATOM 1072 C CB . ASN A 1 134 ? -16.405 -14.682 7.637 1.00 94.57 134 A 1 ATOM 1073 C CG . ASN A 1 134 ? -16.188 -15.438 8.932 1.00 90.16 134 A 1 ATOM 1074 O OD1 . ASN A 1 134 ? -15.930 -16.622 8.955 1.00 81.63 134 A 1 ATOM 1075 N ND2 . ASN A 1 134 ? -16.286 -14.771 10.061 1.00 80.42 134 A 1 ATOM 1076 N N . PRO A 1 135 ? -14.264 -13.328 4.803 1.00 95.00 135 A 1 ATOM 1077 C CA . PRO A 1 135 ? -14.398 -12.595 3.552 1.00 93.88 135 A 1 ATOM 1078 C C . PRO A 1 135 ? -15.230 -13.397 2.542 1.00 93.65 135 A 1 ATOM 1079 O O . PRO A 1 135 ? -15.076 -14.607 2.392 1.00 91.50 135 A 1 ATOM 1080 C CB . PRO A 1 135 ? -12.963 -12.333 3.089 1.00 93.22 135 A 1 ATOM 1081 C CG . PRO A 1 135 ? -12.184 -13.513 3.664 1.00 92.02 135 A 1 ATOM 1082 C CD . PRO A 1 135 ? -12.892 -13.786 4.987 1.00 93.99 135 A 1 ATOM 1083 N N . SER A 1 136 ? -16.103 -12.711 1.802 1.00 92.40 136 A 1 ATOM 1084 C CA . SER A 1 136 ? -16.953 -13.330 0.769 1.00 90.51 136 A 1 ATOM 1085 C C . SER A 1 136 ? -16.194 -13.755 -0.495 1.00 90.65 136 A 1 ATOM 1086 O O . SER A 1 136 ? -16.738 -14.470 -1.337 1.00 86.66 136 A 1 ATOM 1087 C CB . SER A 1 136 ? -18.083 -12.367 0.392 1.00 88.83 136 A 1 ATOM 1088 O OG . SER A 1 136 ? -17.563 -11.130 -0.069 1.00 83.19 136 A 1 ATOM 1089 N N . GLN A 1 137 ? -14.958 -13.296 -0.639 1.00 93.36 137 A 1 ATOM 1090 C CA . GLN A 1 137 ? -14.031 -13.609 -1.721 1.00 93.26 137 A 1 ATOM 1091 C C . GLN A 1 137 ? -12.602 -13.585 -1.176 1.00 95.19 137 A 1 ATOM 1092 O O . GLN A 1 137 ? -12.361 -13.029 -0.105 1.00 93.88 137 A 1 ATOM 1093 C CB . GLN A 1 137 ? -14.214 -12.611 -2.884 1.00 89.67 137 A 1 ATOM 1094 C CG . GLN A 1 137 ? -14.004 -11.140 -2.488 1.00 83.71 137 A 1 ATOM 1095 C CD . GLN A 1 137 ? -14.156 -10.208 -3.686 1.00 83.92 137 A 1 ATOM 1096 O OE1 . GLN A 1 137 ? -15.161 -10.187 -4.382 1.00 77.29 137 A 1 ATOM 1097 N NE2 . GLN A 1 137 ? -13.167 -9.404 -3.992 1.00 75.31 137 A 1 ATOM 1098 N N . PHE A 1 138 ? -11.658 -14.167 -1.912 1.00 94.39 138 A 1 ATOM 1099 C CA . PHE A 1 138 ? -10.251 -14.036 -1.533 1.00 94.64 138 A 1 ATOM 1100 C C . PHE A 1 138 ? -9.829 -12.560 -1.538 1.00 95.92 138 A 1 ATOM 1101 O O . PHE A 1 138 ? -10.297 -11.763 -2.363 1.00 94.57 138 A 1 ATOM 1102 C CB . PHE A 1 138 ? -9.366 -14.888 -2.446 1.00 91.72 138 A 1 ATOM 1103 C CG . PHE A 1 138 ? -9.238 -14.373 -3.864 1.00 81.06 138 A 1 ATOM 1104 C CD1 . PHE A 1 138 ? -10.123 -14.818 -4.866 1.00 70.52 138 A 1 ATOM 1105 C CD2 . PHE A 1 138 ? -8.224 -13.448 -4.184 1.00 70.16 138 A 1 ATOM 1106 C CE1 . PHE A 1 138 ? -9.981 -14.355 -6.180 1.00 58.14 138 A 1 ATOM 1107 C CE2 . PHE A 1 138 ? -8.085 -12.983 -5.501 1.00 60.45 138 A 1 ATOM 1108 C CZ . PHE A 1 138 ? -8.960 -13.443 -6.497 1.00 57.75 138 A 1 ATOM 1109 N N . LEU A 1 139 ? -8.958 -12.199 -0.615 1.00 94.65 139 A 1 ATOM 1110 C CA . LEU A 1 139 ? -8.427 -10.847 -0.516 1.00 95.86 139 A 1 ATOM 1111 C C . LEU A 1 139 ? -6.995 -10.818 -1.045 1.00 96.28 139 A 1 ATOM 1112 O O . LEU A 1 139 ? -6.235 -11.773 -0.887 1.00 94.98 139 A 1 ATOM 1113 C CB . LEU A 1 139 ? -8.547 -10.339 0.929 1.00 95.94 139 A 1 ATOM 1114 C CG . LEU A 1 139 ? -9.989 -10.270 1.470 1.00 95.84 139 A 1 ATOM 1115 C CD1 . LEU A 1 139 ? -9.979 -9.803 2.925 1.00 93.83 139 A 1 ATOM 1116 C CD2 . LEU A 1 139 ? -10.871 -9.311 0.668 1.00 93.87 139 A 1 ATOM 1117 N N . SER A 1 140 ? -6.645 -9.716 -1.686 1.00 96.86 140 A 1 ATOM 1118 C CA . SER A 1 140 ? -5.311 -9.481 -2.233 1.00 96.79 140 A 1 ATOM 1119 C C . SER A 1 140 ? -4.794 -8.101 -1.825 1.00 97.06 140 A 1 ATOM 1120 O O . SER A 1 140 ? -5.573 -7.168 -1.609 1.00 95.96 140 A 1 ATOM 1121 C CB . SER A 1 140 ? -5.310 -9.657 -3.758 1.00 95.45 140 A 1 ATOM 1122 O OG . SER A 1 140 ? -6.206 -8.753 -4.390 1.00 90.38 140 A 1 ATOM 1123 N N . LEU A 1 141 ? -3.473 -7.974 -1.738 1.00 96.43 141 A 1 ATOM 1124 C CA . LEU A 1 141 ? -2.778 -6.705 -1.529 1.00 95.83 141 A 1 ATOM 1125 C C . LEU A 1 141 ? -1.781 -6.485 -2.668 1.00 94.85 141 A 1 ATOM 1126 O O . LEU A 1 141 ? -0.914 -7.314 -2.915 1.00 88.09 141 A 1 ATOM 1127 C CB . LEU A 1 141 ? -2.071 -6.706 -0.162 1.00 94.32 141 A 1 ATOM 1128 C CG . LEU A 1 141 ? -2.985 -6.460 1.054 1.00 92.94 141 A 1 ATOM 1129 C CD1 . LEU A 1 141 ? -2.198 -6.708 2.340 1.00 90.77 141 A 1 ATOM 1130 C CD2 . LEU A 1 141 ? -3.494 -5.021 1.102 1.00 90.47 141 A 1 ATOM 1131 N N . GLY A 1 142 ? -1.886 -5.353 -3.342 1.00 94.31 142 A 1 ATOM 1132 C CA . GLY A 1 142 ? -1.101 -5.067 -4.543 1.00 92.71 142 A 1 ATOM 1133 C C . GLY A 1 142 ? -1.856 -5.488 -5.799 1.00 92.65 142 A 1 ATOM 1134 O O . GLY A 1 142 ? -2.884 -4.884 -6.127 1.00 87.69 142 A 1 ATOM 1135 N N . ARG A 1 143 ? -1.334 -6.482 -6.516 1.00 93.77 143 A 1 ATOM 1136 C CA . ARG A 1 143 ? -1.993 -7.024 -7.704 1.00 93.23 143 A 1 ATOM 1137 C C . ARG A 1 143 ? -3.085 -8.021 -7.315 1.00 93.55 143 A 1 ATOM 1138 O O . ARG A 1 143 ? -3.122 -8.524 -6.201 1.00 92.17 143 A 1 ATOM 1139 C CB . ARG A 1 143 ? -0.967 -7.672 -8.648 1.00 92.17 143 A 1 ATOM 1140 C CG . ARG A 1 143 ? 0.255 -6.806 -8.960 1.00 91.50 143 A 1 ATOM 1141 C CD . ARG A 1 143 ? 1.331 -7.631 -9.682 1.00 89.88 143 A 1 ATOM 1142 N NE . ARG A 1 143 ? 1.887 -8.672 -8.807 1.00 87.15 143 A 1 ATOM 1143 C CZ . ARG A 1 143 ? 2.527 -9.770 -9.175 1.00 87.66 143 A 1 ATOM 1144 N NH1 . ARG A 1 143 ? 2.814 -10.026 -10.418 1.00 81.30 143 A 1 ATOM 1145 N NH2 . ARG A 1 143 ? 2.875 -10.647 -8.279 1.00 81.60 143 A 1 ATOM 1146 N N . HIS A 1 144 ? -3.972 -8.330 -8.241 1.00 92.72 144 A 1 ATOM 1147 C CA . HIS A 1 144 ? -5.064 -9.270 -7.958 1.00 92.73 144 A 1 ATOM 1148 C C . HIS A 1 144 ? -4.562 -10.687 -7.640 1.00 93.65 144 A 1 ATOM 1149 O O . HIS A 1 144 ? -5.171 -11.391 -6.841 1.00 90.74 144 A 1 ATOM 1150 C CB . HIS A 1 144 ? -6.025 -9.278 -9.146 1.00 90.65 144 A 1 ATOM 1151 C CG . HIS A 1 144 ? -7.322 -9.988 -8.849 1.00 81.73 144 A 1 ATOM 1152 N ND1 . HIS A 1 144 ? -8.258 -9.588 -7.925 1.00 69.55 144 A 1 ATOM 1153 C CD2 . HIS A 1 144 ? -7.802 -11.119 -9.457 1.00 68.84 144 A 1 ATOM 1154 C CE1 . HIS A 1 144 ? -9.285 -10.453 -7.981 1.00 66.39 144 A 1 ATOM 1155 N NE2 . HIS A 1 144 ? -9.056 -11.396 -8.903 1.00 69.16 144 A 1 ATOM 1156 N N . GLU A 1 145 ? -3.441 -11.080 -8.236 1.00 93.98 145 A 1 ATOM 1157 C CA . GLU A 1 145 ? -2.754 -12.342 -7.977 1.00 93.86 145 A 1 ATOM 1158 C C . GLU A 1 145 ? -1.933 -12.364 -6.671 1.00 94.43 145 A 1 ATOM 1159 O O . GLU A 1 145 ? -1.539 -13.442 -6.239 1.00 92.27 145 A 1 ATOM 1160 C CB . GLU A 1 145 ? -1.881 -12.719 -9.192 1.00 91.68 145 A 1 ATOM 1161 C CG . GLU A 1 145 ? -0.705 -11.779 -9.495 1.00 87.49 145 A 1 ATOM 1162 C CD . GLU A 1 145 ? -1.011 -10.640 -10.485 1.00 86.91 145 A 1 ATOM 1163 O OE1 . GLU A 1 145 ? -0.076 -10.280 -11.238 1.00 80.27 145 A 1 ATOM 1164 O OE2 . GLU A 1 145 ? -2.127 -10.083 -10.481 1.00 81.00 145 A 1 ATOM 1165 N N . ASP A 1 146 ? -1.691 -11.218 -6.032 1.00 92.67 146 A 1 ATOM 1166 C CA . ASP A 1 146 ? -0.980 -11.143 -4.748 1.00 93.14 146 A 1 ATOM 1167 C C . ASP A 1 146 ? -1.955 -11.462 -3.595 1.00 94.39 146 A 1 ATOM 1168 O O . ASP A 1 146 ? -2.332 -10.600 -2.790 1.00 92.82 146 A 1 ATOM 1169 C CB . ASP A 1 146 ? -0.275 -9.777 -4.579 1.00 92.29 146 A 1 ATOM 1170 C CG . ASP A 1 146 ? 0.767 -9.422 -5.650 1.00 91.49 146 A 1 ATOM 1171 O OD1 . ASP A 1 146 ? 1.446 -10.299 -6.229 1.00 87.45 146 A 1 ATOM 1172 O OD2 . ASP A 1 146 ? 0.927 -8.207 -5.937 1.00 88.02 146 A 1 ATOM 1173 N N . VAL A 1 147 ? -2.425 -12.716 -3.563 1.00 93.59 147 A 1 ATOM 1174 C CA . VAL A 1 147 ? -3.385 -13.218 -2.570 1.00 93.67 147 A 1 ATOM 1175 C C . VAL A 1 147 ? -2.742 -13.210 -1.189 1.00 94.61 147 A 1 ATOM 1176 O O . VAL A 1 147 ? -1.621 -13.682 -1.010 1.00 93.58 147 A 1 ATOM 1177 C CB . VAL A 1 147 ? -3.898 -14.628 -2.925 1.00 91.63 147 A 1 ATOM 1178 C CG1 . VAL A 1 147 ? -4.931 -15.137 -1.906 1.00 86.54 147 A 1 ATOM 1179 C CG2 . VAL A 1 147 ? -4.578 -14.634 -4.303 1.00 85.34 147 A 1 ATOM 1180 N N . MET A 1 148 ? -3.480 -12.700 -0.208 1.00 95.31 148 A 1 ATOM 1181 C CA . MET A 1 148 ? -3.012 -12.695 1.171 1.00 94.85 148 A 1 ATOM 1182 C C . MET A 1 148 ? -3.659 -13.812 1.991 1.00 95.97 148 A 1 ATOM 1183 O O . MET A 1 148 ? -4.863 -14.067 1.911 1.00 95.08 148 A 1 ATOM 1184 C CB . MET A 1 148 ? -3.177 -11.308 1.809 1.00 90.80 148 A 1 ATOM 1185 C CG . MET A 1 148 ? -4.621 -10.908 2.079 1.00 87.54 148 A 1 ATOM 1186 S SD . MET A 1 148 ? -4.729 -9.295 2.899 1.00 88.88 148 A 1 ATOM 1187 C CE . MET A 1 148 ? -6.491 -9.266 3.251 1.00 82.42 148 A 1 ATOM 1188 N N . MET A 1 149 ? -2.851 -14.439 2.839 1.00 97.34 149 A 1 ATOM 1189 C CA . MET A 1 149 ? -3.314 -15.347 3.880 1.00 97.28 149 A 1 ATOM 1190 C C . MET A 1 149 ? -3.491 -14.559 5.177 1.00 97.63 149 A 1 ATOM 1191 O O . MET A 1 149 ? -2.525 -14.043 5.734 1.00 97.10 149 A 1 ATOM 1192 C CB . MET A 1 149 ? -2.324 -16.504 4.032 1.00 96.29 149 A 1 ATOM 1193 C CG . MET A 1 149 ? -2.808 -17.525 5.067 1.00 86.22 149 A 1 ATOM 1194 S SD . MET A 1 149 ? -1.718 -18.962 5.281 1.00 81.93 149 A 1 ATOM 1195 C CE . MET A 1 149 ? -0.305 -18.194 6.102 1.00 68.96 149 A 1 ATOM 1196 N N . ILE A 1 150 ? -4.716 -14.503 5.672 1.00 97.59 150 A 1 ATOM 1197 C CA . ILE A 1 150 ? -5.010 -13.922 6.985 1.00 97.45 150 A 1 ATOM 1198 C C . ILE A 1 150 ? -4.571 -14.922 8.058 1.00 97.44 150 A 1 ATOM 1199 O O . ILE A 1 150 ? -5.060 -16.049 8.089 1.00 96.80 150 A 1 ATOM 1200 C CB . ILE A 1 150 ? -6.504 -13.555 7.086 1.00 97.02 150 A 1 ATOM 1201 C CG1 . ILE A 1 150 ? -6.857 -12.470 6.035 1.00 95.90 150 A 1 ATOM 1202 C CG2 . ILE A 1 150 ? -6.825 -13.078 8.509 1.00 95.96 150 A 1 ATOM 1203 C CD1 . ILE A 1 150 ? -8.344 -12.111 5.957 1.00 92.28 150 A 1 ATOM 1204 N N . LYS A 1 151 ? -3.646 -14.518 8.918 1.00 97.68 151 A 1 ATOM 1205 C CA . LYS A 1 151 ? -3.173 -15.329 10.051 1.00 97.40 151 A 1 ATOM 1206 C C . LYS A 1 151 ? -3.987 -15.071 11.310 1.00 97.58 151 A 1 ATOM 1207 O O . LYS A 1 151 ? -4.308 -16.009 12.023 1.00 96.55 151 A 1 ATOM 1208 C CB . LYS A 1 151 ? -1.687 -15.065 10.320 1.00 96.97 151 A 1 ATOM 1209 C CG . LYS A 1 151 ? -0.789 -15.590 9.193 1.00 94.14 151 A 1 ATOM 1210 C CD . LYS A 1 151 ? 0.682 -15.574 9.628 1.00 86.82 151 A 1 ATOM 1211 C CE . LYS A 1 151 ? 1.539 -16.253 8.558 1.00 80.73 151 A 1 ATOM 1212 N NZ . LYS A 1 151 ? 2.950 -16.411 8.985 1.00 69.78 151 A 1 ATOM 1213 N N . ASP A 1 152 ? -4.298 -13.810 11.555 1.00 97.61 152 A 1 ATOM 1214 C CA . ASP A 1 152 ? -5.031 -13.399 12.749 1.00 97.68 152 A 1 ATOM 1215 C C . ASP A 1 152 ? -5.764 -12.070 12.514 1.00 98.16 152 A 1 ATOM 1216 O O . ASP A 1 152 ? -5.261 -11.185 11.812 1.00 97.33 152 A 1 ATOM 1217 C CB . ASP A 1 152 ? -4.057 -13.294 13.935 1.00 95.76 152 A 1 ATOM 1218 C CG . ASP A 1 152 ? -4.786 -12.875 15.210 1.00 88.72 152 A 1 ATOM 1219 O OD1 . ASP A 1 152 ? -5.785 -13.548 15.538 1.00 80.35 152 A 1 ATOM 1220 O OD2 . ASP A 1 152 ? -4.364 -11.839 15.776 1.00 79.33 152 A 1 ATOM 1221 N N . VAL A 1 153 ? -6.951 -11.945 13.101 1.00 98.11 153 A 1 ATOM 1222 C CA . VAL A 1 153 ? -7.766 -10.726 13.111 1.00 98.13 153 A 1 ATOM 1223 C C . VAL A 1 153 ? -8.387 -10.573 14.486 1.00 98.22 153 A 1 ATOM 1224 O O . VAL A 1 153 ? -9.172 -11.430 14.912 1.00 96.93 153 A 1 ATOM 1225 C CB . VAL A 1 153 ? -8.912 -10.741 12.078 1.00 96.69 153 A 1 ATOM 1226 C CG1 . VAL A 1 153 ? -9.587 -9.361 11.997 1.00 91.40 153 A 1 ATOM 1227 C CG2 . VAL A 1 153 ? -8.466 -11.116 10.672 1.00 91.37 153 A 1 ATOM 1228 N N . LYS A 1 154 ? -8.122 -9.455 15.151 1.00 97.85 154 A 1 ATOM 1229 C CA . LYS A 1 154 ? -8.754 -9.114 16.425 1.00 97.40 154 A 1 ATOM 1230 C C . LYS A 1 154 ? -9.036 -7.618 16.545 1.00 98.21 154 A 1 ATOM 1231 O O . LYS A 1 154 ? -8.306 -6.798 15.999 1.00 97.63 154 A 1 ATOM 1232 C CB . LYS A 1 154 ? -7.928 -9.655 17.602 1.00 93.51 154 A 1 ATOM 1233 C CG . LYS A 1 154 ? -6.527 -9.048 17.753 1.00 85.66 154 A 1 ATOM 1234 C CD . LYS A 1 154 ? -5.853 -9.610 19.019 1.00 86.39 154 A 1 ATOM 1235 C CE . LYS A 1 154 ? -4.499 -8.939 19.260 1.00 76.07 154 A 1 ATOM 1236 N NZ . LYS A 1 154 ? -3.987 -9.207 20.633 1.00 69.61 154 A 1 ATOM 1237 N N . VAL A 1 155 ? -10.100 -7.294 17.269 1.00 98.29 155 A 1 ATOM 1238 C CA . VAL A 1 155 ? -10.310 -5.930 17.765 1.00 98.46 155 A 1 ATOM 1239 C C . VAL A 1 155 ? -9.387 -5.715 18.954 1.00 98.38 155 A 1 ATOM 1240 O O . VAL A 1 155 ? -9.265 -6.594 19.802 1.00 97.64 155 A 1 ATOM 1241 C CB . VAL A 1 155 ? -11.778 -5.662 18.131 1.00 98.26 155 A 1 ATOM 1242 C CG1 . VAL A 1 155 ? -11.984 -4.267 18.736 1.00 97.26 155 A 1 ATOM 1243 C CG2 . VAL A 1 155 ? -12.652 -5.742 16.872 1.00 97.13 155 A 1 ATOM 1244 N N . ILE A 1 156 ? -8.741 -4.560 18.989 1.00 98.54 156 A 1 ATOM 1245 C CA . ILE A 1 156 ? -7.729 -4.206 19.977 1.00 98.34 156 A 1 ATOM 1246 C C . ILE A 1 156 ? -7.885 -2.743 20.386 1.00 98.57 156 A 1 ATOM 1247 O O . ILE A 1 156 ? -8.297 -1.909 19.576 1.00 98.19 156 A 1 ATOM 1248 C CB . ILE A 1 156 ? -6.337 -4.554 19.404 1.00 97.03 156 A 1 ATOM 1249 C CG1 . ILE A 1 156 ? -5.278 -4.582 20.518 1.00 87.65 156 A 1 ATOM 1250 C CG2 . ILE A 1 156 ? -5.906 -3.629 18.247 1.00 87.59 156 A 1 ATOM 1251 C CD1 . ILE A 1 156 ? -4.021 -5.350 20.126 1.00 84.70 156 A 1 ATOM 1252 N N . ASP A 1 157 ? -7.595 -2.430 21.635 1.00 98.38 157 A 1 ATOM 1253 C CA . ASP A 1 157 ? -7.578 -1.047 22.103 1.00 98.29 157 A 1 ATOM 1254 C C . ASP A 1 157 ? -6.211 -0.411 21.816 1.00 98.31 157 A 1 ATOM 1255 O O . ASP A 1 157 ? -5.155 -1.014 22.016 1.00 97.45 157 A 1 ATOM 1256 C CB . ASP A 1 157 ? -8.029 -0.957 23.574 1.00 97.79 157 A 1 ATOM 1257 C CG . ASP A 1 157 ? -9.552 -1.170 23.703 1.00 95.60 157 A 1 ATOM 1258 O OD1 . ASP A 1 157 ? -10.332 -0.434 23.042 1.00 89.62 157 A 1 ATOM 1259 O OD2 . ASP A 1 157 ? -10.036 -2.070 24.417 1.00 89.53 157 A 1 ATOM 1260 N N . VAL A 1 158 ? -6.237 0.827 21.308 1.00 98.20 158 A 1 ATOM 1261 C CA . VAL A 1 158 ? -5.043 1.630 21.006 1.00 98.19 158 A 1 ATOM 1262 C C . VAL A 1 158 ? -5.108 2.966 21.739 1.00 98.21 158 A 1 ATOM 1263 O O . VAL A 1 158 ? -6.173 3.574 21.869 1.00 97.57 158 A 1 ATOM 1264 C CB . VAL A 1 158 ? -4.803 1.818 19.493 1.00 97.69 158 A 1 ATOM 1265 C CG1 . VAL A 1 158 ? -4.645 0.471 18.779 1.00 95.58 158 A 1 ATOM 1266 C CG2 . VAL A 1 158 ? -5.904 2.610 18.783 1.00 95.08 158 A 1 ATOM 1267 N N . GLN A 1 159 ? -3.960 3.429 22.206 1.00 97.95 159 A 1 ATOM 1268 C CA . GLN A 1 159 ? -3.841 4.678 22.949 1.00 97.48 159 A 1 ATOM 1269 C C . GLN A 1 159 ? -2.533 5.399 22.628 1.00 97.55 159 A 1 ATOM 1270 O O . GLN A 1 159 ? -1.557 4.784 22.206 1.00 96.71 159 A 1 ATOM 1271 C CB . GLN A 1 159 ? -3.995 4.405 24.453 1.00 95.94 159 A 1 ATOM 1272 C CG . GLN A 1 159 ? -2.875 3.532 25.055 1.00 88.59 159 A 1 ATOM 1273 C CD . GLN A 1 159 ? -3.087 3.207 26.529 1.00 88.38 159 A 1 ATOM 1274 O OE1 . GLN A 1 159 ? -4.135 3.434 27.119 1.00 79.68 159 A 1 ATOM 1275 N NE2 . GLN A 1 159 ? -2.096 2.649 27.186 1.00 76.81 159 A 1 ATOM 1276 N N . GLU A 1 160 ? -2.520 6.708 22.840 1.00 97.60 160 A 1 ATOM 1277 C CA . GLU A 1 160 ? -1.286 7.490 22.820 1.00 97.11 160 A 1 ATOM 1278 C C . GLU A 1 160 ? -0.549 7.356 24.155 1.00 97.15 160 A 1 ATOM 1279 O O . GLU A 1 160 ? -1.153 7.432 25.229 1.00 95.76 160 A 1 ATOM 1280 C CB . GLU A 1 160 ? -1.570 8.962 22.502 1.00 95.19 160 A 1 ATOM 1281 C CG . GLU A 1 160 ? -1.971 9.164 21.037 1.00 87.33 160 A 1 ATOM 1282 C CD . GLU A 1 160 ? -2.214 10.632 20.666 1.00 87.86 160 A 1 ATOM 1283 O OE1 . GLU A 1 160 ? -2.174 10.932 19.448 1.00 78.47 160 A 1 ATOM 1284 O OE2 . GLU A 1 160 ? -2.448 11.460 21.580 1.00 79.85 160 A 1 ATOM 1285 N N . GLU A 1 161 ? 0.772 7.217 24.084 1.00 96.74 161 A 1 ATOM 1286 C CA . GLU A 1 161 ? 1.652 7.264 25.245 1.00 95.89 161 A 1 ATOM 1287 C C . GLU A 1 161 ? 2.934 8.042 24.936 1.00 96.37 161 A 1 ATOM 1288 O O . GLU A 1 161 ? 3.407 8.094 23.798 1.00 94.64 161 A 1 ATOM 1289 C CB . GLU A 1 161 ? 1.943 5.857 25.798 1.00 92.46 161 A 1 ATOM 1290 C CG . GLU A 1 161 ? 2.796 4.962 24.889 1.00 81.63 161 A 1 ATOM 1291 C CD . GLU A 1 161 ? 3.194 3.628 25.544 1.00 84.47 161 A 1 ATOM 1292 O OE1 . GLU A 1 161 ? 4.296 3.125 25.213 1.00 75.28 161 A 1 ATOM 1293 O OE2 . GLU A 1 161 ? 2.422 3.111 26.381 1.00 78.86 161 A 1 ATOM 1294 N N . THR A 1 162 ? 3.508 8.652 25.959 1.00 96.19 162 A 1 ATOM 1295 C CA . THR A 1 162 ? 4.836 9.266 25.870 1.00 96.16 162 A 1 ATOM 1296 C C . THR A 1 162 ? 5.882 8.243 26.287 1.00 96.09 162 A 1 ATOM 1297 O O . THR A 1 162 ? 5.836 7.728 27.402 1.00 94.41 162 A 1 ATOM 1298 C CB . THR A 1 162 ? 4.934 10.525 26.731 1.00 95.58 162 A 1 ATOM 1299 O OG1 . THR A 1 162 ? 3.963 11.455 26.320 1.00 89.16 162 A 1 ATOM 1300 C CG2 . THR A 1 162 ? 6.287 11.219 26.586 1.00 88.21 162 A 1 ATOM 1301 N N . LEU A 1 163 ? 6.849 7.966 25.407 1.00 95.35 163 A 1 ATOM 1302 C CA . LEU A 1 163 ? 7.883 6.973 25.685 1.00 94.99 163 A 1 ATOM 1303 C C . LEU A 1 163 ? 8.781 7.381 26.869 1.00 95.33 163 A 1 ATOM 1304 O O . LEU A 1 163 ? 9.446 8.420 26.807 1.00 94.01 163 A 1 ATOM 1305 C CB . LEU A 1 163 ? 8.744 6.730 24.435 1.00 93.58 163 A 1 ATOM 1306 C CG . LEU A 1 163 ? 8.072 5.900 23.338 1.00 91.63 163 A 1 ATOM 1307 C CD1 . LEU A 1 163 ? 9.063 5.737 22.178 1.00 88.29 163 A 1 ATOM 1308 C CD2 . LEU A 1 163 ? 7.673 4.504 23.826 1.00 88.80 163 A 1 ATOM 1309 N N . PRO A 1 164 ? 8.902 6.539 27.909 1.00 95.52 164 A 1 ATOM 1310 C CA . PRO A 1 164 ? 9.770 6.821 29.057 1.00 95.06 164 A 1 ATOM 1311 C C . PRO A 1 164 ? 11.264 6.635 28.746 1.00 95.38 164 A 1 ATOM 1312 O O . PRO A 1 164 ? 12.130 7.178 29.438 1.00 93.45 164 A 1 ATOM 1313 C CB . PRO A 1 164 ? 9.292 5.854 30.143 1.00 94.41 164 A 1 ATOM 1314 C CG . PRO A 1 164 ? 8.787 4.644 29.354 1.00 93.42 164 A 1 ATOM 1315 C CD . PRO A 1 164 ? 8.175 5.285 28.109 1.00 95.49 164 A 1 ATOM 1316 N N . SER A 1 165 ? 11.582 5.871 27.703 1.00 95.11 165 A 1 ATOM 1317 C CA . SER A 1 165 ? 12.929 5.574 27.212 1.00 95.20 165 A 1 ATOM 1318 C C . SER A 1 165 ? 12.915 5.384 25.696 1.00 95.59 165 A 1 ATOM 1319 O O . SER A 1 165 ? 11.854 5.252 25.094 1.00 94.44 165 A 1 ATOM 1320 C CB . SER A 1 165 ? 13.477 4.321 27.904 1.00 94.36 165 A 1 ATOM 1321 O OG . SER A 1 165 ? 12.675 3.190 27.634 1.00 88.92 165 A 1 ATOM 1322 N N . ASN A 1 166 ? 14.092 5.356 25.067 1.00 96.06 166 A 1 ATOM 1323 C CA . ASN A 1 166 ? 14.207 4.981 23.656 1.00 95.88 166 A 1 ATOM 1324 C C . ASN A 1 166 ? 13.589 3.596 23.422 1.00 96.13 166 A 1 ATOM 1325 O O . ASN A 1 166 ? 13.774 2.690 24.235 1.00 95.20 166 A 1 ATOM 1326 C CB . ASN A 1 166 ? 15.681 4.977 23.230 1.00 94.79 166 A 1 ATOM 1327 C CG . ASN A 1 166 ? 16.334 6.344 23.199 1.00 93.55 166 A 1 ATOM 1328 O OD1 . ASN A 1 166 ? 15.723 7.384 23.376 1.00 88.88 166 A 1 ATOM 1329 N ND2 . ASN A 1 166 ? 17.622 6.384 22.968 1.00 88.85 166 A 1 ATOM 1330 N N . ARG A 1 167 ? 12.909 3.434 22.287 1.00 95.80 167 A 1 ATOM 1331 C CA . ARG A 1 167 ? 12.277 2.175 21.890 1.00 95.80 167 A 1 ATOM 1332 C C . ARG A 1 167 ? 12.684 1.808 20.473 1.00 96.35 167 A 1 ATOM 1333 O O . ARG A 1 167 ? 12.742 2.667 19.602 1.00 95.43 167 A 1 ATOM 1334 C CB . ARG A 1 167 ? 10.762 2.313 22.061 1.00 94.81 167 A 1 ATOM 1335 C CG . ARG A 1 167 ? 10.033 0.987 21.852 1.00 92.01 167 A 1 ATOM 1336 C CD . ARG A 1 167 ? 8.572 1.146 22.290 1.00 90.18 167 A 1 ATOM 1337 N NE . ARG A 1 167 ? 7.843 -0.119 22.209 1.00 86.87 167 A 1 ATOM 1338 C CZ . ARG A 1 167 ? 6.632 -0.344 22.666 1.00 84.02 167 A 1 ATOM 1339 N NH1 . ARG A 1 167 ? 5.906 0.571 23.242 1.00 79.02 167 A 1 ATOM 1340 N NH2 . ARG A 1 167 ? 6.120 -1.525 22.547 1.00 76.83 167 A 1 ATOM 1341 N N . GLU A 1 168 ? 12.968 0.534 20.253 1.00 96.09 168 A 1 ATOM 1342 C CA . GLU A 1 168 ? 13.366 0.008 18.948 1.00 96.03 168 A 1 ATOM 1343 C C . GLU A 1 168 ? 12.144 -0.509 18.181 1.00 96.33 168 A 1 ATOM 1344 O O . GLU A 1 168 ? 11.257 -1.140 18.764 1.00 95.16 168 A 1 ATOM 1345 C CB . GLU A 1 168 ? 14.424 -1.075 19.187 1.00 94.50 168 A 1 ATOM 1346 C CG . GLU A 1 168 ? 15.140 -1.495 17.907 1.00 84.30 168 A 1 ATOM 1347 C CD . GLU A 1 168 ? 16.268 -2.505 18.172 1.00 86.04 168 A 1 ATOM 1348 O OE1 . GLU A 1 168 ? 16.645 -3.213 17.213 1.00 76.76 168 A 1 ATOM 1349 O OE2 . GLU A 1 168 ? 16.774 -2.539 19.317 1.00 80.24 168 A 1 ATOM 1350 N N . LEU A 1 169 ? 12.076 -0.234 16.870 1.00 96.59 169 A 1 ATOM 1351 C CA . LEU A 1 169 ? 11.076 -0.834 15.990 1.00 96.67 169 A 1 ATOM 1352 C C . LEU A 1 169 ? 11.394 -2.318 15.771 1.00 96.71 169 A 1 ATOM 1353 O O . LEU A 1 169 ? 12.476 -2.661 15.300 1.00 96.04 169 A 1 ATOM 1354 C CB . LEU A 1 169 ? 11.024 -0.096 14.639 1.00 96.53 169 A 1 ATOM 1355 C CG . LEU A 1 169 ? 10.423 1.316 14.676 1.00 95.66 169 A 1 ATOM 1356 C CD1 . LEU A 1 169 ? 10.436 1.914 13.266 1.00 93.90 169 A 1 ATOM 1357 C CD2 . LEU A 1 169 ? 8.975 1.317 15.167 1.00 93.98 169 A 1 ATOM 1358 N N . THR A 1 170 ? 10.417 -3.180 16.024 1.00 96.28 170 A 1 ATOM 1359 C CA . THR A 1 170 ? 10.529 -4.636 15.808 1.00 95.94 170 A 1 ATOM 1360 C C . THR A 1 170 ? 10.220 -5.063 14.370 1.00 96.38 170 A 1 ATOM 1361 O O . THR A 1 170 ? 10.409 -6.219 14.004 1.00 95.07 170 A 1 ATOM 1362 C CB . THR A 1 170 ? 9.591 -5.389 16.763 1.00 95.17 170 A 1 ATOM 1363 O OG1 . THR A 1 170 ? 8.252 -5.002 16.537 1.00 91.57 170 A 1 ATOM 1364 C CG2 . THR A 1 170 ? 9.913 -5.103 18.231 1.00 89.91 170 A 1 ATOM 1365 N N . LYS A 1 171 ? 9.700 -4.145 13.543 1.00 96.80 171 A 1 ATOM 1366 C CA . LYS A 1 171 ? 9.308 -4.355 12.146 1.00 97.07 171 A 1 ATOM 1367 C C . LYS A 1 171 ? 9.560 -3.074 11.356 1.00 97.53 171 A 1 ATOM 1368 O O . LYS A 1 171 ? 9.402 -1.977 11.896 1.00 96.92 171 A 1 ATOM 1369 C CB . LYS A 1 171 ? 7.816 -4.755 12.055 1.00 96.36 171 A 1 ATOM 1370 C CG . LYS A 1 171 ? 7.483 -6.035 12.833 1.00 94.96 171 A 1 ATOM 1371 C CD . LYS A 1 171 ? 5.977 -6.348 12.841 1.00 93.57 171 A 1 ATOM 1372 C CE . LYS A 1 171 ? 5.616 -7.366 13.941 1.00 87.84 171 A 1 ATOM 1373 N NZ . LYS A 1 171 ? 5.698 -6.781 15.321 1.00 81.32 171 A 1 ATOM 1374 N N . ALA A 1 172 ? 9.886 -3.214 10.080 1.00 97.80 172 A 1 ATOM 1375 C CA . ALA A 1 172 ? 9.922 -2.072 9.178 1.00 97.98 172 A 1 ATOM 1376 C C . ALA A 1 172 ? 8.524 -1.440 9.083 1.00 98.28 172 A 1 ATOM 1377 O O . ALA A 1 172 ? 7.523 -2.143 8.979 1.00 97.92 172 A 1 ATOM 1378 C CB . ALA A 1 172 ? 10.455 -2.513 7.817 1.00 97.51 172 A 1 ATOM 1379 N N . THR A 1 173 ? 8.448 -0.115 9.140 1.00 98.18 173 A 1 ATOM 1380 C CA . THR A 1 173 ? 7.170 0.591 9.318 1.00 98.21 173 A 1 ATOM 1381 C C . THR A 1 173 ? 7.152 1.897 8.528 1.00 98.43 173 A 1 ATOM 1382 O O . THR A 1 173 ? 8.173 2.569 8.408 1.00 97.78 173 A 1 ATOM 1383 C CB . THR A 1 173 ? 6.914 0.858 10.813 1.00 96.82 173 A 1 ATOM 1384 O OG1 . THR A 1 173 ? 6.959 -0.341 11.550 1.00 81.88 173 A 1 ATOM 1385 C CG2 . THR A 1 173 ? 5.538 1.458 11.096 1.00 82.91 173 A 1 ATOM 1386 N N . TYR A 1 174 ? 5.980 2.274 7.991 1.00 98.33 174 A 1 ATOM 1387 C CA . TYR A 1 174 ? 5.771 3.642 7.528 1.00 98.28 174 A 1 ATOM 1388 C C . TYR A 1 174 ? 5.461 4.555 8.709 1.00 98.17 174 A 1 ATOM 1389 O O . TYR A 1 174 ? 4.469 4.359 9.406 1.00 97.58 174 A 1 ATOM 1390 C CB . TYR A 1 174 ? 4.655 3.715 6.481 1.00 98.17 174 A 1 ATOM 1391 C CG . TYR A 1 174 ? 4.988 3.116 5.129 1.00 98.30 174 A 1 ATOM 1392 C CD1 . TYR A 1 174 ? 6.222 3.391 4.504 1.00 97.63 174 A 1 ATOM 1393 C CD2 . TYR A 1 174 ? 4.035 2.309 4.474 1.00 97.62 174 A 1 ATOM 1394 C CE1 . TYR A 1 174 ? 6.510 2.856 3.235 1.00 97.27 174 A 1 ATOM 1395 C CE2 . TYR A 1 174 ? 4.317 1.776 3.204 1.00 97.16 174 A 1 ATOM 1396 C CZ . TYR A 1 174 ? 5.556 2.045 2.581 1.00 97.68 174 A 1 ATOM 1397 O OH . TYR A 1 174 ? 5.833 1.525 1.361 1.00 96.76 174 A 1 ATOM 1398 N N . VAL A 1 175 ? 6.286 5.581 8.886 1.00 97.92 175 A 1 ATOM 1399 C CA . VAL A 1 175 ? 6.177 6.542 9.988 1.00 97.75 175 A 1 ATOM 1400 C C . VAL A 1 175 ? 5.978 7.950 9.418 1.00 97.78 175 A 1 ATOM 1401 O O . VAL A 1 175 ? 6.747 8.349 8.544 1.00 97.21 175 A 1 ATOM 1402 C CB . VAL A 1 175 ? 7.416 6.475 10.890 1.00 97.22 175 A 1 ATOM 1403 C CG1 . VAL A 1 175 ? 7.234 7.390 12.107 1.00 95.26 175 A 1 ATOM 1404 C CG2 . VAL A 1 175 ? 7.674 5.041 11.382 1.00 95.55 175 A 1 ATOM 1405 N N . PRO A 1 176 ? 4.981 8.726 9.875 1.00 97.54 176 A 1 ATOM 1406 C CA . PRO A 1 176 ? 4.808 10.112 9.449 1.00 96.90 176 A 1 ATOM 1407 C C . PRO A 1 176 ? 6.082 10.944 9.649 1.00 96.68 176 A 1 ATOM 1408 O O . PRO A 1 176 ? 6.769 10.806 10.658 1.00 95.91 176 A 1 ATOM 1409 C CB . PRO A 1 176 ? 3.646 10.660 10.284 1.00 96.24 176 A 1 ATOM 1410 C CG . PRO A 1 176 ? 2.841 9.412 10.630 1.00 95.34 176 A 1 ATOM 1411 C CD . PRO A 1 176 ? 3.912 8.337 10.783 1.00 96.89 176 A 1 ATOM 1412 N N . VAL A 1 177 ? 6.379 11.857 8.717 1.00 96.70 177 A 1 ATOM 1413 C CA . VAL A 1 177 ? 7.595 12.697 8.775 1.00 96.07 177 A 1 ATOM 1414 C C . VAL A 1 177 ? 7.663 13.630 9.994 1.00 95.52 177 A 1 ATOM 1415 O O . VAL A 1 177 ? 8.726 14.169 10.297 1.00 93.20 177 A 1 ATOM 1416 C CB . VAL A 1 177 ? 7.766 13.532 7.496 1.00 95.28 177 A 1 ATOM 1417 C CG1 . VAL A 1 177 ? 7.973 12.634 6.273 1.00 89.00 177 A 1 ATOM 1418 C CG2 . VAL A 1 177 ? 6.584 14.477 7.242 1.00 89.18 177 A 1 ATOM 1419 N N . SER A 1 178 ? 6.546 13.823 10.699 1.00 94.86 178 A 1 ATOM 1420 C CA . SER A 1 178 ? 6.486 14.579 11.954 1.00 93.44 178 A 1 ATOM 1421 C C . SER A 1 178 ? 7.266 13.918 13.095 1.00 93.04 178 A 1 ATOM 1422 O O . SER A 1 178 ? 7.689 14.611 14.024 1.00 90.77 178 A 1 ATOM 1423 C CB . SER A 1 178 ? 5.023 14.767 12.372 1.00 92.61 178 A 1 ATOM 1424 O OG . SER A 1 178 ? 4.354 13.519 12.410 1.00 89.11 178 A 1 ATOM 1425 N N . TYR A 1 179 ? 7.492 12.608 13.021 1.00 93.86 179 A 1 ATOM 1426 C CA . TYR A 1 179 ? 8.309 11.885 13.993 1.00 92.03 179 A 1 ATOM 1427 C C . TYR A 1 179 ? 9.798 12.108 13.713 1.00 89.65 179 A 1 ATOM 1428 O O . TYR A 1 179 ? 10.261 12.052 12.573 1.00 82.04 179 A 1 ATOM 1429 C CB . TYR A 1 179 ? 7.948 10.396 13.993 1.00 91.86 179 A 1 ATOM 1430 C CG . TYR A 1 179 ? 6.578 10.102 14.578 1.00 92.76 179 A 1 ATOM 1431 C CD1 . TYR A 1 179 ? 6.457 9.703 15.923 1.00 89.12 179 A 1 ATOM 1432 C CD2 . TYR A 1 179 ? 5.424 10.232 13.783 1.00 90.35 179 A 1 ATOM 1433 C CE1 . TYR A 1 179 ? 5.189 9.422 16.467 1.00 88.47 179 A 1 ATOM 1434 C CE2 . TYR A 1 179 ? 4.154 9.958 14.327 1.00 89.43 179 A 1 ATOM 1435 C CZ . TYR A 1 179 ? 4.037 9.546 15.666 1.00 90.50 179 A 1 ATOM 1436 O OH . TYR A 1 179 ? 2.814 9.266 16.183 1.00 88.80 179 A 1 ATOM 1437 N N . LYS A 1 180 ? 10.581 12.341 14.761 1.00 86.97 180 A 1 ATOM 1438 C CA . LYS A 1 180 ? 12.021 12.639 14.669 1.00 85.20 180 A 1 ATOM 1439 C C . LYS A 1 180 ? 12.861 11.364 14.536 1.00 87.24 180 A 1 ATOM 1440 O O . LYS A 1 180 ? 13.716 11.091 15.380 1.00 82.72 180 A 1 ATOM 1441 C CB . LYS A 1 180 ? 12.463 13.498 15.861 1.00 81.00 180 A 1 ATOM 1442 C CG . LYS A 1 180 ? 11.762 14.858 15.921 1.00 76.40 180 A 1 ATOM 1443 C CD . LYS A 1 180 ? 12.279 15.635 17.138 1.00 70.03 180 A 1 ATOM 1444 C CE . LYS A 1 180 ? 11.551 16.974 17.262 1.00 65.60 180 A 1 ATOM 1445 N NZ . LYS A 1 180 ? 11.951 17.687 18.500 1.00 55.84 180 A 1 ATOM 1446 N N . ILE A 1 181 ? 12.608 10.573 13.493 1.00 91.26 181 A 1 ATOM 1447 C CA . ILE A 1 181 ? 13.349 9.339 13.209 1.00 92.29 181 A 1 ATOM 1448 C C . ILE A 1 181 ? 13.929 9.357 11.793 1.00 94.02 181 A 1 ATOM 1449 O O . ILE A 1 181 ? 13.520 10.156 10.946 1.00 91.73 181 A 1 ATOM 1450 C CB . ILE A 1 181 ? 12.493 8.085 13.481 1.00 89.12 181 A 1 ATOM 1451 C CG1 . ILE A 1 181 ? 11.321 7.948 12.500 1.00 81.46 181 A 1 ATOM 1452 C CG2 . ILE A 1 181 ? 12.011 8.066 14.944 1.00 77.64 181 A 1 ATOM 1453 C CD1 . ILE A 1 181 ? 10.671 6.568 12.610 1.00 78.38 181 A 1 ATOM 1454 N N . GLY A 1 182 ? 14.909 8.482 11.533 1.00 92.28 182 A 1 ATOM 1455 C CA . GLY A 1 182 ? 15.491 8.293 10.201 1.00 92.71 182 A 1 ATOM 1456 C C . GLY A 1 182 ? 14.706 7.285 9.361 1.00 94.78 182 A 1 ATOM 1457 O O . GLY A 1 182 ? 14.108 6.359 9.890 1.00 93.22 182 A 1 ATOM 1458 N N . GLY A 1 183 ? 14.742 7.453 8.036 1.00 94.95 183 A 1 ATOM 1459 C CA . GLY A 1 183 ? 14.142 6.507 7.098 1.00 95.92 183 A 1 ATOM 1460 C C . GLY A 1 183 ? 14.155 7.023 5.662 1.00 96.84 183 A 1 ATOM 1461 O O . GLY A 1 183 ? 14.490 8.178 5.402 1.00 95.69 183 A 1 ATOM 1462 N N . ALA A 1 184 ? 13.781 6.163 4.714 1.00 96.82 184 A 1 ATOM 1463 C CA . ALA A 1 184 ? 13.606 6.551 3.317 1.00 97.02 184 A 1 ATOM 1464 C C . ALA A 1 184 ? 12.269 7.284 3.137 1.00 97.41 184 A 1 ATOM 1465 O O . ALA A 1 184 ? 11.224 6.784 3.540 1.00 96.77 184 A 1 ATOM 1466 C CB . ALA A 1 184 ? 13.711 5.307 2.429 1.00 96.35 184 A 1 ATOM 1467 N N . PHE A 1 185 ? 12.301 8.463 2.502 1.00 96.99 185 A 1 ATOM 1468 C CA . PHE A 1 185 ? 11.113 9.295 2.306 1.00 96.76 185 A 1 ATOM 1469 C C . PHE A 1 185 ? 10.219 8.771 1.174 1.00 96.79 185 A 1 ATOM 1470 O O . PHE A 1 185 ? 10.688 8.510 0.065 1.00 96.16 185 A 1 ATOM 1471 C CB . PHE A 1 185 ? 11.547 10.738 2.052 1.00 96.13 185 A 1 ATOM 1472 C CG . PHE A 1 185 ? 10.399 11.689 1.778 1.00 95.51 185 A 1 ATOM 1473 C CD1 . PHE A 1 185 ? 10.007 11.963 0.451 1.00 92.90 185 A 1 ATOM 1474 C CD2 . PHE A 1 185 ? 9.718 12.302 2.842 1.00 92.90 185 A 1 ATOM 1475 C CE1 . PHE A 1 185 ? 8.954 12.859 0.195 1.00 91.16 185 A 1 ATOM 1476 C CE2 . PHE A 1 185 ? 8.666 13.203 2.583 1.00 91.36 185 A 1 ATOM 1477 C CZ . PHE A 1 185 ? 8.291 13.485 1.257 1.00 92.05 185 A 1 ATOM 1478 N N . PHE A 1 186 ? 8.910 8.699 1.432 1.00 97.19 186 A 1 ATOM 1479 C CA . PHE A 1 186 ? 7.886 8.348 0.450 1.00 97.17 186 A 1 ATOM 1480 C C . PHE A 1 186 ? 6.678 9.288 0.523 1.00 97.33 186 A 1 ATOM 1481 O O . PHE A 1 186 ? 6.293 9.776 1.579 1.00 96.83 186 A 1 ATOM 1482 C CB . PHE A 1 186 ? 7.444 6.891 0.639 1.00 97.00 186 A 1 ATOM 1483 C CG . PHE A 1 186 ? 8.506 5.865 0.302 1.00 97.17 186 A 1 ATOM 1484 C CD1 . PHE A 1 186 ? 8.739 5.496 -1.037 1.00 96.02 186 A 1 ATOM 1485 C CD2 . PHE A 1 186 ? 9.271 5.277 1.324 1.00 96.12 186 A 1 ATOM 1486 C CE1 . PHE A 1 186 ? 9.733 4.553 -1.350 1.00 95.29 186 A 1 ATOM 1487 C CE2 . PHE A 1 186 ? 10.266 4.336 1.009 1.00 95.43 186 A 1 ATOM 1488 C CZ . PHE A 1 186 ? 10.496 3.973 -0.329 1.00 95.82 186 A 1 ATOM 1489 N N . ARG A 1 187 ? 6.035 9.491 -0.630 1.00 97.04 187 A 1 ATOM 1490 C CA . ARG A 1 187 ? 4.736 10.171 -0.752 1.00 96.80 187 A 1 ATOM 1491 C C . ARG A 1 187 ? 3.698 9.165 -1.230 1.00 96.84 187 A 1 ATOM 1492 O O . ARG A 1 187 ? 3.568 8.923 -2.436 1.00 95.63 187 A 1 ATOM 1493 C CB . ARG A 1 187 ? 4.833 11.385 -1.684 1.00 95.96 187 A 1 ATOM 1494 C CG . ARG A 1 187 ? 5.764 12.466 -1.118 1.00 89.29 187 A 1 ATOM 1495 C CD . ARG A 1 187 ? 5.812 13.696 -2.024 1.00 88.27 187 A 1 ATOM 1496 N NE . ARG A 1 187 ? 4.600 14.513 -1.892 1.00 78.22 187 A 1 ATOM 1497 C CZ . ARG A 1 187 ? 4.126 15.390 -2.752 1.00 72.11 187 A 1 ATOM 1498 N NH1 . ARG A 1 187 ? 4.685 15.601 -3.916 1.00 66.09 187 A 1 ATOM 1499 N NH2 . ARG A 1 187 ? 3.071 16.084 -2.441 1.00 61.43 187 A 1 ATOM 1500 N N . LEU A 1 188 ? 2.976 8.569 -0.288 1.00 97.39 188 A 1 ATOM 1501 C CA . LEU A 1 188 ? 2.062 7.455 -0.536 1.00 97.51 188 A 1 ATOM 1502 C C . LEU A 1 188 ? 0.621 7.940 -0.683 1.00 97.44 188 A 1 ATOM 1503 O O . LEU A 1 188 ? 0.192 8.879 -0.025 1.00 96.80 188 A 1 ATOM 1504 C CB . LEU A 1 188 ? 2.203 6.407 0.576 1.00 97.46 188 A 1 ATOM 1505 C CG . LEU A 1 188 ? 3.619 5.826 0.731 1.00 97.01 188 A 1 ATOM 1506 C CD1 . LEU A 1 188 ? 3.604 4.774 1.831 1.00 96.07 188 A 1 ATOM 1507 C CD2 . LEU A 1 188 ? 4.141 5.175 -0.555 1.00 95.96 188 A 1 ATOM 1508 N N . ASN A 1 189 ? -0.140 7.293 -1.555 1.00 96.77 189 A 1 ATOM 1509 C CA . ASN A 1 189 ? -1.565 7.583 -1.694 1.00 96.43 189 A 1 ATOM 1510 C C . ASN A 1 189 ? -2.324 7.042 -0.472 1.00 97.17 189 A 1 ATOM 1511 O O . ASN A 1 189 ? -2.163 5.865 -0.140 1.00 96.79 189 A 1 ATOM 1512 C CB . ASN A 1 189 ? -2.092 6.951 -2.987 1.00 95.13 189 A 1 ATOM 1513 C CG . ASN A 1 189 ? -1.513 7.525 -4.268 1.00 93.50 189 A 1 ATOM 1514 O OD1 . ASN A 1 189 ? -1.096 8.673 -4.380 1.00 88.51 189 A 1 ATOM 1515 N ND2 . ASN A 1 189 ? -1.498 6.737 -5.316 1.00 87.15 189 A 1 ATOM 1516 N N . LYS A 1 190 ? -3.202 7.862 0.133 1.00 96.08 190 A 1 ATOM 1517 C CA . LYS A 1 190 ? -4.141 7.425 1.181 1.00 96.33 190 A 1 ATOM 1518 C C . LYS A 1 190 ? -5.507 7.121 0.575 1.00 96.37 190 A 1 ATOM 1519 O O . LYS A 1 190 ? -5.913 5.969 0.484 1.00 94.25 190 A 1 ATOM 1520 C CB . LYS A 1 190 ? -4.201 8.465 2.321 1.00 95.56 190 A 1 ATOM 1521 C CG . LYS A 1 190 ? -5.121 7.988 3.462 1.00 94.91 190 A 1 ATOM 1522 C CD . LYS A 1 190 ? -5.161 8.959 4.655 1.00 93.40 190 A 1 ATOM 1523 C CE . LYS A 1 190 ? -6.115 8.420 5.729 1.00 90.97 190 A 1 ATOM 1524 N NZ . LYS A 1 190 ? -6.113 9.219 6.978 1.00 87.98 190 A 1 ATOM 1525 N N . ASN A 1 191 ? -6.175 8.148 0.072 1.00 95.62 191 A 1 ATOM 1526 C CA . ASN A 1 191 ? -7.487 8.065 -0.563 1.00 94.99 191 A 1 ATOM 1527 C C . ASN A 1 191 ? -7.522 8.923 -1.833 1.00 95.41 191 A 1 ATOM 1528 O O . ASN A 1 191 ? -6.511 9.493 -2.246 1.00 93.27 191 A 1 ATOM 1529 C CB . ASN A 1 191 ? -8.573 8.442 0.474 1.00 92.23 191 A 1 ATOM 1530 C CG . ASN A 1 191 ? -8.496 9.881 0.960 1.00 90.83 191 A 1 ATOM 1531 O OD1 . ASN A 1 191 ? -7.534 10.587 0.726 1.00 79.93 191 A 1 ATOM 1532 N ND2 . ASN A 1 191 ? -9.503 10.363 1.641 1.00 82.75 191 A 1 ATOM 1533 N N . TYR A 1 192 ? -8.672 8.991 -2.499 1.00 93.59 192 A 1 ATOM 1534 C CA . TYR A 1 192 ? -8.853 9.881 -3.643 1.00 93.18 192 A 1 ATOM 1535 C C . TYR A 1 192 ? -10.263 10.462 -3.692 1.00 93.72 192 A 1 ATOM 1536 O O . TYR A 1 192 ? -11.228 9.829 -3.284 1.00 92.96 192 A 1 ATOM 1537 C CB . TYR A 1 192 ? -8.510 9.168 -4.961 1.00 91.84 192 A 1 ATOM 1538 C CG . TYR A 1 192 ? -9.483 8.077 -5.381 1.00 90.88 192 A 1 ATOM 1539 C CD1 . TYR A 1 192 ? -9.243 6.735 -5.016 1.00 87.53 192 A 1 ATOM 1540 C CD2 . TYR A 1 192 ? -10.646 8.399 -6.115 1.00 87.58 192 A 1 ATOM 1541 C CE1 . TYR A 1 192 ? -10.164 5.731 -5.360 1.00 83.82 192 A 1 ATOM 1542 C CE2 . TYR A 1 192 ? -11.577 7.393 -6.456 1.00 84.22 192 A 1 ATOM 1543 C CZ . TYR A 1 192 ? -11.337 6.059 -6.075 1.00 85.04 192 A 1 ATOM 1544 O OH . TYR A 1 192 ? -12.243 5.093 -6.388 1.00 81.78 192 A 1 ATOM 1545 N N . GLU A 1 193 ? -10.364 11.630 -4.307 1.00 92.43 193 A 1 ATOM 1546 C CA . GLU A 1 193 ? -11.625 12.246 -4.704 1.00 91.52 193 A 1 ATOM 1547 C C . GLU A 1 193 ? -11.789 12.171 -6.224 1.00 92.34 193 A 1 ATOM 1548 O O . GLU A 1 193 ? -10.812 12.229 -6.983 1.00 90.21 193 A 1 ATOM 1549 C CB . GLU A 1 193 ? -11.661 13.697 -4.234 1.00 88.99 193 A 1 ATOM 1550 C CG . GLU A 1 193 ? -11.691 13.821 -2.702 1.00 77.05 193 A 1 ATOM 1551 C CD . GLU A 1 193 ? -11.559 15.282 -2.235 1.00 76.07 193 A 1 ATOM 1552 O OE1 . GLU A 1 193 ? -11.540 15.479 -1.008 1.00 67.96 193 A 1 ATOM 1553 O OE2 . GLU A 1 193 ? -11.414 16.176 -3.112 1.00 69.06 193 A 1 ATOM 1554 N N . LEU A 1 194 ? -13.035 12.043 -6.686 1.00 90.73 194 A 1 ATOM 1555 C CA . LEU A 1 194 ? -13.347 12.126 -8.110 1.00 90.29 194 A 1 ATOM 1556 C C . LEU A 1 194 ? -13.524 13.594 -8.508 1.00 91.84 194 A 1 ATOM 1557 O O . LEU A 1 194 ? -14.432 14.270 -8.036 1.00 90.87 194 A 1 ATOM 1558 C CB . LEU A 1 194 ? -14.596 11.292 -8.440 1.00 88.37 194 A 1 ATOM 1559 C CG . LEU A 1 194 ? -14.392 9.770 -8.352 1.00 84.12 194 A 1 ATOM 1560 C CD1 . LEU A 1 194 ? -15.721 9.064 -8.617 1.00 80.04 194 A 1 ATOM 1561 C CD2 . LEU A 1 194 ? -13.374 9.255 -9.379 1.00 80.13 194 A 1 ATOM 1562 N N . VAL A 1 195 ? -12.675 14.064 -9.414 1.00 91.06 195 A 1 ATOM 1563 C CA . VAL A 1 195 ? -12.718 15.433 -9.933 1.00 90.82 195 A 1 ATOM 1564 C C . VAL A 1 195 ? -13.080 15.391 -11.412 1.00 91.86 195 A 1 ATOM 1565 O O . VAL A 1 195 ? -12.422 14.710 -12.204 1.00 90.17 195 A 1 ATOM 1566 C CB . VAL A 1 195 ? -11.391 16.171 -9.685 1.00 89.86 195 A 1 ATOM 1567 C CG1 . VAL A 1 195 ? -11.469 17.628 -10.154 1.00 82.54 195 A 1 ATOM 1568 C CG2 . VAL A 1 195 ? -11.028 16.181 -8.191 1.00 83.79 195 A 1 ATOM 1569 N N . GLU A 1 196 ? -14.121 16.127 -11.796 1.00 88.96 196 A 1 ATOM 1570 C CA . GLU A 1 196 ? -14.493 16.261 -13.204 1.00 88.34 196 A 1 ATOM 1571 C C . GLU A 1 196 ? -13.611 17.310 -13.898 1.00 87.04 196 A 1 ATOM 1572 O O . GLU A 1 196 ? -13.503 18.459 -13.466 1.00 83.61 196 A 1 ATOM 1573 C CB . GLU A 1 196 ? -15.987 16.581 -13.352 1.00 87.23 196 A 1 ATOM 1574 C CG . GLU A 1 196 ? -16.424 16.357 -14.810 1.00 82.41 196 A 1 ATOM 1575 C CD . GLU A 1 196 ? -17.882 16.720 -15.101 1.00 79.80 196 A 1 ATOM 1576 O OE1 . GLU A 1 196 ? -18.211 16.702 -16.316 1.00 72.86 196 A 1 ATOM 1577 O OE2 . GLU A 1 196 ? -18.636 17.030 -14.164 1.00 76.54 196 A 1 ATOM 1578 N N . GLN A 1 197 ? -12.994 16.927 -15.011 1.00 92.83 197 A 1 ATOM 1579 C CA . GLN A 1 197 ? -12.262 17.836 -15.887 1.00 91.09 197 A 1 ATOM 1580 C C . GLN A 1 197 ? -12.587 17.512 -17.346 1.00 91.00 197 A 1 ATOM 1581 O O . GLN A 1 197 ? -12.403 16.377 -17.795 1.00 88.25 197 A 1 ATOM 1582 C CB . GLN A 1 197 ? -10.749 17.737 -15.652 1.00 88.96 197 A 1 ATOM 1583 C CG . GLN A 1 197 ? -10.299 18.173 -14.252 1.00 78.71 197 A 1 ATOM 1584 C CD . GLN A 1 197 ? -8.783 18.179 -14.097 1.00 75.23 197 A 1 ATOM 1585 O OE1 . GLN A 1 197 ? -8.021 17.993 -15.033 1.00 70.01 197 A 1 ATOM 1586 N NE2 . GLN A 1 197 ? -8.281 18.403 -12.902 1.00 66.83 197 A 1 ATOM 1587 N N . LYS A 1 198 ? -13.053 18.513 -18.103 1.00 89.88 198 A 1 ATOM 1588 C CA . LYS A 1 198 ? -13.393 18.355 -19.534 1.00 88.16 198 A 1 ATOM 1589 C C . LYS A 1 198 ? -14.341 17.163 -19.794 1.00 88.93 198 A 1 ATOM 1590 O O . LYS A 1 198 ? -14.109 16.371 -20.706 1.00 85.27 198 A 1 ATOM 1591 C CB . LYS A 1 198 ? -12.108 18.277 -20.391 1.00 88.07 198 A 1 ATOM 1592 C CG . LYS A 1 198 ? -11.180 19.487 -20.242 1.00 85.96 198 A 1 ATOM 1593 C CD . LYS A 1 198 ? -9.946 19.334 -21.152 1.00 79.21 198 A 1 ATOM 1594 C CE . LYS A 1 198 ? -9.036 20.561 -21.004 1.00 77.40 198 A 1 ATOM 1595 N NZ . LYS A 1 198 ? -7.826 20.479 -21.864 1.00 66.62 198 A 1 ATOM 1596 N N . LYS A 1 199 ? -15.393 17.032 -18.971 1.00 89.15 199 A 1 ATOM 1597 C CA . LYS A 1 199 ? -16.396 15.946 -19.022 1.00 87.25 199 A 1 ATOM 1598 C C . LYS A 1 199 ? -15.819 14.531 -18.799 1.00 88.06 199 A 1 ATOM 1599 O O . LYS A 1 199 ? -16.389 13.544 -19.261 1.00 83.72 199 A 1 ATOM 1600 C CB . LYS A 1 199 ? -17.239 16.017 -20.310 1.00 86.76 199 A 1 ATOM 1601 C CG . LYS A 1 199 ? -17.887 17.383 -20.568 1.00 83.51 199 A 1 ATOM 1602 C CD . LYS A 1 199 ? -18.729 17.328 -21.848 1.00 75.82 199 A 1 ATOM 1603 C CE . LYS A 1 199 ? -19.416 18.678 -22.082 1.00 74.17 199 A 1 ATOM 1604 N NZ . LYS A 1 199 ? -20.308 18.658 -23.270 1.00 62.94 199 A 1 ATOM 1605 N N . LYS A 1 200 ? -14.684 14.423 -18.104 1.00 90.02 200 A 1 ATOM 1606 C CA . LYS A 1 200 ? -14.080 13.152 -17.693 1.00 88.28 200 A 1 ATOM 1607 C C . LYS A 1 200 ? -13.775 13.188 -16.204 1.00 91.37 200 A 1 ATOM 1608 O O . LYS A 1 200 ? -13.292 14.199 -15.700 1.00 89.49 200 A 1 ATOM 1609 C CB . LYS A 1 200 ? -12.805 12.871 -18.490 1.00 84.40 200 A 1 ATOM 1610 C CG . LYS A 1 200 ? -13.077 12.634 -19.978 1.00 77.48 200 A 1 ATOM 1611 C CD . LYS A 1 200 ? -11.780 12.247 -20.694 1.00 73.32 200 A 1 ATOM 1612 C CE . LYS A 1 200 ? -12.064 12.004 -22.174 1.00 67.74 200 A 1 ATOM 1613 N NZ . LYS A 1 200 ? -10.843 11.560 -22.890 1.00 60.03 200 A 1 ATOM 1614 N N . TRP A 1 201 ? -14.012 12.059 -15.545 1.00 90.95 201 A 1 ATOM 1615 C CA . TRP A 1 201 ? -13.700 11.887 -14.132 1.00 90.12 201 A 1 ATOM 1616 C C . TRP A 1 201 ? -12.260 11.408 -13.946 1.00 91.01 201 A 1 ATOM 1617 O O . TRP A 1 201 ? -11.819 10.468 -14.600 1.00 88.31 201 A 1 ATOM 1618 C CB . TRP A 1 201 ? -14.721 10.931 -13.515 1.00 88.73 201 A 1 ATOM 1619 C CG . TRP A 1 201 ? -16.112 11.493 -13.487 1.00 87.43 201 A 1 ATOM 1620 C CD1 . TRP A 1 201 ? -17.092 11.257 -14.387 1.00 82.69 201 A 1 ATOM 1621 C CD2 . TRP A 1 201 ? -16.672 12.426 -12.520 1.00 85.63 201 A 1 ATOM 1622 N NE1 . TRP A 1 201 ? -18.223 11.974 -14.044 1.00 79.70 201 A 1 ATOM 1623 C CE2 . TRP A 1 201 ? -18.018 12.710 -12.896 1.00 83.02 201 A 1 ATOM 1624 C CE3 . TRP A 1 201 ? -16.179 13.056 -11.355 1.00 79.80 201 A 1 ATOM 1625 C CZ2 . TRP A 1 201 ? -18.833 13.572 -12.151 1.00 81.47 201 A 1 ATOM 1626 C CZ3 . TRP A 1 201 ? -16.990 13.922 -10.606 1.00 78.54 201 A 1 ATOM 1627 C CH2 . TRP A 1 201 ? -18.315 14.179 -10.998 1.00 77.78 201 A 1 ATOM 1628 N N . TYR A 1 202 ? -11.552 12.055 -13.030 1.00 93.18 202 A 1 ATOM 1629 C CA . TYR A 1 202 ? -10.183 11.717 -12.651 1.00 92.36 202 A 1 ATOM 1630 C C . TYR A 1 202 ? -10.100 11.479 -11.149 1.00 93.01 202 A 1 ATOM 1631 O O . TYR A 1 202 ? -10.743 12.168 -10.362 1.00 91.28 202 A 1 ATOM 1632 C CB . TYR A 1 202 ? -9.224 12.838 -13.065 1.00 90.15 202 A 1 ATOM 1633 C CG . TYR A 1 202 ? -9.167 13.065 -14.561 1.00 82.37 202 A 1 ATOM 1634 C CD1 . TYR A 1 202 ? -8.222 12.380 -15.349 1.00 76.72 202 A 1 ATOM 1635 C CD2 . TYR A 1 202 ? -10.071 13.953 -15.167 1.00 77.15 202 A 1 ATOM 1636 C CE1 . TYR A 1 202 ? -8.178 12.586 -16.739 1.00 69.30 202 A 1 ATOM 1637 C CE2 . TYR A 1 202 ? -10.035 14.157 -16.562 1.00 72.27 202 A 1 ATOM 1638 C CZ . TYR A 1 202 ? -9.084 13.477 -17.346 1.00 70.84 202 A 1 ATOM 1639 O OH . TYR A 1 202 ? -9.038 13.681 -18.690 1.00 68.06 202 A 1 ATOM 1640 N N . ARG A 1 203 ? -9.254 10.515 -10.748 1.00 92.82 203 A 1 ATOM 1641 C CA . ARG A 1 203 ? -8.912 10.300 -9.338 1.00 91.87 203 A 1 ATOM 1642 C C . ARG A 1 203 ? -7.832 11.298 -8.934 1.00 93.20 203 A 1 ATOM 1643 O O . ARG A 1 203 ? -6.711 11.216 -9.437 1.00 92.52 203 A 1 ATOM 1644 C CB . ARG A 1 203 ? -8.446 8.854 -9.113 1.00 90.02 203 A 1 ATOM 1645 C CG . ARG A 1 203 ? -9.577 7.841 -9.329 1.00 86.32 203 A 1 ATOM 1646 C CD . ARG A 1 203 ? -9.050 6.418 -9.135 1.00 83.67 203 A 1 ATOM 1647 N NE . ARG A 1 203 ? -10.108 5.416 -9.366 1.00 78.07 203 A 1 ATOM 1648 C CZ . ARG A 1 203 ? -9.945 4.104 -9.418 1.00 74.48 203 A 1 ATOM 1649 N NH1 . ARG A 1 203 ? -8.779 3.543 -9.260 1.00 69.28 203 A 1 ATOM 1650 N NH2 . ARG A 1 203 ? -10.964 3.324 -9.627 1.00 67.24 203 A 1 ATOM 1651 N N . LYS A 1 204 ? -8.169 12.213 -8.026 1.00 92.31 204 A 1 ATOM 1652 C CA . LYS A 1 204 ? -7.206 13.104 -7.375 1.00 92.78 204 A 1 ATOM 1653 C C . LYS A 1 204 ? -6.844 12.497 -6.023 1.00 93.21 204 A 1 ATOM 1654 O O . LYS A 1 204 ? -7.663 12.511 -5.110 1.00 92.05 204 A 1 ATOM 1655 C CB . LYS A 1 204 ? -7.810 14.505 -7.260 1.00 92.92 204 A 1 ATOM 1656 C CG . LYS A 1 204 ? -6.807 15.508 -6.676 1.00 90.09 204 A 1 ATOM 1657 C CD . LYS A 1 204 ? -7.474 16.873 -6.494 1.00 86.54 204 A 1 ATOM 1658 C CE . LYS A 1 204 ? -6.524 17.863 -5.829 1.00 79.76 204 A 1 ATOM 1659 N NZ . LYS A 1 204 ? -7.243 19.095 -5.421 1.00 70.92 204 A 1 ATOM 1660 N N . PHE A 1 205 ? -5.645 11.945 -5.920 1.00 94.35 205 A 1 ATOM 1661 C CA . PHE A 1 205 ? -5.195 11.292 -4.692 1.00 93.84 205 A 1 ATOM 1662 C C . PHE A 1 205 ? -4.739 12.311 -3.646 1.00 95.00 205 A 1 ATOM 1663 O O . PHE A 1 205 ? -3.948 13.205 -3.959 1.00 94.36 205 A 1 ATOM 1664 C CB . PHE A 1 205 ? -4.083 10.282 -4.996 1.00 92.17 205 A 1 ATOM 1665 C CG . PHE A 1 205 ? -4.586 9.009 -5.650 1.00 90.91 205 A 1 ATOM 1666 C CD1 . PHE A 1 205 ? -5.012 7.933 -4.851 1.00 87.53 205 A 1 ATOM 1667 C CD2 . PHE A 1 205 ? -4.643 8.899 -7.052 1.00 87.59 205 A 1 ATOM 1668 C CE1 . PHE A 1 205 ? -5.487 6.754 -5.445 1.00 85.79 205 A 1 ATOM 1669 C CE2 . PHE A 1 205 ? -5.123 7.723 -7.647 1.00 85.40 205 A 1 ATOM 1670 C CZ . PHE A 1 205 ? -5.540 6.645 -6.843 1.00 85.80 205 A 1 ATOM 1671 N N . SER A 1 206 ? -5.191 12.102 -2.400 1.00 95.04 206 A 1 ATOM 1672 C CA . SER A 1 206 ? -4.553 12.643 -1.206 1.00 95.13 206 A 1 ATOM 1673 C C . SER A 1 206 ? -3.326 11.792 -0.887 1.00 95.96 206 A 1 ATOM 1674 O O . SER A 1 206 ? -3.386 10.556 -0.933 1.00 94.76 206 A 1 ATOM 1675 C CB . SER A 1 206 ? -5.514 12.653 -0.015 1.00 93.81 206 A 1 ATOM 1676 O OG . SER A 1 206 ? -4.860 13.298 1.052 1.00 77.20 206 A 1 ATOM 1677 N N . LYS A 1 207 ? -2.198 12.458 -0.622 1.00 96.46 207 A 1 ATOM 1678 C CA . LYS A 1 207 ? -0.916 11.801 -0.359 1.00 96.36 207 A 1 ATOM 1679 C C . LYS A 1 207 ? -0.429 12.127 1.039 1.00 97.12 207 A 1 ATOM 1680 O O . LYS A 1 207 ? -0.541 13.270 1.465 1.00 96.06 207 A 1 ATOM 1681 C CB . LYS A 1 207 ? 0.144 12.206 -1.387 1.00 94.75 207 A 1 ATOM 1682 C CG . LYS A 1 207 ? -0.190 11.717 -2.800 1.00 92.80 207 A 1 ATOM 1683 C CD . LYS A 1 207 ? 1.013 11.952 -3.716 1.00 89.14 207 A 1 ATOM 1684 C CE . LYS A 1 207 ? 0.732 11.371 -5.102 1.00 85.56 207 A 1 ATOM 1685 N NZ . LYS A 1 207 ? 1.970 11.321 -5.909 1.00 77.70 207 A 1 ATOM 1686 N N . GLN A 1 208 ? 0.174 11.137 1.673 1.00 97.01 208 A 1 ATOM 1687 C CA . GLN A 1 208 ? 0.814 11.255 2.970 1.00 97.13 208 A 1 ATOM 1688 C C . GLN A 1 208 ? 2.330 11.147 2.815 1.00 97.53 208 A 1 ATOM 1689 O O . GLN A 1 208 ? 2.829 10.337 2.026 1.00 96.69 208 A 1 ATOM 1690 C CB . GLN A 1 208 ? 0.256 10.190 3.914 1.00 96.47 208 A 1 ATOM 1691 C CG . GLN A 1 208 ? -1.254 10.350 4.144 1.00 92.33 208 A 1 ATOM 1692 C CD . GLN A 1 208 ? -1.649 11.687 4.766 1.00 91.95 208 A 1 ATOM 1693 O OE1 . GLN A 1 208 ? -0.855 12.422 5.324 1.00 83.09 208 A 1 ATOM 1694 N NE2 . GLN A 1 208 ? -2.903 12.071 4.678 1.00 79.24 208 A 1 ATOM 1695 N N . GLU A 1 209 ? 3.046 12.000 3.540 1.00 96.71 209 A 1 ATOM 1696 C CA . GLU A 1 209 ? 4.507 12.029 3.566 1.00 96.79 209 A 1 ATOM 1697 C C . GLU A 1 209 ? 4.994 11.206 4.758 1.00 97.14 209 A 1 ATOM 1698 O O . GLU A 1 209 ? 4.706 11.516 5.914 1.00 96.46 209 A 1 ATOM 1699 C CB . GLU A 1 209 ? 5.032 13.470 3.581 1.00 96.39 209 A 1 ATOM 1700 C CG . GLU A 1 209 ? 4.579 14.216 2.311 1.00 94.66 209 A 1 ATOM 1701 C CD . GLU A 1 209 ? 5.256 15.559 2.058 1.00 93.69 209 A 1 ATOM 1702 O OE1 . GLU A 1 209 ? 5.115 16.021 0.885 1.00 86.60 209 A 1 ATOM 1703 O OE2 . GLU A 1 209 ? 5.906 16.107 2.967 1.00 87.76 209 A 1 ATOM 1704 N N . VAL A 1 210 ? 5.711 10.126 4.461 1.00 97.76 210 A 1 ATOM 1705 C CA . VAL A 1 210 ? 6.158 9.150 5.451 1.00 97.80 210 A 1 ATOM 1706 C C . VAL A 1 210 ? 7.607 8.748 5.221 1.00 97.81 210 A 1 ATOM 1707 O O . VAL A 1 210 ? 8.146 8.866 4.120 1.00 97.48 210 A 1 ATOM 1708 C CB . VAL A 1 210 ? 5.258 7.894 5.487 1.00 97.55 210 A 1 ATOM 1709 C CG1 . VAL A 1 210 ? 3.821 8.233 5.874 1.00 96.44 210 A 1 ATOM 1710 C CG2 . VAL A 1 210 ? 5.246 7.133 4.152 1.00 95.86 210 A 1 ATOM 1711 N N . LEU A 1 211 ? 8.219 8.238 6.273 1.00 98.00 211 A 1 ATOM 1712 C CA . LEU A 1 211 ? 9.523 7.603 6.275 1.00 97.98 211 A 1 ATOM 1713 C C . LEU A 1 211 ? 9.322 6.092 6.361 1.00 98.23 211 A 1 ATOM 1714 O O . LEU A 1 211 ? 8.605 5.617 7.236 1.00 98.01 211 A 1 ATOM 1715 C CB . LEU A 1 211 ? 10.341 8.143 7.459 1.00 97.55 211 A 1 ATOM 1716 C CG . LEU A 1 211 ? 10.537 9.672 7.435 1.00 96.29 211 A 1 ATOM 1717 C CD1 . LEU A 1 211 ? 11.137 10.137 8.752 1.00 93.95 211 A 1 ATOM 1718 C CD2 . LEU A 1 211 ? 11.442 10.119 6.284 1.00 93.89 211 A 1 ATOM 1719 N N . TYR A 1 212 ? 9.959 5.344 5.476 1.00 98.07 212 A 1 ATOM 1720 C CA . TYR A 1 212 ? 10.135 3.908 5.654 1.00 98.04 212 A 1 ATOM 1721 C C . TYR A 1 212 ? 11.302 3.694 6.618 1.00 98.04 212 A 1 ATOM 1722 O O . TYR A 1 212 ? 12.467 3.862 6.247 1.00 97.57 212 A 1 ATOM 1723 C CB . TYR A 1 212 ? 10.353 3.224 4.304 1.00 97.93 212 A 1 ATOM 1724 C CG . TYR A 1 212 ? 10.676 1.749 4.418 1.00 97.91 212 A 1 ATOM 1725 C CD1 . TYR A 1 212 ? 12.005 1.303 4.271 1.00 97.08 212 A 1 ATOM 1726 C CD2 . TYR A 1 212 ? 9.654 0.820 4.685 1.00 97.18 212 A 1 ATOM 1727 C CE1 . TYR A 1 212 ? 12.304 -0.069 4.363 1.00 96.63 212 A 1 ATOM 1728 C CE2 . TYR A 1 212 ? 9.950 -0.555 4.779 1.00 96.59 212 A 1 ATOM 1729 C CZ . TYR A 1 212 ? 11.277 -0.999 4.607 1.00 96.76 212 A 1 ATOM 1730 O OH . TYR A 1 212 ? 11.565 -2.329 4.674 1.00 95.51 212 A 1 ATOM 1731 N N . ALA A 1 213 ? 10.966 3.389 7.859 1.00 97.93 213 A 1 ATOM 1732 C CA . ALA A 1 213 ? 11.902 3.097 8.931 1.00 97.85 213 A 1 ATOM 1733 C C . ALA A 1 213 ? 12.070 1.580 9.043 1.00 97.89 213 A 1 ATOM 1734 O O . ALA A 1 213 ? 11.084 0.856 9.180 1.00 97.06 213 A 1 ATOM 1735 C CB . ALA A 1 213 ? 11.376 3.736 10.217 1.00 97.47 213 A 1 ATOM 1736 N N . GLY A 1 214 ? 13.319 1.101 8.939 1.00 97.19 214 A 1 ATOM 1737 C CA . GLY A 1 214 ? 13.630 -0.322 9.067 1.00 96.69 214 A 1 ATOM 1738 C C . GLY A 1 214 ? 13.478 -0.833 10.503 1.00 97.02 214 A 1 ATOM 1739 O O . GLY A 1 214 ? 13.465 -0.052 11.456 1.00 96.31 214 A 1 ATOM 1740 N N . GLU A 1 215 ? 13.409 -2.149 10.637 1.00 95.90 215 A 1 ATOM 1741 C CA . GLU A 1 215 ? 13.616 -2.830 11.919 1.00 95.52 215 A 1 ATOM 1742 C C . GLU A 1 215 ? 14.937 -2.367 12.552 1.00 95.45 215 A 1 ATOM 1743 O O . GLU A 1 215 ? 15.912 -2.100 11.848 1.00 92.90 215 A 1 ATOM 1744 C CB . GLU A 1 215 ? 13.613 -4.346 11.654 1.00 93.82 215 A 1 ATOM 1745 C CG . GLU A 1 215 ? 13.776 -5.204 12.916 1.00 87.47 215 A 1 ATOM 1746 C CD . GLU A 1 215 ? 13.733 -6.709 12.609 1.00 87.51 215 A 1 ATOM 1747 O OE1 . GLU A 1 215 ? 14.069 -7.497 13.518 1.00 78.24 215 A 1 ATOM 1748 O OE2 . GLU A 1 215 ? 13.338 -7.082 11.474 1.00 80.51 215 A 1 ATOM 1749 N N . GLY A 1 216 ? 14.971 -2.222 13.862 1.00 95.77 216 A 1 ATOM 1750 C CA . GLY A 1 216 ? 16.115 -1.679 14.598 1.00 95.51 216 A 1 ATOM 1751 C C . GLY A 1 216 ? 16.170 -0.153 14.681 1.00 96.29 216 A 1 ATOM 1752 O O . GLY A 1 216 ? 17.001 0.406 15.396 1.00 94.94 216 A 1 ATOM 1753 N N . THR A 1 217 ? 15.294 0.562 13.965 1.00 96.44 217 A 1 ATOM 1754 C CA . THR A 1 217 ? 15.236 2.026 14.063 1.00 96.58 217 A 1 ATOM 1755 C C . THR A 1 217 ? 14.779 2.440 15.459 1.00 96.91 217 A 1 ATOM 1756 O O . THR A 1 217 ? 13.766 1.961 15.960 1.00 96.33 217 A 1 ATOM 1757 C CB . THR A 1 217 ? 14.322 2.649 13.004 1.00 96.41 217 A 1 ATOM 1758 O OG1 . THR A 1 217 ? 14.752 2.279 11.717 1.00 94.29 217 A 1 ATOM 1759 C CG2 . THR A 1 217 ? 14.335 4.181 13.046 1.00 94.24 217 A 1 ATOM 1760 N N . ILE A 1 218 ? 15.509 3.371 16.074 1.00 96.23 218 A 1 ATOM 1761 C CA . ILE A 1 218 ? 15.219 3.862 17.421 1.00 95.83 218 A 1 ATOM 1762 C C . ILE A 1 218 ? 14.218 5.018 17.357 1.00 95.92 218 A 1 ATOM 1763 O O . ILE A 1 218 ? 14.473 6.041 16.724 1.00 95.16 218 A 1 ATOM 1764 C CB . ILE A 1 218 ? 16.520 4.247 18.160 1.00 95.10 218 A 1 ATOM 1765 C CG1 . ILE A 1 218 ? 17.443 3.015 18.305 1.00 92.43 218 A 1 ATOM 1766 C CG2 . ILE A 1 218 ? 16.201 4.854 19.542 1.00 92.55 218 A 1 ATOM 1767 C CD1 . ILE A 1 218 ? 18.827 3.323 18.889 1.00 83.07 218 A 1 ATOM 1768 N N . ILE A 1 219 ? 13.120 4.877 18.094 1.00 96.18 219 A 1 ATOM 1769 C CA . ILE A 1 219 ? 12.200 5.961 18.429 1.00 95.92 219 A 1 ATOM 1770 C C . ILE A 1 219 ? 12.744 6.653 19.688 1.00 95.99 219 A 1 ATOM 1771 O O . ILE A 1 219 ? 12.933 5.995 20.717 1.00 95.62 219 A 1 ATOM 1772 C CB . ILE A 1 219 ? 10.764 5.449 18.653 1.00 95.70 219 A 1 ATOM 1773 C CG1 . ILE A 1 219 ? 10.273 4.523 17.520 1.00 93.80 219 A 1 ATOM 1774 C CG2 . ILE A 1 219 ? 9.825 6.668 18.790 1.00 93.50 219 A 1 ATOM 1775 C CD1 . ILE A 1 219 ? 8.969 3.805 17.884 1.00 89.93 219 A 1 ATOM 1776 N N . PRO A 1 220 ? 13.017 7.972 19.631 1.00 95.29 220 A 1 ATOM 1777 C CA . PRO A 1 220 ? 13.564 8.692 20.772 1.00 94.69 220 A 1 ATOM 1778 C C . PRO A 1 220 ? 12.626 8.687 21.985 1.00 95.05 220 A 1 ATOM 1779 O O . PRO A 1 220 ? 11.403 8.753 21.848 1.00 94.62 220 A 1 ATOM 1780 C CB . PRO A 1 220 ? 13.834 10.115 20.282 1.00 93.36 220 A 1 ATOM 1781 C CG . PRO A 1 220 ? 13.957 9.957 18.770 1.00 91.41 220 A 1 ATOM 1782 C CD . PRO A 1 220 ? 12.978 8.832 18.464 1.00 94.06 220 A 1 ATOM 1783 N N . LYS A 1 221 ? 13.232 8.700 23.175 1.00 93.72 221 A 1 ATOM 1784 C CA . LYS A 1 221 ? 12.557 9.027 24.432 1.00 93.77 221 A 1 ATOM 1785 C C . LYS A 1 221 ? 11.739 10.323 24.286 1.00 94.11 221 A 1 ATOM 1786 O O . LYS A 1 221 ? 12.116 11.210 23.521 1.00 92.38 221 A 1 ATOM 1787 C CB . LYS A 1 221 ? 13.627 9.149 25.536 1.00 92.84 221 A 1 ATOM 1788 C CG . LYS A 1 221 ? 12.991 9.432 26.894 1.00 91.35 221 A 1 ATOM 1789 C CD . LYS A 1 221 ? 13.996 9.707 28.005 1.00 88.93 221 A 1 ATOM 1790 C CE . LYS A 1 221 ? 13.150 10.243 29.167 1.00 82.74 221 A 1 ATOM 1791 N NZ . LYS A 1 221 ? 13.960 10.612 30.339 1.00 76.12 221 A 1 ATOM 1792 N N . ASP A 1 222 ? 10.674 10.429 25.060 1.00 93.55 222 A 1 ATOM 1793 C CA . ASP A 1 222 ? 9.744 11.567 25.104 1.00 93.85 222 A 1 ATOM 1794 C C . ASP A 1 222 ? 8.939 11.777 23.802 1.00 94.45 222 A 1 ATOM 1795 O O . ASP A 1 222 ? 8.223 12.768 23.662 1.00 92.57 222 A 1 ATOM 1796 C CB . ASP A 1 222 ? 10.443 12.842 25.625 1.00 93.09 222 A 1 ATOM 1797 C CG . ASP A 1 222 ? 11.219 12.629 26.938 1.00 91.51 222 A 1 ATOM 1798 O OD1 . ASP A 1 222 ? 10.672 12.008 27.875 1.00 87.95 222 A 1 ATOM 1799 O OD2 . ASP A 1 222 ? 12.394 13.061 27.029 1.00 88.35 222 A 1 ATOM 1800 N N . SER A 1 223 ? 9.026 10.841 22.846 1.00 94.84 223 A 1 ATOM 1801 C CA . SER A 1 223 ? 8.147 10.831 21.673 1.00 94.60 223 A 1 ATOM 1802 C C . SER A 1 223 ? 6.731 10.419 22.077 1.00 95.40 223 A 1 ATOM 1803 O O . SER A 1 223 ? 6.550 9.417 22.773 1.00 94.49 223 A 1 ATOM 1804 C CB . SER A 1 223 ? 8.654 9.882 20.582 1.00 93.89 223 A 1 ATOM 1805 O OG . SER A 1 223 ? 9.966 10.246 20.183 1.00 89.86 223 A 1 ATOM 1806 N N . LEU A 1 224 ? 5.728 11.163 21.601 1.00 94.66 224 A 1 ATOM 1807 C CA . LEU A 1 224 ? 4.326 10.761 21.695 1.00 94.99 224 A 1 ATOM 1808 C C . LEU A 1 224 ? 4.032 9.774 20.563 1.00 95.42 224 A 1 ATOM 1809 O O . LEU A 1 224 ? 4.160 10.138 19.394 1.00 93.97 224 A 1 ATOM 1810 C CB . LEU A 1 224 ? 3.440 12.017 21.622 1.00 94.17 224 A 1 ATOM 1811 C CG . LEU A 1 224 ? 1.941 11.734 21.833 1.00 87.83 224 A 1 ATOM 1812 C CD1 . LEU A 1 224 ? 1.648 11.314 23.275 1.00 84.03 224 A 1 ATOM 1813 C CD2 . LEU A 1 224 ? 1.135 12.999 21.528 1.00 84.68 224 A 1 ATOM 1814 N N . ILE A 1 225 ? 3.661 8.541 20.898 1.00 96.54 225 A 1 ATOM 1815 C CA . ILE A 1 225 ? 3.402 7.461 19.938 1.00 96.36 225 A 1 ATOM 1816 C C . ILE A 1 225 ? 2.081 6.767 20.244 1.00 97.12 225 A 1 ATOM 1817 O O . ILE A 1 225 ? 1.574 6.847 21.360 1.00 96.71 225 A 1 ATOM 1818 C CB . ILE A 1 225 ? 4.560 6.435 19.901 1.00 94.77 225 A 1 ATOM 1819 C CG1 . ILE A 1 225 ? 4.762 5.735 21.259 1.00 85.83 225 A 1 ATOM 1820 C CG2 . ILE A 1 225 ? 5.858 7.099 19.408 1.00 81.80 225 A 1 ATOM 1821 C CD1 . ILE A 1 225 ? 5.585 4.452 21.142 1.00 80.63 225 A 1 ATOM 1822 N N . TRP A 1 226 ? 1.555 6.053 19.256 1.00 97.72 226 A 1 ATOM 1823 C CA . TRP A 1 226 ? 0.431 5.146 19.460 1.00 97.81 226 A 1 ATOM 1824 C C . TRP A 1 226 ? 0.941 3.747 19.799 1.00 97.91 226 A 1 ATOM 1825 O O . TRP A 1 226 ? 1.882 3.256 19.168 1.00 97.32 226 A 1 ATOM 1826 C CB . TRP A 1 226 ? -0.461 5.130 18.223 1.00 97.51 226 A 1 ATOM 1827 C CG . TRP A 1 226 ? -1.221 6.397 18.006 1.00 96.93 226 A 1 ATOM 1828 C CD1 . TRP A 1 226 ? -0.773 7.502 17.381 1.00 94.16 226 A 1 ATOM 1829 C CD2 . TRP A 1 226 ? -2.578 6.698 18.440 1.00 95.29 226 A 1 ATOM 1830 N NE1 . TRP A 1 226 ? -1.755 8.471 17.392 1.00 92.72 226 A 1 ATOM 1831 C CE2 . TRP A 1 226 ? -2.893 8.028 18.032 1.00 94.60 226 A 1 ATOM 1832 C CE3 . TRP A 1 226 ? -3.572 5.980 19.140 1.00 92.81 226 A 1 ATOM 1833 C CZ2 . TRP A 1 226 ? -4.135 8.614 18.302 1.00 92.70 226 A 1 ATOM 1834 C CZ3 . TRP A 1 226 ? -4.822 6.558 19.416 1.00 90.20 226 A 1 ATOM 1835 C CH2 . TRP A 1 226 ? -5.108 7.874 18.997 1.00 89.69 226 A 1 ATOM 1836 N N . VAL A 1 227 ? 0.282 3.111 20.764 1.00 97.66 227 A 1 ATOM 1837 C CA . VAL A 1 227 ? 0.580 1.745 21.204 1.00 97.82 227 A 1 ATOM 1838 C C . VAL A 1 227 ? -0.724 0.965 21.320 1.00 98.14 227 A 1 ATOM 1839 O O . VAL A 1 227 ? -1.747 1.512 21.743 1.00 97.48 227 A 1 ATOM 1840 C CB . VAL A 1 227 ? 1.376 1.743 22.523 1.00 96.60 227 A 1 ATOM 1841 C CG1 . VAL A 1 227 ? 1.818 0.338 22.940 1.00 89.03 227 A 1 ATOM 1842 C CG2 . VAL A 1 227 ? 2.655 2.575 22.368 1.00 88.90 227 A 1 ATOM 1843 N N . ASP A 1 228 ? -0.685 -0.300 20.898 1.00 97.05 228 A 1 ATOM 1844 C CA . ASP A 1 228 ? -1.799 -1.222 21.085 1.00 96.85 228 A 1 ATOM 1845 C C . ASP A 1 228 ? -1.729 -1.940 22.450 1.00 96.84 228 A 1 ATOM 1846 O O . ASP A 1 228 ? -0.728 -1.873 23.161 1.00 95.63 228 A 1 ATOM 1847 C CB . ASP A 1 228 ? -1.940 -2.142 19.861 1.00 95.75 228 A 1 ATOM 1848 C CG . ASP A 1 228 ? -0.951 -3.304 19.729 1.00 95.95 228 A 1 ATOM 1849 O OD1 . ASP A 1 228 ? -0.230 -3.633 20.688 1.00 92.30 228 A 1 ATOM 1850 O OD2 . ASP A 1 228 ? -0.965 -3.960 18.653 1.00 92.36 228 A 1 ATOM 1851 N N . GLU A 1 229 ? -2.812 -2.640 22.815 1.00 96.49 229 A 1 ATOM 1852 C CA . GLU A 1 229 ? -2.888 -3.360 24.103 1.00 95.64 229 A 1 ATOM 1853 C C . GLU A 1 229 ? -1.870 -4.512 24.239 1.00 96.05 229 A 1 ATOM 1854 O O . GLU A 1 229 ? -1.580 -4.934 25.353 1.00 93.49 229 A 1 ATOM 1855 C CB . GLU A 1 229 ? -4.327 -3.856 24.345 1.00 92.54 229 A 1 ATOM 1856 C CG . GLU A 1 229 ? -4.707 -5.053 23.462 1.00 86.65 229 A 1 ATOM 1857 C CD . GLU A 1 229 ? -6.195 -5.440 23.468 1.00 89.42 229 A 1 ATOM 1858 O OE1 . GLU A 1 229 ? -6.502 -6.521 22.908 1.00 81.86 229 A 1 ATOM 1859 O OE2 . GLU A 1 229 ? -7.046 -4.640 23.920 1.00 84.57 229 A 1 ATOM 1860 N N . ASP A 1 230 ? -1.295 -5.004 23.121 1.00 96.41 230 A 1 ATOM 1861 C CA . ASP A 1 230 ? -0.196 -5.978 23.136 1.00 95.82 230 A 1 ATOM 1862 C C . ASP A 1 230 ? 1.171 -5.290 23.319 1.00 95.75 230 A 1 ATOM 1863 O O . ASP A 1 230 ? 2.208 -5.957 23.382 1.00 93.50 230 A 1 ATOM 1864 C CB . ASP A 1 230 ? -0.178 -6.807 21.841 1.00 95.24 230 A 1 ATOM 1865 C CG . ASP A 1 230 ? -1.428 -7.620 21.506 1.00 94.42 230 A 1 ATOM 1866 O OD1 . ASP A 1 230 ? -2.142 -8.166 22.371 1.00 91.57 230 A 1 ATOM 1867 O OD2 . ASP A 1 230 ? -1.658 -7.817 20.288 1.00 91.82 230 A 1 ATOM 1868 N N . GLY A 1 231 ? 1.201 -3.964 23.367 1.00 95.74 231 A 1 ATOM 1869 C CA . GLY A 1 231 ? 2.412 -3.163 23.462 1.00 95.25 231 A 1 ATOM 1870 C C . GLY A 1 231 ? 3.120 -2.945 22.123 1.00 95.72 231 A 1 ATOM 1871 O O . GLY A 1 231 ? 4.274 -2.525 22.126 1.00 93.72 231 A 1 ATOM 1872 N N . GLU A 1 232 ? 2.498 -3.204 20.973 1.00 95.99 232 A 1 ATOM 1873 C CA . GLU A 1 232 ? 3.103 -2.914 19.665 1.00 96.09 232 A 1 ATOM 1874 C C . GLU A 1 232 ? 2.911 -1.435 19.287 1.00 96.70 232 A 1 ATOM 1875 O O . GLU A 1 232 ? 1.855 -0.847 19.506 1.00 95.47 232 A 1 ATOM 1876 C CB . GLU A 1 232 ? 2.541 -3.831 18.573 1.00 95.14 232 A 1 ATOM 1877 C CG . GLU A 1 232 ? 2.900 -5.319 18.765 1.00 89.86 232 A 1 ATOM 1878 C CD . GLU A 1 232 ? 4.339 -5.686 18.359 1.00 86.30 232 A 1 ATOM 1879 O OE1 . GLU A 1 232 ? 4.938 -6.565 19.003 1.00 75.79 232 A 1 ATOM 1880 O OE2 . GLU A 1 232 ? 4.810 -5.207 17.288 1.00 75.58 232 A 1 ATOM 1881 N N . VAL A 1 233 ? 3.942 -0.843 18.691 1.00 96.64 233 A 1 ATOM 1882 C CA . VAL A 1 233 ? 3.901 0.549 18.222 1.00 96.71 233 A 1 ATOM 1883 C C . VAL A 1 233 ? 3.214 0.623 16.863 1.00 97.20 233 A 1 ATOM 1884 O O . VAL A 1 233 ? 3.498 -0.173 15.970 1.00 96.13 233 A 1 ATOM 1885 C CB . VAL A 1 233 ? 5.311 1.160 18.153 1.00 95.24 233 A 1 ATOM 1886 C CG1 . VAL A 1 233 ? 5.293 2.604 17.639 1.00 91.12 233 A 1 ATOM 1887 C CG2 . VAL A 1 233 ? 5.970 1.174 19.535 1.00 91.55 233 A 1 ATOM 1888 N N . LEU A 1 234 ? 2.363 1.623 16.682 1.00 96.46 234 A 1 ATOM 1889 C CA . LEU A 1 234 ? 1.696 1.914 15.420 1.00 96.44 234 A 1 ATOM 1890 C C . LEU A 1 234 ? 1.750 3.404 15.070 1.00 97.15 234 A 1 ATOM 1891 O O . LEU A 1 234 ? 1.871 4.271 15.929 1.00 96.30 234 A 1 ATOM 1892 C CB . LEU A 1 234 ? 0.262 1.340 15.407 1.00 93.87 234 A 1 ATOM 1893 C CG . LEU A 1 234 ? -0.703 1.927 16.453 1.00 93.15 234 A 1 ATOM 1894 C CD1 . LEU A 1 234 ? -2.131 1.847 15.937 1.00 87.59 234 A 1 ATOM 1895 C CD2 . LEU A 1 234 ? -0.651 1.144 17.764 1.00 88.53 234 A 1 ATOM 1896 N N . PHE A 1 235 ? 1.642 3.702 13.776 1.00 97.65 235 A 1 ATOM 1897 C CA . PHE A 1 235 ? 1.666 5.058 13.231 1.00 97.49 235 A 1 ATOM 1898 C C . PHE A 1 235 ? 0.483 5.241 12.277 1.00 97.71 235 A 1 ATOM 1899 O O . PHE A 1 235 ? 0.639 5.043 11.070 1.00 96.85 235 A 1 ATOM 1900 C CB . PHE A 1 235 ? 3.013 5.315 12.552 1.00 96.96 235 A 1 ATOM 1901 C CG . PHE A 1 235 ? 4.204 5.186 13.478 1.00 96.92 235 A 1 ATOM 1902 C CD1 . PHE A 1 235 ? 4.576 6.260 14.305 1.00 95.74 235 A 1 ATOM 1903 C CD2 . PHE A 1 235 ? 4.927 3.979 13.527 1.00 96.08 235 A 1 ATOM 1904 C CE1 . PHE A 1 235 ? 5.678 6.134 15.169 1.00 95.08 235 A 1 ATOM 1905 C CE2 . PHE A 1 235 ? 6.028 3.854 14.393 1.00 94.99 235 A 1 ATOM 1906 C CZ . PHE A 1 235 ? 6.407 4.933 15.210 1.00 95.05 235 A 1 ATOM 1907 N N . PRO A 1 236 ? -0.712 5.546 12.796 1.00 97.27 236 A 1 ATOM 1908 C CA . PRO A 1 236 ? -1.905 5.736 11.981 1.00 96.74 236 A 1 ATOM 1909 C C . PRO A 1 236 ? -1.783 6.995 11.116 1.00 96.67 236 A 1 ATOM 1910 O O . PRO A 1 236 ? -1.300 8.036 11.556 1.00 95.01 236 A 1 ATOM 1911 C CB . PRO A 1 236 ? -3.067 5.807 12.971 1.00 95.96 236 A 1 ATOM 1912 C CG . PRO A 1 236 ? -2.423 6.350 14.245 1.00 94.77 236 A 1 ATOM 1913 C CD . PRO A 1 236 ? -1.021 5.753 14.208 1.00 96.86 236 A 1 ATOM 1914 N N . VAL A 1 237 ? -2.240 6.870 9.868 1.00 96.20 237 A 1 ATOM 1915 C CA . VAL A 1 237 ? -2.219 7.920 8.846 1.00 95.60 237 A 1 ATOM 1916 C C . VAL A 1 237 ? -3.527 7.947 8.068 1.00 94.42 237 A 1 ATOM 1917 O O . VAL A 1 237 ? -4.003 6.865 7.672 1.00 89.21 237 A 1 ATOM 1918 C CB . VAL A 1 237 ? -1.045 7.726 7.875 1.00 93.29 237 A 1 ATOM 1919 C CG1 . VAL A 1 237 ? -1.029 8.819 6.813 1.00 87.65 237 A 1 ATOM 1920 C CG2 . VAL A 1 237 ? 0.305 7.771 8.591 1.00 89.06 237 A 1 ATOM 1921 O OXT . VAL A 1 237 ? -4.001 9.058 7.849 1.00 86.24 237 A 1 #