# 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_nma1821 # _entry.id nma1821 # 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 MET 2 1 n GLN 3 1 n LYS 4 1 n TYR 5 1 n HIS 6 1 n SER 7 1 n THR 8 1 n ALA 9 1 n PRO 10 1 n LEU 11 1 n PRO 12 1 n PHE 13 1 n VAL 14 1 n GLY 15 1 n GLN 16 1 n LYS 17 1 n ARG 18 1 n TYR 19 1 n PHE 20 1 n ILE 21 1 n LYS 22 1 n HIS 23 1 n PHE 24 1 n THR 25 1 n LYS 26 1 n VAL 27 1 n LEU 28 1 n SER 29 1 n GLN 30 1 n ILE 31 1 n PRO 32 1 n ALA 33 1 n ASP 34 1 n GLY 35 1 n LYS 36 1 n HIS 37 1 n TRP 38 1 n THR 39 1 n ILE 40 1 n VAL 41 1 n ASP 42 1 n VAL 43 1 n PHE 44 1 n GLY 45 1 n GLY 46 1 n SER 47 1 n GLY 48 1 n LEU 49 1 n LEU 50 1 n ALA 51 1 n HIS 52 1 n VAL 53 1 n ALA 54 1 n LYS 55 1 n ARG 56 1 n ILE 57 1 n LYS 58 1 n PRO 59 1 n GLN 60 1 n ALA 61 1 n ARG 62 1 n VAL 63 1 n ILE 64 1 n TYR 65 1 n ASN 66 1 n ASP 67 1 n TYR 68 1 n ASP 69 1 n ASN 70 1 n TYR 71 1 n SER 72 1 n ASP 73 1 n ARG 74 1 n LEU 75 1 n ARG 76 1 n HIS 77 1 n ILE 78 1 n PRO 79 1 n ASP 80 1 n TYR 81 1 n ASN 82 1 n ARG 83 1 n LEU 84 1 n ARG 85 1 n GLU 86 1 n GLN 87 1 n ILE 88 1 n ALA 89 1 n GLN 90 1 n ILE 91 1 n VAL 92 1 n GLY 93 1 n GLY 94 1 n ILE 95 1 n PRO 96 1 n LYS 97 1 n GLY 98 1 n SER 99 1 n ARG 100 1 n LEU 101 1 n ASP 102 1 n PRO 103 1 n GLU 104 1 n ARG 105 1 n THR 106 1 n ARG 107 1 n SER 108 1 n VAL 109 1 n GLN 110 1 n GLN 111 1 n THR 112 1 n ILE 113 1 n THR 114 1 n ASN 115 1 n PHE 116 1 n GLN 117 1 n GLY 118 1 n HIS 119 1 n ILE 120 1 n ASP 121 1 n VAL 122 1 n ARG 123 1 n VAL 124 1 n LEU 125 1 n SER 126 1 n SER 127 1 n TRP 128 1 n LEU 129 1 n LEU 130 1 n PHE 131 1 n SER 132 1 n ALA 133 1 n LYS 134 1 n GLN 135 1 n ALA 136 1 n ASN 137 1 n SER 138 1 n LEU 139 1 n GLU 140 1 n GLN 141 1 n LEU 142 1 n LEU 143 1 n GLY 144 1 n PHE 145 1 n GLU 146 1 n PHE 147 1 n TYR 148 1 n ASN 149 1 n LYS 150 1 n VAL 151 1 n ARG 152 1 n GLN 153 1 n SER 154 1 n PRO 155 1 n TYR 156 1 n SER 157 1 n ILE 158 1 n ALA 159 1 n ALA 160 1 n ASP 161 1 n TYR 162 1 n LEU 163 1 n ASP 164 1 n GLY 165 1 n LEU 166 1 n GLU 167 1 n ILE 168 1 n THR 169 1 n GLN 170 1 n GLN 171 1 n ASP 172 1 n TYR 173 1 n ASN 174 1 n LEU 175 1 n LEU 176 1 n MET 177 1 n ALA 178 1 n GLU 179 1 n HIS 180 1 n GLN 181 1 n HIS 182 1 n ASN 183 1 n PRO 184 1 n ASN 185 1 n THR 186 1 n LEU 187 1 n LEU 188 1 n VAL 189 1 n LEU 190 1 n ASP 191 1 n PRO 192 1 n PRO 193 1 n TYR 194 1 n VAL 195 1 n SER 196 1 n THR 197 1 n ALA 198 1 n GLN 199 1 n GLY 200 1 n ALA 201 1 n TYR 202 1 n ALA 203 1 n ALA 204 1 n ASP 205 1 n LYS 206 1 n TYR 207 1 n PHE 208 1 n ASN 209 1 n MET 210 1 n VAL 211 1 n SER 212 1 n PHE 213 1 n LEU 214 1 n ARG 215 1 n MET 216 1 n ILE 217 1 n GLN 218 1 n TYR 219 1 n MET 220 1 n ARG 221 1 n PRO 222 1 n PRO 223 1 n PHE 224 1 n ILE 225 1 n LEU 226 1 n PHE 227 1 n SER 228 1 n SER 229 1 n THR 230 1 n ARG 231 1 n SER 232 1 n GLU 233 1 n ALA 234 1 n LEU 235 1 n ASP 236 1 n TYR 237 1 n PHE 238 1 n GLN 239 1 n PHE 240 1 n LEU 241 1 n GLN 242 1 n GLU 243 1 n CYS 244 1 n GLU 245 1 n PRO 246 1 n ASP 247 1 n LYS 248 1 n TYR 249 1 n ARG 250 1 n ARG 251 1 n PHE 252 1 n SER 253 1 n GLY 254 1 n TYR 255 1 n ASN 256 1 n ILE 257 1 n VAL 258 1 n SER 259 1 n LEU 260 1 n ASP 261 1 n ALA 262 1 n LYS 263 1 n MET 264 1 n GLY 265 1 n LYS 266 1 n GLY 267 1 n ILE 268 1 n GLU 269 1 n TYR 270 1 n GLN 271 1 n ASP 272 1 n ASN 273 1 n MET 274 1 n ILE 275 1 n TYR 276 1 n LYS 277 1 n ILE 278 1 n ASP 279 # _ma_data.content_type "model coordinates" _ma_data.id 1 _ma_data.name Model # _ma_model_list.data_id 1 _ma_model_list.model_group_id 1 _ma_model_list.model_group_name "AlphaFold-beta-20231127 (3.0.1 @ 2025-04-07 01:07:53)" _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 90.64 _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 64.38 1 1 A MET 2 2 70.92 1 2 A GLN 3 2 80.79 1 3 A LYS 4 2 77.94 1 4 A TYR 5 2 94.06 1 5 A HIS 6 2 92.03 1 6 A SER 7 2 92.63 1 7 A THR 8 2 91.46 1 8 A ALA 9 2 94.28 1 9 A PRO 10 2 95.44 1 10 A LEU 11 2 95.11 1 11 A PRO 12 2 93.34 1 12 A PHE 13 2 89.78 1 13 A VAL 14 2 85.16 1 14 A GLY 15 2 87.06 1 15 A GLN 16 2 81.92 1 16 A LYS 17 2 89.80 1 17 A ARG 18 2 85.31 1 18 A TYR 19 2 89.76 1 19 A PHE 20 2 95.92 1 20 A ILE 21 2 95.61 1 21 A LYS 22 2 86.54 1 22 A HIS 23 2 95.23 1 23 A PHE 24 2 98.08 1 24 A THR 25 2 95.30 1 25 A LYS 26 2 88.58 1 26 A VAL 27 2 97.79 1 27 A LEU 28 2 97.89 1 28 A SER 29 2 95.22 1 29 A GLN 30 2 95.06 1 30 A ILE 31 2 97.50 1 31 A PRO 32 2 96.10 1 32 A ALA 33 2 91.32 1 33 A ASP 34 2 90.96 1 34 A GLY 35 2 97.44 1 35 A LYS 36 2 90.81 1 36 A HIS 37 2 93.03 1 37 A TRP 38 2 97.64 1 38 A THR 39 2 98.14 1 39 A ILE 40 2 98.54 1 40 A VAL 41 2 98.53 1 41 A ASP 42 2 98.14 1 42 A VAL 43 2 98.03 1 43 A PHE 44 2 96.09 1 44 A GLY 45 2 92.59 1 45 A GLY 46 2 95.15 1 46 A SER 47 2 96.66 1 47 A GLY 48 2 97.72 1 48 A LEU 49 2 97.26 1 49 A LEU 50 2 97.92 1 50 A ALA 51 2 98.51 1 51 A HIS 52 2 96.38 1 52 A VAL 53 2 97.86 1 53 A ALA 54 2 98.32 1 54 A LYS 55 2 97.02 1 55 A ARG 56 2 91.11 1 56 A ILE 57 2 95.70 1 57 A LYS 58 2 97.17 1 58 A PRO 59 2 97.29 1 59 A GLN 60 2 92.43 1 60 A ALA 61 2 98.32 1 61 A ARG 62 2 96.36 1 62 A VAL 63 2 98.56 1 63 A ILE 64 2 98.51 1 64 A TYR 65 2 98.04 1 65 A ASN 66 2 97.16 1 66 A ASP 67 2 96.13 1 67 A TYR 68 2 88.65 1 68 A ASP 69 2 87.90 1 69 A ASN 70 2 90.62 1 70 A TYR 71 2 96.33 1 71 A SER 72 2 95.83 1 72 A ASP 73 2 94.78 1 73 A ARG 74 2 91.14 1 74 A LEU 75 2 96.68 1 75 A ARG 76 2 83.59 1 76 A HIS 77 2 95.33 1 77 A ILE 78 2 97.46 1 78 A PRO 79 2 97.68 1 79 A ASP 80 2 97.62 1 80 A TYR 81 2 97.14 1 81 A ASN 82 2 96.95 1 82 A ARG 83 2 93.31 1 83 A LEU 84 2 98.24 1 84 A ARG 85 2 94.10 1 85 A GLU 86 2 89.05 1 86 A GLN 87 2 96.79 1 87 A ILE 88 2 98.11 1 88 A ALA 89 2 97.58 1 89 A GLN 90 2 91.22 1 90 A ILE 91 2 97.38 1 91 A VAL 92 2 95.61 1 92 A GLY 93 2 90.33 1 93 A GLY 94 2 93.17 1 94 A ILE 95 2 93.98 1 95 A PRO 96 2 96.49 1 96 A LYS 97 2 86.63 1 97 A GLY 98 2 95.69 1 98 A SER 99 2 95.35 1 99 A ARG 100 2 87.04 1 100 A LEU 101 2 97.12 1 101 A ASP 102 2 95.94 1 102 A PRO 103 2 97.13 1 103 A GLU 104 2 86.71 1 104 A ARG 105 2 89.85 1 105 A THR 106 2 97.36 1 106 A ARG 107 2 84.28 1 107 A SER 108 2 97.57 1 108 A VAL 109 2 98.23 1 109 A GLN 110 2 96.31 1 110 A GLN 111 2 90.47 1 111 A THR 112 2 98.07 1 112 A ILE 113 2 98.24 1 113 A THR 114 2 96.39 1 114 A ASN 115 2 96.17 1 115 A PHE 116 2 98.31 1 116 A GLN 117 2 91.18 1 117 A GLY 118 2 97.76 1 118 A HIS 119 2 91.97 1 119 A ILE 120 2 96.05 1 120 A ASP 121 2 96.05 1 121 A VAL 122 2 95.59 1 122 A ARG 123 2 82.70 1 123 A VAL 124 2 96.88 1 124 A LEU 125 2 97.42 1 125 A SER 126 2 95.98 1 126 A SER 127 2 95.72 1 127 A TRP 128 2 96.87 1 128 A LEU 129 2 97.48 1 129 A LEU 130 2 95.44 1 130 A PHE 131 2 74.69 1 131 A SER 132 2 71.42 1 132 A ALA 133 2 74.76 1 133 A LYS 134 2 80.09 1 134 A GLN 135 2 80.81 1 135 A ALA 136 2 91.01 1 136 A ASN 137 2 86.31 1 137 A SER 138 2 94.48 1 138 A LEU 139 2 96.21 1 139 A GLU 140 2 86.87 1 140 A GLN 141 2 91.49 1 141 A LEU 142 2 96.84 1 142 A LEU 143 2 97.10 1 143 A GLY 144 2 96.39 1 144 A PHE 145 2 95.00 1 145 A GLU 146 2 89.43 1 146 A PHE 147 2 97.38 1 147 A TYR 148 2 96.11 1 148 A ASN 149 2 96.28 1 149 A LYS 150 2 91.18 1 150 A VAL 151 2 95.97 1 151 A ARG 152 2 88.32 1 152 A GLN 153 2 86.02 1 153 A SER 154 2 94.61 1 154 A PRO 155 2 96.05 1 155 A TYR 156 2 96.04 1 156 A SER 157 2 91.50 1 157 A ILE 158 2 87.32 1 158 A ALA 159 2 90.04 1 159 A ALA 160 2 90.92 1 160 A ASP 161 2 92.37 1 161 A TYR 162 2 96.67 1 162 A LEU 163 2 96.25 1 163 A ASP 164 2 95.02 1 164 A GLY 165 2 97.70 1 165 A LEU 166 2 98.12 1 166 A GLU 167 2 95.17 1 167 A ILE 168 2 97.88 1 168 A THR 169 2 97.23 1 169 A GLN 170 2 91.16 1 170 A GLN 171 2 90.06 1 171 A ASP 172 2 93.79 1 172 A TYR 173 2 95.32 1 173 A ASN 174 2 89.48 1 174 A LEU 175 2 94.88 1 175 A LEU 176 2 97.69 1 176 A MET 177 2 96.96 1 177 A ALA 178 2 96.76 1 178 A GLU 179 2 91.60 1 179 A HIS 180 2 94.17 1 180 A GLN 181 2 86.11 1 181 A HIS 182 2 87.68 1 182 A ASN 183 2 91.78 1 183 A PRO 184 2 95.65 1 184 A ASN 185 2 93.61 1 185 A THR 186 2 97.63 1 186 A LEU 187 2 98.42 1 187 A LEU 188 2 97.84 1 188 A VAL 189 2 98.46 1 189 A LEU 190 2 97.71 1 190 A ASP 191 2 95.57 1 191 A PRO 192 2 95.36 1 192 A PRO 193 2 91.59 1 193 A TYR 194 2 76.52 1 194 A VAL 195 2 77.76 1 195 A SER 196 2 61.98 1 196 A THR 197 2 53.30 1 197 A ALA 198 2 49.19 1 198 A GLN 199 2 48.46 1 199 A GLY 200 2 50.97 1 200 A ALA 201 2 45.51 1 201 A TYR 202 2 37.52 1 202 A ALA 203 2 51.66 1 203 A ALA 204 2 52.00 1 204 A ASP 205 2 53.38 1 205 A LYS 206 2 56.03 1 206 A TYR 207 2 62.22 1 207 A PHE 208 2 88.68 1 208 A ASN 209 2 87.69 1 209 A MET 210 2 83.92 1 210 A VAL 211 2 91.30 1 211 A SER 212 2 92.77 1 212 A PHE 213 2 93.39 1 213 A LEU 214 2 94.10 1 214 A ARG 215 2 85.31 1 215 A MET 216 2 95.70 1 216 A ILE 217 2 94.21 1 217 A GLN 218 2 83.59 1 218 A TYR 219 2 91.62 1 219 A MET 220 2 93.69 1 220 A ARG 221 2 83.09 1 221 A PRO 222 2 96.34 1 222 A PRO 223 2 97.56 1 223 A PHE 224 2 97.87 1 224 A ILE 225 2 98.34 1 225 A LEU 226 2 97.47 1 226 A PHE 227 2 97.28 1 227 A SER 228 2 93.67 1 228 A SER 229 2 89.47 1 229 A THR 230 2 87.16 1 230 A ARG 231 2 74.63 1 231 A SER 232 2 82.81 1 232 A GLU 233 2 78.06 1 233 A ALA 234 2 92.64 1 234 A LEU 235 2 93.32 1 235 A ASP 236 2 91.40 1 236 A TYR 237 2 93.38 1 237 A PHE 238 2 94.14 1 238 A GLN 239 2 87.36 1 239 A PHE 240 2 94.63 1 240 A LEU 241 2 95.63 1 241 A GLN 242 2 92.78 1 242 A GLU 243 2 92.75 1 243 A CYS 244 2 96.24 1 244 A GLU 245 2 91.70 1 245 A PRO 246 2 96.51 1 246 A ASP 247 2 92.17 1 247 A LYS 248 2 89.80 1 248 A TYR 249 2 94.88 1 249 A ARG 250 2 80.86 1 250 A ARG 251 2 86.66 1 251 A PHE 252 2 94.06 1 252 A SER 253 2 94.29 1 253 A GLY 254 2 95.88 1 254 A TYR 255 2 95.07 1 255 A ASN 256 2 95.31 1 256 A ILE 257 2 94.03 1 257 A VAL 258 2 97.31 1 258 A SER 259 2 95.95 1 259 A LEU 260 2 94.17 1 260 A ASP 261 2 89.44 1 261 A ALA 262 2 87.45 1 262 A LYS 263 2 73.83 1 263 A MET 264 2 69.12 1 264 A GLY 265 2 73.44 1 265 A LYS 266 2 65.30 1 266 A GLY 267 2 78.98 1 267 A ILE 268 2 77.59 1 268 A GLU 269 2 78.77 1 269 A TYR 270 2 84.20 1 270 A GLN 271 2 86.69 1 271 A ASP 272 2 92.19 1 272 A ASN 273 2 94.63 1 273 A MET 274 2 96.94 1 274 A ILE 275 2 97.28 1 275 A TYR 276 2 98.10 1 276 A LYS 277 2 95.93 1 277 A ILE 278 2 94.34 1 278 A ASP 279 2 84.46 1 279 # _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 MET . 2 A 2 A 3 1 n GLN . 3 A 3 A 4 1 n LYS . 4 A 4 A 5 1 n TYR . 5 A 5 A 6 1 n HIS . 6 A 6 A 7 1 n SER . 7 A 7 A 8 1 n THR . 8 A 8 A 9 1 n ALA . 9 A 9 A 10 1 n PRO . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n PRO . 12 A 12 A 13 1 n PHE . 13 A 13 A 14 1 n VAL . 14 A 14 A 15 1 n GLY . 15 A 15 A 16 1 n GLN . 16 A 16 A 17 1 n LYS . 17 A 17 A 18 1 n ARG . 18 A 18 A 19 1 n TYR . 19 A 19 A 20 1 n PHE . 20 A 20 A 21 1 n ILE . 21 A 21 A 22 1 n LYS . 22 A 22 A 23 1 n HIS . 23 A 23 A 24 1 n PHE . 24 A 24 A 25 1 n THR . 25 A 25 A 26 1 n LYS . 26 A 26 A 27 1 n VAL . 27 A 27 A 28 1 n LEU . 28 A 28 A 29 1 n SER . 29 A 29 A 30 1 n GLN . 30 A 30 A 31 1 n ILE . 31 A 31 A 32 1 n PRO . 32 A 32 A 33 1 n ALA . 33 A 33 A 34 1 n ASP . 34 A 34 A 35 1 n GLY . 35 A 35 A 36 1 n LYS . 36 A 36 A 37 1 n HIS . 37 A 37 A 38 1 n TRP . 38 A 38 A 39 1 n THR . 39 A 39 A 40 1 n ILE . 40 A 40 A 41 1 n VAL . 41 A 41 A 42 1 n ASP . 42 A 42 A 43 1 n VAL . 43 A 43 A 44 1 n PHE . 44 A 44 A 45 1 n GLY . 45 A 45 A 46 1 n GLY . 46 A 46 A 47 1 n SER . 47 A 47 A 48 1 n GLY . 48 A 48 A 49 1 n LEU . 49 A 49 A 50 1 n LEU . 50 A 50 A 51 1 n ALA . 51 A 51 A 52 1 n HIS . 52 A 52 A 53 1 n VAL . 53 A 53 A 54 1 n ALA . 54 A 54 A 55 1 n LYS . 55 A 55 A 56 1 n ARG . 56 A 56 A 57 1 n ILE . 57 A 57 A 58 1 n LYS . 58 A 58 A 59 1 n PRO . 59 A 59 A 60 1 n GLN . 60 A 60 A 61 1 n ALA . 61 A 61 A 62 1 n ARG . 62 A 62 A 63 1 n VAL . 63 A 63 A 64 1 n ILE . 64 A 64 A 65 1 n TYR . 65 A 65 A 66 1 n ASN . 66 A 66 A 67 1 n ASP . 67 A 67 A 68 1 n TYR . 68 A 68 A 69 1 n ASP . 69 A 69 A 70 1 n ASN . 70 A 70 A 71 1 n TYR . 71 A 71 A 72 1 n SER . 72 A 72 A 73 1 n ASP . 73 A 73 A 74 1 n ARG . 74 A 74 A 75 1 n LEU . 75 A 75 A 76 1 n ARG . 76 A 76 A 77 1 n HIS . 77 A 77 A 78 1 n ILE . 78 A 78 A 79 1 n PRO . 79 A 79 A 80 1 n ASP . 80 A 80 A 81 1 n TYR . 81 A 81 A 82 1 n ASN . 82 A 82 A 83 1 n ARG . 83 A 83 A 84 1 n LEU . 84 A 84 A 85 1 n ARG . 85 A 85 A 86 1 n GLU . 86 A 86 A 87 1 n GLN . 87 A 87 A 88 1 n ILE . 88 A 88 A 89 1 n ALA . 89 A 89 A 90 1 n GLN . 90 A 90 A 91 1 n ILE . 91 A 91 A 92 1 n VAL . 92 A 92 A 93 1 n GLY . 93 A 93 A 94 1 n GLY . 94 A 94 A 95 1 n ILE . 95 A 95 A 96 1 n PRO . 96 A 96 A 97 1 n LYS . 97 A 97 A 98 1 n GLY . 98 A 98 A 99 1 n SER . 99 A 99 A 100 1 n ARG . 100 A 100 A 101 1 n LEU . 101 A 101 A 102 1 n ASP . 102 A 102 A 103 1 n PRO . 103 A 103 A 104 1 n GLU . 104 A 104 A 105 1 n ARG . 105 A 105 A 106 1 n THR . 106 A 106 A 107 1 n ARG . 107 A 107 A 108 1 n SER . 108 A 108 A 109 1 n VAL . 109 A 109 A 110 1 n GLN . 110 A 110 A 111 1 n GLN . 111 A 111 A 112 1 n THR . 112 A 112 A 113 1 n ILE . 113 A 113 A 114 1 n THR . 114 A 114 A 115 1 n ASN . 115 A 115 A 116 1 n PHE . 116 A 116 A 117 1 n GLN . 117 A 117 A 118 1 n GLY . 118 A 118 A 119 1 n HIS . 119 A 119 A 120 1 n ILE . 120 A 120 A 121 1 n ASP . 121 A 121 A 122 1 n VAL . 122 A 122 A 123 1 n ARG . 123 A 123 A 124 1 n VAL . 124 A 124 A 125 1 n LEU . 125 A 125 A 126 1 n SER . 126 A 126 A 127 1 n SER . 127 A 127 A 128 1 n TRP . 128 A 128 A 129 1 n LEU . 129 A 129 A 130 1 n LEU . 130 A 130 A 131 1 n PHE . 131 A 131 A 132 1 n SER . 132 A 132 A 133 1 n ALA . 133 A 133 A 134 1 n LYS . 134 A 134 A 135 1 n GLN . 135 A 135 A 136 1 n ALA . 136 A 136 A 137 1 n ASN . 137 A 137 A 138 1 n SER . 138 A 138 A 139 1 n LEU . 139 A 139 A 140 1 n GLU . 140 A 140 A 141 1 n GLN . 141 A 141 A 142 1 n LEU . 142 A 142 A 143 1 n LEU . 143 A 143 A 144 1 n GLY . 144 A 144 A 145 1 n PHE . 145 A 145 A 146 1 n GLU . 146 A 146 A 147 1 n PHE . 147 A 147 A 148 1 n TYR . 148 A 148 A 149 1 n ASN . 149 A 149 A 150 1 n LYS . 150 A 150 A 151 1 n VAL . 151 A 151 A 152 1 n ARG . 152 A 152 A 153 1 n GLN . 153 A 153 A 154 1 n SER . 154 A 154 A 155 1 n PRO . 155 A 155 A 156 1 n TYR . 156 A 156 A 157 1 n SER . 157 A 157 A 158 1 n ILE . 158 A 158 A 159 1 n ALA . 159 A 159 A 160 1 n ALA . 160 A 160 A 161 1 n ASP . 161 A 161 A 162 1 n TYR . 162 A 162 A 163 1 n LEU . 163 A 163 A 164 1 n ASP . 164 A 164 A 165 1 n GLY . 165 A 165 A 166 1 n LEU . 166 A 166 A 167 1 n GLU . 167 A 167 A 168 1 n ILE . 168 A 168 A 169 1 n THR . 169 A 169 A 170 1 n GLN . 170 A 170 A 171 1 n GLN . 171 A 171 A 172 1 n ASP . 172 A 172 A 173 1 n TYR . 173 A 173 A 174 1 n ASN . 174 A 174 A 175 1 n LEU . 175 A 175 A 176 1 n LEU . 176 A 176 A 177 1 n MET . 177 A 177 A 178 1 n ALA . 178 A 178 A 179 1 n GLU . 179 A 179 A 180 1 n HIS . 180 A 180 A 181 1 n GLN . 181 A 181 A 182 1 n HIS . 182 A 182 A 183 1 n ASN . 183 A 183 A 184 1 n PRO . 184 A 184 A 185 1 n ASN . 185 A 185 A 186 1 n THR . 186 A 186 A 187 1 n LEU . 187 A 187 A 188 1 n LEU . 188 A 188 A 189 1 n VAL . 189 A 189 A 190 1 n LEU . 190 A 190 A 191 1 n ASP . 191 A 191 A 192 1 n PRO . 192 A 192 A 193 1 n PRO . 193 A 193 A 194 1 n TYR . 194 A 194 A 195 1 n VAL . 195 A 195 A 196 1 n SER . 196 A 196 A 197 1 n THR . 197 A 197 A 198 1 n ALA . 198 A 198 A 199 1 n GLN . 199 A 199 A 200 1 n GLY . 200 A 200 A 201 1 n ALA . 201 A 201 A 202 1 n TYR . 202 A 202 A 203 1 n ALA . 203 A 203 A 204 1 n ALA . 204 A 204 A 205 1 n ASP . 205 A 205 A 206 1 n LYS . 206 A 206 A 207 1 n TYR . 207 A 207 A 208 1 n PHE . 208 A 208 A 209 1 n ASN . 209 A 209 A 210 1 n MET . 210 A 210 A 211 1 n VAL . 211 A 211 A 212 1 n SER . 212 A 212 A 213 1 n PHE . 213 A 213 A 214 1 n LEU . 214 A 214 A 215 1 n ARG . 215 A 215 A 216 1 n MET . 216 A 216 A 217 1 n ILE . 217 A 217 A 218 1 n GLN . 218 A 218 A 219 1 n TYR . 219 A 219 A 220 1 n MET . 220 A 220 A 221 1 n ARG . 221 A 221 A 222 1 n PRO . 222 A 222 A 223 1 n PRO . 223 A 223 A 224 1 n PHE . 224 A 224 A 225 1 n ILE . 225 A 225 A 226 1 n LEU . 226 A 226 A 227 1 n PHE . 227 A 227 A 228 1 n SER . 228 A 228 A 229 1 n SER . 229 A 229 A 230 1 n THR . 230 A 230 A 231 1 n ARG . 231 A 231 A 232 1 n SER . 232 A 232 A 233 1 n GLU . 233 A 233 A 234 1 n ALA . 234 A 234 A 235 1 n LEU . 235 A 235 A 236 1 n ASP . 236 A 236 A 237 1 n TYR . 237 A 237 A 238 1 n PHE . 238 A 238 A 239 1 n GLN . 239 A 239 A 240 1 n PHE . 240 A 240 A 241 1 n LEU . 241 A 241 A 242 1 n GLN . 242 A 242 A 243 1 n GLU . 243 A 243 A 244 1 n CYS . 244 A 244 A 245 1 n GLU . 245 A 245 A 246 1 n PRO . 246 A 246 A 247 1 n ASP . 247 A 247 A 248 1 n LYS . 248 A 248 A 249 1 n TYR . 249 A 249 A 250 1 n ARG . 250 A 250 A 251 1 n ARG . 251 A 251 A 252 1 n PHE . 252 A 252 A 253 1 n SER . 253 A 253 A 254 1 n GLY . 254 A 254 A 255 1 n TYR . 255 A 255 A 256 1 n ASN . 256 A 256 A 257 1 n ILE . 257 A 257 A 258 1 n VAL . 258 A 258 A 259 1 n SER . 259 A 259 A 260 1 n LEU . 260 A 260 A 261 1 n ASP . 261 A 261 A 262 1 n ALA . 262 A 262 A 263 1 n LYS . 263 A 263 A 264 1 n MET . 264 A 264 A 265 1 n GLY . 265 A 265 A 266 1 n LYS . 266 A 266 A 267 1 n GLY . 267 A 267 A 268 1 n ILE . 268 A 268 A 269 1 n GLU . 269 A 269 A 270 1 n TYR . 270 A 270 A 271 1 n GLN . 271 A 271 A 272 1 n ASP . 272 A 272 A 273 1 n ASN . 273 A 273 A 274 1 n MET . 274 A 274 A 275 1 n ILE . 275 A 275 A 276 1 n TYR . 276 A 276 A 277 1 n LYS . 277 A 277 A 278 1 n ILE . 278 A 278 A 279 1 n ASP . 279 A 279 # _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 ? -26.409 3.485 0.597 1.00 61.87 1 A 1 ATOM 2 C CA . MET A 1 1 ? -25.994 3.210 -0.800 1.00 73.27 1 A 1 ATOM 3 C C . MET A 1 1 ? -24.478 3.105 -0.852 1.00 77.81 1 A 1 ATOM 4 O O . MET A 1 1 ? -23.811 3.884 -0.183 1.00 74.24 1 A 1 ATOM 5 C CB . MET A 1 1 ? -26.449 4.310 -1.773 1.00 67.23 1 A 1 ATOM 6 C CG . MET A 1 1 ? -27.950 4.274 -2.054 1.00 59.37 1 A 1 ATOM 7 S SD . MET A 1 1 ? -28.418 5.491 -3.318 1.00 55.43 1 A 1 ATOM 8 C CE . MET A 1 1 ? -30.214 5.526 -3.084 1.00 45.84 1 A 1 ATOM 9 N N . MET A 1 2 ? -23.935 2.163 -1.615 1.00 71.28 2 A 1 ATOM 10 C CA . MET A 1 2 ? -22.488 2.021 -1.805 1.00 76.70 2 A 1 ATOM 11 C C . MET A 1 2 ? -21.966 3.228 -2.596 1.00 79.93 2 A 1 ATOM 12 O O . MET A 1 2 ? -22.466 3.508 -3.687 1.00 77.07 2 A 1 ATOM 13 C CB . MET A 1 2 ? -22.219 0.686 -2.516 1.00 73.15 2 A 1 ATOM 14 C CG . MET A 1 2 ? -20.742 0.308 -2.565 1.00 67.37 2 A 1 ATOM 15 S SD . MET A 1 2 ? -20.415 -1.267 -3.418 1.00 64.87 2 A 1 ATOM 16 C CE . MET A 1 2 ? -21.259 -2.450 -2.326 1.00 57.01 2 A 1 ATOM 17 N N . GLN A 1 3 ? -21.002 3.956 -2.047 1.00 84.88 3 A 1 ATOM 18 C CA . GLN A 1 3 ? -20.393 5.097 -2.728 1.00 87.97 3 A 1 ATOM 19 C C . GLN A 1 3 ? -19.395 4.611 -3.787 1.00 89.92 3 A 1 ATOM 20 O O . GLN A 1 3 ? -18.747 3.577 -3.631 1.00 88.52 3 A 1 ATOM 21 C CB . GLN A 1 3 ? -19.726 6.042 -1.718 1.00 85.89 3 A 1 ATOM 22 C CG . GLN A 1 3 ? -20.729 6.718 -0.766 1.00 80.07 3 A 1 ATOM 23 C CD . GLN A 1 3 ? -20.066 7.697 0.204 1.00 75.91 3 A 1 ATOM 24 O OE1 . GLN A 1 3 ? -18.868 7.924 0.195 1.00 68.14 3 A 1 ATOM 25 N NE2 . GLN A 1 3 ? -20.816 8.321 1.081 1.00 65.79 3 A 1 ATOM 26 N N . LYS A 1 4 ? -19.247 5.374 -4.878 1.00 88.67 4 A 1 ATOM 27 C CA . LYS A 1 4 ? -18.224 5.099 -5.894 1.00 90.32 4 A 1 ATOM 28 C C . LYS A 1 4 ? -16.834 5.297 -5.283 1.00 92.64 4 A 1 ATOM 29 O O . LYS A 1 4 ? -16.607 6.267 -4.568 1.00 90.42 4 A 1 ATOM 30 C CB . LYS A 1 4 ? -18.474 6.001 -7.114 1.00 85.89 4 A 1 ATOM 31 C CG . LYS A 1 4 ? -17.594 5.635 -8.317 1.00 74.18 4 A 1 ATOM 32 C CD . LYS A 1 4 ? -17.934 6.537 -9.511 1.00 68.95 4 A 1 ATOM 33 C CE . LYS A 1 4 ? -17.067 6.198 -10.723 1.00 59.99 4 A 1 ATOM 34 N NZ . LYS A 1 4 ? -17.360 7.107 -11.862 1.00 50.37 4 A 1 ATOM 35 N N . TYR A 1 5 ? -15.903 4.388 -5.582 1.00 93.85 5 A 1 ATOM 36 C CA . TYR A 1 5 ? -14.525 4.452 -5.097 1.00 94.47 5 A 1 ATOM 37 C C . TYR A 1 5 ? -13.514 4.370 -6.247 1.00 94.86 5 A 1 ATOM 38 O O . TYR A 1 5 ? -13.800 3.838 -7.321 1.00 92.77 5 A 1 ATOM 39 C CB . TYR A 1 5 ? -14.289 3.359 -4.038 1.00 93.77 5 A 1 ATOM 40 C CG . TYR A 1 5 ? -14.536 1.931 -4.492 1.00 95.36 5 A 1 ATOM 41 C CD1 . TYR A 1 5 ? -15.733 1.279 -4.130 1.00 93.86 5 A 1 ATOM 42 C CD2 . TYR A 1 5 ? -13.580 1.248 -5.266 1.00 94.45 5 A 1 ATOM 43 C CE1 . TYR A 1 5 ? -15.975 -0.042 -4.551 1.00 93.77 5 A 1 ATOM 44 C CE2 . TYR A 1 5 ? -13.822 -0.070 -5.695 1.00 94.27 5 A 1 ATOM 45 C CZ . TYR A 1 5 ? -15.022 -0.717 -5.340 1.00 94.52 5 A 1 ATOM 46 O OH . TYR A 1 5 ? -15.258 -1.986 -5.763 1.00 92.73 5 A 1 ATOM 47 N N . HIS A 1 6 ? -12.306 4.876 -6.004 1.00 94.87 6 A 1 ATOM 48 C CA . HIS A 1 6 ? -11.158 4.691 -6.888 1.00 94.93 6 A 1 ATOM 49 C C . HIS A 1 6 ? -10.651 3.248 -6.757 1.00 95.41 6 A 1 ATOM 50 O O . HIS A 1 6 ? -10.369 2.772 -5.662 1.00 94.48 6 A 1 ATOM 51 C CB . HIS A 1 6 ? -10.058 5.706 -6.543 1.00 94.54 6 A 1 ATOM 52 C CG . HIS A 1 6 ? -10.437 7.139 -6.839 1.00 94.76 6 A 1 ATOM 53 N ND1 . HIS A 1 6 ? -10.027 7.871 -7.942 1.00 85.61 6 A 1 ATOM 54 C CD2 . HIS A 1 6 ? -11.235 7.939 -6.076 1.00 87.11 6 A 1 ATOM 55 C CE1 . HIS A 1 6 ? -10.577 9.085 -7.833 1.00 88.49 6 A 1 ATOM 56 N NE2 . HIS A 1 6 ? -11.321 9.164 -6.719 1.00 90.12 6 A 1 ATOM 57 N N . SER A 1 7 ? -10.508 2.541 -7.876 1.00 93.82 7 A 1 ATOM 58 C CA . SER A 1 7 ? -9.980 1.164 -7.901 1.00 93.59 7 A 1 ATOM 59 C C . SER A 1 7 ? -8.452 1.090 -8.004 1.00 94.58 7 A 1 ATOM 60 O O . SER A 1 7 ? -7.866 0.011 -7.922 1.00 92.70 7 A 1 ATOM 61 C CB . SER A 1 7 ? -10.630 0.394 -9.053 1.00 92.17 7 A 1 ATOM 62 O OG . SER A 1 7 ? -10.385 1.043 -10.286 1.00 88.91 7 A 1 ATOM 63 N N . THR A 1 8 ? -7.803 2.228 -8.217 1.00 94.21 8 A 1 ATOM 64 C CA . THR A 1 8 ? -6.349 2.386 -8.301 1.00 94.53 8 A 1 ATOM 65 C C . THR A 1 8 ? -5.952 3.695 -7.633 1.00 95.25 8 A 1 ATOM 66 O O . THR A 1 8 ? -6.713 4.660 -7.701 1.00 93.93 8 A 1 ATOM 67 C CB . THR A 1 8 ? -5.851 2.417 -9.755 1.00 93.15 8 A 1 ATOM 68 O OG1 . THR A 1 8 ? -6.464 3.466 -10.477 1.00 84.67 8 A 1 ATOM 69 C CG2 . THR A 1 8 ? -6.131 1.128 -10.519 1.00 84.51 8 A 1 ATOM 70 N N . ALA A 1 9 ? -4.751 3.748 -7.065 1.00 94.39 9 A 1 ATOM 71 C CA . ALA A 1 9 ? -4.195 4.983 -6.528 1.00 94.28 9 A 1 ATOM 72 C C . ALA A 1 9 ? -4.058 6.062 -7.625 1.00 95.01 9 A 1 ATOM 73 O O . ALA A 1 9 ? -3.676 5.729 -8.753 1.00 94.38 9 A 1 ATOM 74 C CB . ALA A 1 9 ? -2.849 4.661 -5.874 1.00 93.35 9 A 1 ATOM 75 N N . PRO A 1 10 ? -4.330 7.350 -7.326 1.00 96.04 10 A 1 ATOM 76 C CA . PRO A 1 10 ? -4.255 8.441 -8.303 1.00 95.57 10 A 1 ATOM 77 C C . PRO A 1 10 ? -2.858 8.658 -8.897 1.00 95.87 10 A 1 ATOM 78 O O . PRO A 1 10 ? -2.726 8.980 -10.077 1.00 94.95 10 A 1 ATOM 79 C CB . PRO A 1 10 ? -4.726 9.689 -7.552 1.00 94.97 10 A 1 ATOM 80 C CG . PRO A 1 10 ? -5.648 9.135 -6.474 1.00 94.50 10 A 1 ATOM 81 C CD . PRO A 1 10 ? -4.970 7.822 -6.100 1.00 96.19 10 A 1 ATOM 82 N N . LEU A 1 11 ? -1.815 8.465 -8.095 1.00 95.69 11 A 1 ATOM 83 C CA . LEU A 1 11 ? -0.407 8.573 -8.488 1.00 95.45 11 A 1 ATOM 84 C C . LEU A 1 11 ? 0.294 7.208 -8.429 1.00 95.11 11 A 1 ATOM 85 O O . LEU A 1 11 ? -0.124 6.330 -7.668 1.00 94.47 11 A 1 ATOM 86 C CB . LEU A 1 11 ? 0.308 9.584 -7.579 1.00 95.55 11 A 1 ATOM 87 C CG . LEU A 1 11 ? -0.148 11.038 -7.745 1.00 95.57 11 A 1 ATOM 88 C CD1 . LEU A 1 11 ? 0.556 11.891 -6.691 1.00 94.24 11 A 1 ATOM 89 C CD2 . LEU A 1 11 ? 0.195 11.593 -9.131 1.00 94.77 11 A 1 ATOM 90 N N . PRO A 1 12 ? 1.395 7.022 -9.182 1.00 95.00 12 A 1 ATOM 91 C CA . PRO A 1 12 ? 2.193 5.803 -9.129 1.00 93.94 12 A 1 ATOM 92 C C . PRO A 1 12 ? 2.620 5.461 -7.696 1.00 94.09 12 A 1 ATOM 93 O O . PRO A 1 12 ? 3.236 6.274 -7.000 1.00 92.82 12 A 1 ATOM 94 C CB . PRO A 1 12 ? 3.402 6.048 -10.034 1.00 92.54 12 A 1 ATOM 95 C CG . PRO A 1 12 ? 2.899 7.095 -11.020 1.00 91.03 12 A 1 ATOM 96 C CD . PRO A 1 12 ? 1.956 7.937 -10.174 1.00 93.97 12 A 1 ATOM 97 N N . PHE A 1 13 ? 2.319 4.233 -7.289 1.00 92.37 13 A 1 ATOM 98 C CA . PHE A 1 13 ? 2.724 3.670 -6.009 1.00 91.43 13 A 1 ATOM 99 C C . PHE A 1 13 ? 3.039 2.178 -6.179 1.00 89.97 13 A 1 ATOM 100 O O . PHE A 1 13 ? 2.233 1.413 -6.717 1.00 87.16 13 A 1 ATOM 101 C CB . PHE A 1 13 ? 1.631 3.915 -4.962 1.00 91.19 13 A 1 ATOM 102 C CG . PHE A 1 13 ? 2.100 3.630 -3.552 1.00 91.01 13 A 1 ATOM 103 C CD1 . PHE A 1 13 ? 2.036 2.327 -3.026 1.00 89.63 13 A 1 ATOM 104 C CD2 . PHE A 1 13 ? 2.653 4.669 -2.778 1.00 89.94 13 A 1 ATOM 105 C CE1 . PHE A 1 13 ? 2.533 2.059 -1.736 1.00 88.04 13 A 1 ATOM 106 C CE2 . PHE A 1 13 ? 3.145 4.401 -1.486 1.00 88.26 13 A 1 ATOM 107 C CZ . PHE A 1 13 ? 3.090 3.097 -0.967 1.00 88.62 13 A 1 ATOM 108 N N . VAL A 1 14 ? 4.231 1.771 -5.764 1.00 89.46 14 A 1 ATOM 109 C CA . VAL A 1 14 ? 4.679 0.371 -5.826 1.00 87.66 14 A 1 ATOM 110 C C . VAL A 1 14 ? 4.022 -0.411 -4.696 1.00 87.47 14 A 1 ATOM 111 O O . VAL A 1 14 ? 3.998 0.056 -3.567 1.00 83.51 14 A 1 ATOM 112 C CB . VAL A 1 14 ? 6.215 0.273 -5.761 1.00 85.18 14 A 1 ATOM 113 C CG1 . VAL A 1 14 ? 6.695 -1.183 -5.840 1.00 80.83 14 A 1 ATOM 114 C CG2 . VAL A 1 14 ? 6.840 1.037 -6.935 1.00 82.02 14 A 1 ATOM 115 N N . GLY A 1 15 ? 3.471 -1.587 -5.012 1.00 87.07 15 A 1 ATOM 116 C CA . GLY A 1 15 ? 2.816 -2.423 -3.999 1.00 87.15 15 A 1 ATOM 117 C C . GLY A 1 15 ? 1.350 -2.072 -3.710 1.00 88.72 15 A 1 ATOM 118 O O . GLY A 1 15 ? 0.735 -2.708 -2.866 1.00 85.31 15 A 1 ATOM 119 N N . GLN A 1 16 ? 0.740 -1.134 -4.442 1.00 87.72 16 A 1 ATOM 120 C CA . GLN A 1 16 ? -0.693 -0.843 -4.264 1.00 87.89 16 A 1 ATOM 121 C C . GLN A 1 16 ? -1.563 -2.104 -4.460 1.00 89.87 16 A 1 ATOM 122 O O . GLN A 1 16 ? -1.447 -2.819 -5.467 1.00 86.81 16 A 1 ATOM 123 C CB . GLN A 1 16 ? -1.145 0.302 -5.193 1.00 83.49 16 A 1 ATOM 124 C CG . GLN A 1 16 ? -1.224 -0.083 -6.679 1.00 80.12 16 A 1 ATOM 125 C CD . GLN A 1 16 ? -1.693 1.073 -7.553 1.00 78.96 16 A 1 ATOM 126 O OE1 . GLN A 1 16 ? -2.875 1.314 -7.729 1.00 73.06 16 A 1 ATOM 127 N NE2 . GLN A 1 16 ? -0.793 1.823 -8.136 1.00 69.34 16 A 1 ATOM 128 N N . LYS A 1 17 ? -2.502 -2.360 -3.540 1.00 91.81 17 A 1 ATOM 129 C CA . LYS A 1 17 ? -3.329 -3.583 -3.521 1.00 93.38 17 A 1 ATOM 130 C C . LYS A 1 17 ? -4.553 -3.547 -4.460 1.00 94.71 17 A 1 ATOM 131 O O . LYS A 1 17 ? -5.598 -4.119 -4.170 1.00 92.44 17 A 1 ATOM 132 C CB . LYS A 1 17 ? -3.662 -3.936 -2.061 1.00 91.05 17 A 1 ATOM 133 C CG . LYS A 1 17 ? -2.408 -4.266 -1.218 1.00 90.12 17 A 1 ATOM 134 C CD . LYS A 1 17 ? -1.628 -5.491 -1.757 1.00 87.42 17 A 1 ATOM 135 C CE . LYS A 1 17 ? -0.471 -5.920 -0.856 1.00 86.36 17 A 1 ATOM 136 N NZ . LYS A 1 17 ? 0.711 -5.065 -0.944 1.00 80.94 17 A 1 ATOM 137 N N . ARG A 1 18 ? -4.415 -2.919 -5.634 1.00 93.37 18 A 1 ATOM 138 C CA . ARG A 1 18 ? -5.520 -2.734 -6.600 1.00 93.60 18 A 1 ATOM 139 C C . ARG A 1 18 ? -6.191 -4.037 -7.051 1.00 94.73 18 A 1 ATOM 140 O O . ARG A 1 18 ? -7.387 -4.038 -7.301 1.00 93.16 18 A 1 ATOM 141 C CB . ARG A 1 18 ? -5.034 -1.913 -7.806 1.00 91.68 18 A 1 ATOM 142 C CG . ARG A 1 18 ? -4.024 -2.669 -8.687 1.00 90.22 18 A 1 ATOM 143 C CD . ARG A 1 18 ? -3.531 -1.790 -9.836 1.00 87.67 18 A 1 ATOM 144 N NE . ARG A 1 18 ? -2.590 -2.545 -10.681 1.00 81.06 18 A 1 ATOM 145 C CZ . ARG A 1 18 ? -1.854 -2.059 -11.664 1.00 75.36 18 A 1 ATOM 146 N NH1 . ARG A 1 18 ? -1.902 -0.804 -12.003 1.00 68.28 18 A 1 ATOM 147 N NH2 . ARG A 1 18 ? -1.049 -2.844 -12.324 1.00 69.27 18 A 1 ATOM 148 N N . TYR A 1 19 ? -5.448 -5.141 -7.153 1.00 93.56 19 A 1 ATOM 149 C CA . TYR A 1 19 ? -5.999 -6.437 -7.568 1.00 93.63 19 A 1 ATOM 150 C C . TYR A 1 19 ? -6.821 -7.113 -6.464 1.00 95.26 19 A 1 ATOM 151 O O . TYR A 1 19 ? -7.721 -7.892 -6.763 1.00 94.70 19 A 1 ATOM 152 C CB . TYR A 1 19 ? -4.861 -7.332 -8.065 1.00 92.96 19 A 1 ATOM 153 C CG . TYR A 1 19 ? -4.123 -6.777 -9.274 1.00 92.04 19 A 1 ATOM 154 C CD1 . TYR A 1 19 ? -4.814 -6.572 -10.488 1.00 87.46 19 A 1 ATOM 155 C CD2 . TYR A 1 19 ? -2.748 -6.476 -9.195 1.00 87.36 19 A 1 ATOM 156 C CE1 . TYR A 1 19 ? -4.131 -6.076 -11.616 1.00 85.06 19 A 1 ATOM 157 C CE2 . TYR A 1 19 ? -2.064 -5.984 -10.325 1.00 84.95 19 A 1 ATOM 158 C CZ . TYR A 1 19 ? -2.755 -5.788 -11.538 1.00 85.87 19 A 1 ATOM 159 O OH . TYR A 1 19 ? -2.093 -5.327 -12.634 1.00 84.25 19 A 1 ATOM 160 N N . PHE A 1 20 ? -6.576 -6.746 -5.214 1.00 95.93 20 A 1 ATOM 161 C CA . PHE A 1 20 ? -7.327 -7.249 -4.065 1.00 96.57 20 A 1 ATOM 162 C C . PHE A 1 20 ? -8.591 -6.451 -3.743 1.00 97.30 20 A 1 ATOM 163 O O . PHE A 1 20 ? -9.384 -6.921 -2.936 1.00 97.05 20 A 1 ATOM 164 C CB . PHE A 1 20 ? -6.405 -7.329 -2.848 1.00 96.37 20 A 1 ATOM 165 C CG . PHE A 1 20 ? -5.477 -8.522 -2.904 1.00 96.50 20 A 1 ATOM 166 C CD1 . PHE A 1 20 ? -5.965 -9.793 -2.544 1.00 95.24 20 A 1 ATOM 167 C CD2 . PHE A 1 20 ? -4.140 -8.366 -3.297 1.00 95.55 20 A 1 ATOM 168 C CE1 . PHE A 1 20 ? -5.110 -10.904 -2.565 1.00 94.70 20 A 1 ATOM 169 C CE2 . PHE A 1 20 ? -3.287 -9.482 -3.321 1.00 94.68 20 A 1 ATOM 170 C CZ . PHE A 1 20 ? -3.769 -10.749 -2.950 1.00 95.20 20 A 1 ATOM 171 N N . ILE A 1 21 ? -8.839 -5.293 -4.359 1.00 97.25 21 A 1 ATOM 172 C CA . ILE A 1 21 ? -9.960 -4.413 -3.981 1.00 97.39 21 A 1 ATOM 173 C C . ILE A 1 21 ? -11.311 -5.151 -3.983 1.00 97.50 21 A 1 ATOM 174 O O . ILE A 1 21 ? -12.087 -5.022 -3.038 1.00 97.33 21 A 1 ATOM 175 C CB . ILE A 1 21 ? -9.994 -3.150 -4.872 1.00 97.00 21 A 1 ATOM 176 C CG1 . ILE A 1 21 ? -8.742 -2.263 -4.691 1.00 94.85 21 A 1 ATOM 177 C CG2 . ILE A 1 21 ? -11.263 -2.311 -4.631 1.00 95.40 21 A 1 ATOM 178 C CD1 . ILE A 1 21 ? -8.427 -1.824 -3.262 1.00 88.16 21 A 1 ATOM 179 N N . LYS A 1 22 ? -11.572 -5.994 -4.990 1.00 97.20 22 A 1 ATOM 180 C CA . LYS A 1 22 ? -12.806 -6.801 -5.049 1.00 96.89 22 A 1 ATOM 181 C C . LYS A 1 22 ? -12.930 -7.786 -3.878 1.00 97.50 22 A 1 ATOM 182 O O . LYS A 1 22 ? -14.040 -8.066 -3.427 1.00 97.14 22 A 1 ATOM 183 C CB . LYS A 1 22 ? -12.859 -7.532 -6.401 1.00 95.94 22 A 1 ATOM 184 C CG . LYS A 1 22 ? -14.168 -8.319 -6.601 1.00 83.63 22 A 1 ATOM 185 C CD . LYS A 1 22 ? -14.193 -9.018 -7.966 1.00 79.69 22 A 1 ATOM 186 C CE . LYS A 1 22 ? -15.498 -9.803 -8.153 1.00 69.91 22 A 1 ATOM 187 N NZ . LYS A 1 22 ? -15.540 -10.504 -9.463 1.00 60.97 22 A 1 ATOM 188 N N . HIS A 1 23 ? -11.822 -8.353 -3.421 1.00 97.44 23 A 1 ATOM 189 C CA . HIS A 1 23 ? -11.805 -9.282 -2.287 1.00 97.76 23 A 1 ATOM 190 C C . HIS A 1 23 ? -11.890 -8.515 -0.966 1.00 98.06 23 A 1 ATOM 191 O O . HIS A 1 23 ? -12.708 -8.859 -0.116 1.00 97.82 23 A 1 ATOM 192 C CB . HIS A 1 23 ? -10.562 -10.179 -2.371 1.00 97.71 23 A 1 ATOM 193 C CG . HIS A 1 23 ? -10.561 -11.020 -3.623 1.00 97.30 23 A 1 ATOM 194 N ND1 . HIS A 1 23 ? -11.185 -12.234 -3.794 1.00 90.56 23 A 1 ATOM 195 C CD2 . HIS A 1 23 ? -9.982 -10.704 -4.822 1.00 91.15 23 A 1 ATOM 196 C CE1 . HIS A 1 23 ? -10.961 -12.646 -5.053 1.00 91.59 23 A 1 ATOM 197 N NE2 . HIS A 1 23 ? -10.254 -11.730 -5.722 1.00 92.92 23 A 1 ATOM 198 N N . PHE A 1 24 ? -11.153 -7.417 -0.859 1.00 98.09 24 A 1 ATOM 199 C CA . PHE A 1 24 ? -11.184 -6.512 0.285 1.00 98.12 24 A 1 ATOM 200 C C . PHE A 1 24 ? -12.599 -5.973 0.563 1.00 98.18 24 A 1 ATOM 201 O O . PHE A 1 24 ? -13.074 -6.048 1.692 1.00 98.02 24 A 1 ATOM 202 C CB . PHE A 1 24 ? -10.180 -5.383 0.009 1.00 98.14 24 A 1 ATOM 203 C CG . PHE A 1 24 ? -10.060 -4.374 1.128 1.00 98.39 24 A 1 ATOM 204 C CD1 . PHE A 1 24 ? -10.428 -3.029 0.919 1.00 97.95 24 A 1 ATOM 205 C CD2 . PHE A 1 24 ? -9.555 -4.773 2.374 1.00 98.02 24 A 1 ATOM 206 C CE1 . PHE A 1 24 ? -10.278 -2.091 1.952 1.00 97.84 24 A 1 ATOM 207 C CE2 . PHE A 1 24 ? -9.410 -3.833 3.409 1.00 97.78 24 A 1 ATOM 208 C CZ . PHE A 1 24 ? -9.766 -2.492 3.200 1.00 98.31 24 A 1 ATOM 209 N N . THR A 1 25 ? -13.332 -5.535 -0.468 1.00 97.86 25 A 1 ATOM 210 C CA . THR A 1 25 ? -14.722 -5.069 -0.301 1.00 97.65 25 A 1 ATOM 211 C C . THR A 1 25 ? -15.669 -6.171 0.182 1.00 97.65 25 A 1 ATOM 212 O O . THR A 1 25 ? -16.577 -5.889 0.965 1.00 97.18 25 A 1 ATOM 213 C CB . THR A 1 25 ? -15.294 -4.463 -1.592 1.00 97.05 25 A 1 ATOM 214 O OG1 . THR A 1 25 ? -15.195 -5.358 -2.677 1.00 90.59 25 A 1 ATOM 215 C CG2 . THR A 1 25 ? -14.575 -3.177 -2.003 1.00 89.09 25 A 1 ATOM 216 N N . LYS A 1 26 ? -15.454 -7.435 -0.226 1.00 97.90 26 A 1 ATOM 217 C CA . LYS A 1 26 ? -16.227 -8.582 0.285 1.00 97.86 26 A 1 ATOM 218 C C . LYS A 1 26 ? -15.951 -8.832 1.767 1.00 98.07 26 A 1 ATOM 219 O O . LYS A 1 26 ? -16.886 -9.116 2.507 1.00 97.40 26 A 1 ATOM 220 C CB . LYS A 1 26 ? -15.917 -9.859 -0.500 1.00 97.40 26 A 1 ATOM 221 C CG . LYS A 1 26 ? -16.461 -9.861 -1.931 1.00 87.96 26 A 1 ATOM 222 C CD . LYS A 1 26 ? -15.990 -11.152 -2.605 1.00 82.52 26 A 1 ATOM 223 C CE . LYS A 1 26 ? -16.525 -11.293 -4.027 1.00 73.86 26 A 1 ATOM 224 N NZ . LYS A 1 26 ? -16.171 -12.635 -4.563 1.00 64.27 26 A 1 ATOM 225 N N . VAL A 1 27 ? -14.693 -8.709 2.202 1.00 98.09 27 A 1 ATOM 226 C CA . VAL A 1 27 ? -14.338 -8.841 3.624 1.00 98.12 27 A 1 ATOM 227 C C . VAL A 1 27 ? -14.943 -7.694 4.433 1.00 98.16 27 A 1 ATOM 228 O O . VAL A 1 27 ? -15.598 -7.941 5.444 1.00 97.83 27 A 1 ATOM 229 C CB . VAL A 1 27 ? -12.814 -8.936 3.819 1.00 98.02 27 A 1 ATOM 230 C CG1 . VAL A 1 27 ? -12.455 -9.046 5.302 1.00 97.14 27 A 1 ATOM 231 C CG2 . VAL A 1 27 ? -12.266 -10.184 3.116 1.00 97.19 27 A 1 ATOM 232 N N . LEU A 1 28 ? -14.847 -6.453 3.943 1.00 98.34 28 A 1 ATOM 233 C CA . LEU A 1 28 ? -15.498 -5.305 4.581 1.00 98.25 28 A 1 ATOM 234 C C . LEU A 1 28 ? -17.019 -5.480 4.703 1.00 98.06 28 A 1 ATOM 235 O O . LEU A 1 28 ? -17.618 -4.946 5.629 1.00 97.72 28 A 1 ATOM 236 C CB . LEU A 1 28 ? -15.200 -4.023 3.790 1.00 98.24 28 A 1 ATOM 237 C CG . LEU A 1 28 ? -13.744 -3.529 3.839 1.00 97.79 28 A 1 ATOM 238 C CD1 . LEU A 1 28 ? -13.644 -2.285 2.952 1.00 97.42 28 A 1 ATOM 239 C CD2 . LEU A 1 28 ? -13.296 -3.157 5.250 1.00 97.27 28 A 1 ATOM 240 N N . SER A 1 29 ? -17.663 -6.230 3.800 1.00 97.79 29 A 1 ATOM 241 C CA . SER A 1 29 ? -19.106 -6.502 3.884 1.00 97.39 29 A 1 ATOM 242 C C . SER A 1 29 ? -19.507 -7.333 5.109 1.00 97.50 29 A 1 ATOM 243 O O . SER A 1 29 ? -20.673 -7.291 5.483 1.00 96.44 29 A 1 ATOM 244 C CB . SER A 1 29 ? -19.626 -7.162 2.606 1.00 96.40 29 A 1 ATOM 245 O OG . SER A 1 29 ? -19.422 -6.308 1.498 1.00 85.80 29 A 1 ATOM 246 N N . GLN A 1 30 ? -18.562 -8.029 5.759 1.00 97.84 30 A 1 ATOM 247 C CA . GLN A 1 30 ? -18.797 -8.753 7.017 1.00 97.80 30 A 1 ATOM 248 C C . GLN A 1 30 ? -18.935 -7.805 8.223 1.00 97.90 30 A 1 ATOM 249 O O . GLN A 1 30 ? -19.572 -8.156 9.212 1.00 97.26 30 A 1 ATOM 250 C CB . GLN A 1 30 ? -17.666 -9.764 7.260 1.00 97.75 30 A 1 ATOM 251 C CG . GLN A 1 30 ? -17.523 -10.781 6.110 1.00 96.90 30 A 1 ATOM 252 C CD . GLN A 1 30 ? -16.365 -11.754 6.318 1.00 95.51 30 A 1 ATOM 253 O OE1 . GLN A 1 30 ? -15.974 -12.100 7.417 1.00 88.67 30 A 1 ATOM 254 N NE2 . GLN A 1 30 ? -15.760 -12.248 5.260 1.00 85.94 30 A 1 ATOM 255 N N . ILE A 1 31 ? -18.398 -6.584 8.141 1.00 97.85 31 A 1 ATOM 256 C CA . ILE A 1 31 ? -18.653 -5.545 9.144 1.00 97.91 31 A 1 ATOM 257 C C . ILE A 1 31 ? -20.132 -5.130 9.051 1.00 97.80 31 A 1 ATOM 258 O O . ILE A 1 31 ? -20.606 -4.828 7.945 1.00 97.40 31 A 1 ATOM 259 C CB . ILE A 1 31 ? -17.697 -4.347 8.958 1.00 98.01 31 A 1 ATOM 260 C CG1 . ILE A 1 31 ? -16.236 -4.794 9.197 1.00 97.51 31 A 1 ATOM 261 C CG2 . ILE A 1 31 ? -18.076 -3.189 9.899 1.00 97.46 31 A 1 ATOM 262 C CD1 . ILE A 1 31 ? -15.192 -3.696 8.944 1.00 96.10 31 A 1 ATOM 263 N N . PRO A 1 32 ? -20.880 -5.073 10.172 1.00 97.44 32 A 1 ATOM 264 C CA . PRO A 1 32 ? -22.306 -4.755 10.157 1.00 96.97 32 A 1 ATOM 265 C C . PRO A 1 32 ? -22.637 -3.402 9.514 1.00 96.88 32 A 1 ATOM 266 O O . PRO A 1 32 ? -21.941 -2.403 9.722 1.00 94.90 32 A 1 ATOM 267 C CB . PRO A 1 32 ? -22.757 -4.810 11.620 1.00 95.85 32 A 1 ATOM 268 C CG . PRO A 1 32 ? -21.779 -5.799 12.251 1.00 93.91 32 A 1 ATOM 269 C CD . PRO A 1 32 ? -20.483 -5.505 11.508 1.00 96.76 32 A 1 ATOM 270 N N . ALA A 1 33 ? -23.750 -3.370 8.768 1.00 92.69 33 A 1 ATOM 271 C CA . ALA A 1 33 ? -24.316 -2.164 8.158 1.00 92.61 33 A 1 ATOM 272 C C . ALA A 1 33 ? -23.247 -1.292 7.461 1.00 93.62 33 A 1 ATOM 273 O O . ALA A 1 33 ? -22.412 -1.808 6.717 1.00 88.96 33 A 1 ATOM 274 C CB . ALA A 1 33 ? -25.168 -1.446 9.215 1.00 88.70 33 A 1 ATOM 275 N N . ASP A 1 34 ? -23.240 0.005 7.713 1.00 96.04 34 A 1 ATOM 276 C CA . ASP A 1 34 ? -22.294 0.982 7.165 1.00 96.48 34 A 1 ATOM 277 C C . ASP A 1 34 ? -21.042 1.184 8.043 1.00 97.36 34 A 1 ATOM 278 O O . ASP A 1 34 ? -20.288 2.142 7.853 1.00 95.97 34 A 1 ATOM 279 C CB . ASP A 1 34 ? -23.034 2.304 6.912 1.00 94.28 34 A 1 ATOM 280 C CG . ASP A 1 34 ? -24.081 2.233 5.794 1.00 87.47 34 A 1 ATOM 281 O OD1 . ASP A 1 34 ? -23.912 1.403 4.868 1.00 79.72 34 A 1 ATOM 282 O OD2 . ASP A 1 34 ? -25.026 3.051 5.858 1.00 80.33 34 A 1 ATOM 283 N N . GLY A 1 35 ? -20.804 0.293 9.012 1.00 96.96 35 A 1 ATOM 284 C CA . GLY A 1 35 ? -19.650 0.344 9.910 1.00 97.41 35 A 1 ATOM 285 C C . GLY A 1 35 ? -19.811 1.301 11.095 1.00 97.93 35 A 1 ATOM 286 O O . GLY A 1 35 ? -18.821 1.747 11.660 1.00 97.47 35 A 1 ATOM 287 N N . LYS A 1 36 ? -21.043 1.630 11.491 1.00 96.86 36 A 1 ATOM 288 C CA . LYS A 1 36 ? -21.291 2.460 12.678 1.00 96.85 36 A 1 ATOM 289 C C . LYS A 1 36 ? -20.627 1.831 13.911 1.00 96.78 36 A 1 ATOM 290 O O . LYS A 1 36 ? -20.778 0.636 14.140 1.00 94.40 36 A 1 ATOM 291 C CB . LYS A 1 36 ? -22.805 2.641 12.864 1.00 96.27 36 A 1 ATOM 292 C CG . LYS A 1 36 ? -23.116 3.716 13.911 1.00 93.45 36 A 1 ATOM 293 C CD . LYS A 1 36 ? -24.630 3.922 14.069 1.00 88.98 36 A 1 ATOM 294 C CE . LYS A 1 36 ? -24.875 4.990 15.133 1.00 82.22 36 A 1 ATOM 295 N NZ . LYS A 1 36 ? -26.321 5.186 15.406 1.00 71.50 36 A 1 ATOM 296 N N . HIS A 1 37 ? -19.923 2.644 14.700 1.00 97.59 37 A 1 ATOM 297 C CA . HIS A 1 37 ? -19.133 2.218 15.870 1.00 97.57 37 A 1 ATOM 298 C C . HIS A 1 37 ? -17.907 1.335 15.570 1.00 97.65 37 A 1 ATOM 299 O O . HIS A 1 37 ? -17.280 0.840 16.506 1.00 96.22 37 A 1 ATOM 300 C CB . HIS A 1 37 ? -20.038 1.600 16.955 1.00 96.98 37 A 1 ATOM 301 C CG . HIS A 1 37 ? -21.246 2.443 17.283 1.00 95.92 37 A 1 ATOM 302 N ND1 . HIS A 1 37 ? -21.227 3.681 17.877 1.00 85.62 37 A 1 ATOM 303 C CD2 . HIS A 1 37 ? -22.555 2.135 17.028 1.00 86.00 37 A 1 ATOM 304 C CE1 . HIS A 1 37 ? -22.494 4.101 17.993 1.00 87.38 37 A 1 ATOM 305 N NE2 . HIS A 1 37 ? -23.342 3.200 17.480 1.00 89.38 37 A 1 ATOM 306 N N . TRP A 1 38 ? -17.541 1.168 14.294 1.00 98.27 38 A 1 ATOM 307 C CA . TRP A 1 38 ? -16.301 0.504 13.898 1.00 98.46 38 A 1 ATOM 308 C C . TRP A 1 38 ? -15.187 1.514 13.634 1.00 98.61 38 A 1 ATOM 309 O O . TRP A 1 38 ? -15.423 2.619 13.139 1.00 98.41 38 A 1 ATOM 310 C CB . TRP A 1 38 ? -16.534 -0.402 12.687 1.00 98.32 38 A 1 ATOM 311 C CG . TRP A 1 38 ? -17.188 -1.701 13.036 1.00 98.15 38 A 1 ATOM 312 C CD1 . TRP A 1 38 ? -18.478 -1.868 13.420 1.00 97.45 38 A 1 ATOM 313 C CD2 . TRP A 1 38 ? -16.577 -3.022 13.102 1.00 97.92 38 A 1 ATOM 314 N NE1 . TRP A 1 38 ? -18.704 -3.193 13.729 1.00 97.08 38 A 1 ATOM 315 C CE2 . TRP A 1 38 ? -17.564 -3.954 13.550 1.00 97.47 38 A 1 ATOM 316 C CE3 . TRP A 1 38 ? -15.286 -3.529 12.840 1.00 97.34 38 A 1 ATOM 317 C CZ2 . TRP A 1 38 ? -17.282 -5.315 13.736 1.00 96.57 38 A 1 ATOM 318 C CZ3 . TRP A 1 38 ? -14.993 -4.896 13.015 1.00 96.70 38 A 1 ATOM 319 C CH2 . TRP A 1 38 ? -15.988 -5.790 13.462 1.00 96.26 38 A 1 ATOM 320 N N . THR A 1 39 ? -13.958 1.085 13.903 1.00 98.48 39 A 1 ATOM 321 C CA . THR A 1 39 ? -12.734 1.757 13.460 1.00 98.60 39 A 1 ATOM 322 C C . THR A 1 39 ? -12.004 0.852 12.469 1.00 98.70 39 A 1 ATOM 323 O O . THR A 1 39 ? -11.871 -0.342 12.701 1.00 98.58 39 A 1 ATOM 324 C CB . THR A 1 39 ? -11.840 2.136 14.651 1.00 98.43 39 A 1 ATOM 325 O OG1 . THR A 1 39 ? -12.565 2.964 15.536 1.00 96.99 39 A 1 ATOM 326 C CG2 . THR A 1 39 ? -10.604 2.929 14.233 1.00 97.18 39 A 1 ATOM 327 N N . ILE A 1 40 ? -11.530 1.401 11.357 1.00 98.68 40 A 1 ATOM 328 C CA . ILE A 1 40 ? -10.692 0.689 10.387 1.00 98.78 40 A 1 ATOM 329 C C . ILE A 1 40 ? -9.362 1.435 10.316 1.00 98.79 40 A 1 ATOM 330 O O . ILE A 1 40 ? -9.346 2.618 9.990 1.00 98.69 40 A 1 ATOM 331 C CB . ILE A 1 40 ? -11.385 0.571 9.013 1.00 98.76 40 A 1 ATOM 332 C CG1 . ILE A 1 40 ? -12.766 -0.121 9.135 1.00 98.43 40 A 1 ATOM 333 C CG2 . ILE A 1 40 ? -10.468 -0.196 8.038 1.00 98.58 40 A 1 ATOM 334 C CD1 . ILE A 1 40 ? -13.593 -0.140 7.846 1.00 97.61 40 A 1 ATOM 335 N N . VAL A 1 41 ? -8.269 0.755 10.636 1.00 98.78 41 A 1 ATOM 336 C CA . VAL A 1 41 ? -6.925 1.347 10.674 1.00 98.78 41 A 1 ATOM 337 C C . VAL A 1 41 ? -6.086 0.750 9.553 1.00 98.78 41 A 1 ATOM 338 O O . VAL A 1 41 ? -5.736 -0.426 9.601 1.00 98.57 41 A 1 ATOM 339 C CB . VAL A 1 41 ? -6.249 1.142 12.048 1.00 98.66 41 A 1 ATOM 340 C CG1 . VAL A 1 41 ? -4.955 1.961 12.134 1.00 98.07 41 A 1 ATOM 341 C CG2 . VAL A 1 41 ? -7.155 1.574 13.211 1.00 98.09 41 A 1 ATOM 342 N N . ASP A 1 42 ? -5.759 1.554 8.555 1.00 98.79 42 A 1 ATOM 343 C CA . ASP A 1 42 ? -4.787 1.226 7.506 1.00 98.75 42 A 1 ATOM 344 C C . ASP A 1 42 ? -3.384 1.559 8.035 1.00 98.70 42 A 1 ATOM 345 O O . ASP A 1 42 ? -2.901 2.688 7.932 1.00 98.22 42 A 1 ATOM 346 C CB . ASP A 1 42 ? -5.168 1.969 6.216 1.00 98.56 42 A 1 ATOM 347 C CG . ASP A 1 42 ? -4.391 1.525 4.974 1.00 98.24 42 A 1 ATOM 348 O OD1 . ASP A 1 42 ? -3.515 0.639 5.083 1.00 97.17 42 A 1 ATOM 349 O OD2 . ASP A 1 42 ? -4.711 2.065 3.882 1.00 96.71 42 A 1 ATOM 350 N N . VAL A 1 43 ? -2.779 0.572 8.692 1.00 98.50 43 A 1 ATOM 351 C CA . VAL A 1 43 ? -1.591 0.733 9.549 1.00 98.39 43 A 1 ATOM 352 C C . VAL A 1 43 ? -0.348 1.096 8.742 1.00 98.19 43 A 1 ATOM 353 O O . VAL A 1 43 ? 0.483 1.870 9.211 1.00 97.50 43 A 1 ATOM 354 C CB . VAL A 1 43 ? -1.339 -0.553 10.359 1.00 98.24 43 A 1 ATOM 355 C CG1 . VAL A 1 43 ? -0.072 -0.493 11.225 1.00 97.68 43 A 1 ATOM 356 C CG2 . VAL A 1 43 ? -2.514 -0.866 11.299 1.00 97.73 43 A 1 ATOM 357 N N . PHE A 1 44 ? -0.217 0.557 7.530 1.00 97.81 44 A 1 ATOM 358 C CA . PHE A 1 44 ? 0.910 0.810 6.626 1.00 97.06 44 A 1 ATOM 359 C C . PHE A 1 44 ? 0.512 1.669 5.421 1.00 96.56 44 A 1 ATOM 360 O O . PHE A 1 44 ? 1.290 1.774 4.473 1.00 93.85 44 A 1 ATOM 361 C CB . PHE A 1 44 ? 1.557 -0.522 6.227 1.00 96.46 44 A 1 ATOM 362 C CG . PHE A 1 44 ? 2.213 -1.255 7.381 1.00 96.57 44 A 1 ATOM 363 C CD1 . PHE A 1 44 ? 3.543 -0.954 7.740 1.00 95.89 44 A 1 ATOM 364 C CD2 . PHE A 1 44 ? 1.499 -2.230 8.104 1.00 95.93 44 A 1 ATOM 365 C CE1 . PHE A 1 44 ? 4.156 -1.632 8.808 1.00 95.51 44 A 1 ATOM 366 C CE2 . PHE A 1 44 ? 2.114 -2.906 9.175 1.00 95.60 44 A 1 ATOM 367 C CZ . PHE A 1 44 ? 3.440 -2.609 9.526 1.00 95.74 44 A 1 ATOM 368 N N . GLY A 1 45 ? -0.684 2.230 5.452 1.00 94.47 45 A 1 ATOM 369 C CA . GLY A 1 45 ? -1.300 3.197 4.542 1.00 94.20 45 A 1 ATOM 370 C C . GLY A 1 45 ? -0.861 3.248 3.081 1.00 94.15 45 A 1 ATOM 371 O O . GLY A 1 45 ? -1.666 3.077 2.157 1.00 87.53 45 A 1 ATOM 372 N N . GLY A 1 46 ? 0.418 3.471 2.847 1.00 95.23 46 A 1 ATOM 373 C CA . GLY A 1 46 ? 1.035 3.503 1.527 1.00 95.08 46 A 1 ATOM 374 C C . GLY A 1 46 ? 0.395 4.556 0.621 1.00 95.93 46 A 1 ATOM 375 O O . GLY A 1 46 ? 0.552 5.756 0.823 1.00 94.36 46 A 1 ATOM 376 N N . SER A 1 47 ? -0.348 4.115 -0.401 1.00 96.60 47 A 1 ATOM 377 C CA . SER A 1 47 ? -1.093 5.019 -1.289 1.00 96.96 47 A 1 ATOM 378 C C . SER A 1 47 ? -2.443 5.497 -0.735 1.00 97.60 47 A 1 ATOM 379 O O . SER A 1 47 ? -3.134 6.249 -1.425 1.00 97.16 47 A 1 ATOM 380 C CB . SER A 1 47 ? -1.306 4.363 -2.653 1.00 96.31 47 A 1 ATOM 381 O OG . SER A 1 47 ? -2.116 3.202 -2.552 1.00 95.33 47 A 1 ATOM 382 N N . GLY A 1 48 ? -2.877 5.007 0.426 1.00 97.05 48 A 1 ATOM 383 C CA . GLY A 1 48 ? -4.202 5.271 0.987 1.00 97.63 48 A 1 ATOM 384 C C . GLY A 1 48 ? -5.354 4.565 0.265 1.00 98.23 48 A 1 ATOM 385 O O . GLY A 1 48 ? -6.515 4.831 0.556 1.00 97.98 48 A 1 ATOM 386 N N . LEU A 1 49 ? -5.079 3.676 -0.698 1.00 97.75 49 A 1 ATOM 387 C CA . LEU A 1 49 ? -6.121 3.031 -1.509 1.00 97.90 49 A 1 ATOM 388 C C . LEU A 1 49 ? -7.052 2.150 -0.661 1.00 98.24 49 A 1 ATOM 389 O O . LEU A 1 49 ? -8.264 2.164 -0.874 1.00 98.11 49 A 1 ATOM 390 C CB . LEU A 1 49 ? -5.462 2.222 -2.645 1.00 97.54 49 A 1 ATOM 391 C CG . LEU A 1 49 ? -6.461 1.526 -3.594 1.00 96.77 49 A 1 ATOM 392 C CD1 . LEU A 1 49 ? -7.369 2.514 -4.336 1.00 95.92 49 A 1 ATOM 393 C CD2 . LEU A 1 49 ? -5.694 0.714 -4.642 1.00 95.84 49 A 1 ATOM 394 N N . LEU A 1 50 ? -6.505 1.406 0.295 1.00 98.20 50 A 1 ATOM 395 C CA . LEU A 1 50 ? -7.300 0.549 1.177 1.00 98.33 50 A 1 ATOM 396 C C . LEU A 1 50 ? -8.154 1.394 2.130 1.00 98.42 50 A 1 ATOM 397 O O . LEU A 1 50 ? -9.361 1.160 2.223 1.00 98.27 50 A 1 ATOM 398 C CB . LEU A 1 50 ? -6.380 -0.425 1.934 1.00 98.28 50 A 1 ATOM 399 C CG . LEU A 1 50 ? -5.637 -1.435 1.037 1.00 97.80 50 A 1 ATOM 400 C CD1 . LEU A 1 50 ? -4.617 -2.214 1.863 1.00 97.21 50 A 1 ATOM 401 C CD2 . LEU A 1 50 ? -6.588 -2.439 0.375 1.00 96.83 50 A 1 ATOM 402 N N . ALA A 1 51 ? -7.578 2.440 2.734 1.00 98.52 51 A 1 ATOM 403 C CA . ALA A 1 51 ? -8.316 3.392 3.566 1.00 98.58 51 A 1 ATOM 404 C C . ALA A 1 51 ? -9.446 4.091 2.785 1.00 98.56 51 A 1 ATOM 405 O O . ALA A 1 51 ? -10.592 4.137 3.239 1.00 98.39 51 A 1 ATOM 406 C CB . ALA A 1 51 ? -7.320 4.414 4.127 1.00 98.52 51 A 1 ATOM 407 N N . HIS A 1 52 ? -9.158 4.567 1.573 1.00 98.42 52 A 1 ATOM 408 C CA . HIS A 1 52 ? -10.144 5.167 0.672 1.00 98.32 52 A 1 ATOM 409 C C . HIS A 1 52 ? -11.322 4.221 0.423 1.00 98.25 52 A 1 ATOM 410 O O . HIS A 1 52 ? -12.479 4.578 0.649 1.00 97.81 52 A 1 ATOM 411 C CB . HIS A 1 52 ? -9.469 5.552 -0.652 1.00 98.05 52 A 1 ATOM 412 C CG . HIS A 1 52 ? -10.463 6.020 -1.688 1.00 98.06 52 A 1 ATOM 413 N ND1 . HIS A 1 52 ? -11.039 7.270 -1.745 1.00 92.76 52 A 1 ATOM 414 C CD2 . HIS A 1 52 ? -11.023 5.264 -2.681 1.00 93.67 52 A 1 ATOM 415 C CE1 . HIS A 1 52 ? -11.928 7.259 -2.749 1.00 93.80 52 A 1 ATOM 416 N NE2 . HIS A 1 52 ? -11.953 6.059 -3.343 1.00 94.62 52 A 1 ATOM 417 N N . VAL A 1 53 ? -11.039 2.995 -0.024 1.00 98.27 53 A 1 ATOM 418 C CA . VAL A 1 53 ? -12.071 1.989 -0.305 1.00 98.17 53 A 1 ATOM 419 C C . VAL A 1 53 ? -12.859 1.651 0.959 1.00 98.16 53 A 1 ATOM 420 O O . VAL A 1 53 ? -14.087 1.621 0.908 1.00 97.91 53 A 1 ATOM 421 C CB . VAL A 1 53 ? -11.450 0.737 -0.948 1.00 98.02 53 A 1 ATOM 422 C CG1 . VAL A 1 53 ? -12.449 -0.419 -1.074 1.00 97.24 53 A 1 ATOM 423 C CG2 . VAL A 1 53 ? -10.955 1.058 -2.365 1.00 97.26 53 A 1 ATOM 424 N N . ALA A 1 54 ? -12.179 1.465 2.096 1.00 98.43 54 A 1 ATOM 425 C CA . ALA A 1 54 ? -12.828 1.191 3.372 1.00 98.42 54 A 1 ATOM 426 C C . ALA A 1 54 ? -13.837 2.286 3.735 1.00 98.28 54 A 1 ATOM 427 O O . ALA A 1 54 ? -14.986 1.979 4.043 1.00 98.02 54 A 1 ATOM 428 C CB . ALA A 1 54 ? -11.759 1.029 4.454 1.00 98.44 54 A 1 ATOM 429 N N . LYS A 1 55 ? -13.458 3.564 3.606 1.00 98.41 55 A 1 ATOM 430 C CA . LYS A 1 55 ? -14.352 4.690 3.899 1.00 98.30 55 A 1 ATOM 431 C C . LYS A 1 55 ? -15.563 4.750 2.966 1.00 98.17 55 A 1 ATOM 432 O O . LYS A 1 55 ? -16.659 5.086 3.412 1.00 97.71 55 A 1 ATOM 433 C CB . LYS A 1 55 ? -13.556 6.004 3.874 1.00 98.13 55 A 1 ATOM 434 C CG . LYS A 1 55 ? -14.367 7.223 4.365 1.00 97.14 55 A 1 ATOM 435 C CD . LYS A 1 55 ? -14.855 7.047 5.812 1.00 96.45 55 A 1 ATOM 436 C CE . LYS A 1 55 ? -15.617 8.265 6.319 1.00 95.03 55 A 1 ATOM 437 N NZ . LYS A 1 55 ? -16.075 8.045 7.714 1.00 93.82 55 A 1 ATOM 438 N N . ARG A 1 56 ? -15.401 4.419 1.693 1.00 98.11 56 A 1 ATOM 439 C CA . ARG A 1 56 ? -16.518 4.418 0.729 1.00 97.89 56 A 1 ATOM 440 C C . ARG A 1 56 ? -17.476 3.245 0.926 1.00 97.79 56 A 1 ATOM 441 O O . ARG A 1 56 ? -18.676 3.408 0.709 1.00 96.98 56 A 1 ATOM 442 C CB . ARG A 1 56 ? -15.980 4.484 -0.707 1.00 97.56 56 A 1 ATOM 443 C CG . ARG A 1 56 ? -15.178 5.760 -1.032 1.00 95.11 56 A 1 ATOM 444 C CD . ARG A 1 56 ? -15.992 7.051 -0.891 1.00 91.92 56 A 1 ATOM 445 N NE . ARG A 1 56 ? -15.175 8.241 -1.197 1.00 88.65 56 A 1 ATOM 446 C CZ . ARG A 1 56 ? -14.619 9.083 -0.344 1.00 84.67 56 A 1 ATOM 447 N NH1 . ARG A 1 56 ? -14.713 8.960 0.942 1.00 75.13 56 A 1 ATOM 448 N NH2 . ARG A 1 56 ? -13.939 10.099 -0.782 1.00 78.35 56 A 1 ATOM 449 N N . ILE A 1 57 ? -16.973 2.092 1.364 1.00 97.80 57 A 1 ATOM 450 C CA . ILE A 1 57 ? -17.793 0.905 1.648 1.00 97.63 57 A 1 ATOM 451 C C . ILE A 1 57 ? -18.444 0.992 3.035 1.00 97.63 57 A 1 ATOM 452 O O . ILE A 1 57 ? -19.584 0.558 3.198 1.00 97.03 57 A 1 ATOM 453 C CB . ILE A 1 57 ? -16.944 -0.375 1.475 1.00 97.34 57 A 1 ATOM 454 C CG1 . ILE A 1 57 ? -16.412 -0.542 0.030 1.00 95.35 57 A 1 ATOM 455 C CG2 . ILE A 1 57 ? -17.711 -1.647 1.881 1.00 95.24 57 A 1 ATOM 456 C CD1 . ILE A 1 57 ? -17.476 -0.675 -1.064 1.00 87.54 57 A 1 ATOM 457 N N . LYS A 1 58 ? -17.753 1.568 4.017 1.00 97.84 58 A 1 ATOM 458 C CA . LYS A 1 58 ? -18.206 1.729 5.407 1.00 98.00 58 A 1 ATOM 459 C C . LYS A 1 58 ? -18.229 3.206 5.815 1.00 98.12 58 A 1 ATOM 460 O O . LYS A 1 58 ? -17.408 3.641 6.617 1.00 97.90 58 A 1 ATOM 461 C CB . LYS A 1 58 ? -17.331 0.858 6.334 1.00 97.96 58 A 1 ATOM 462 C CG . LYS A 1 58 ? -17.385 -0.646 6.013 1.00 97.49 58 A 1 ATOM 463 C CD . LYS A 1 58 ? -18.798 -1.224 6.179 1.00 96.98 58 A 1 ATOM 464 C CE . LYS A 1 58 ? -18.820 -2.691 5.785 1.00 95.58 58 A 1 ATOM 465 N NZ . LYS A 1 58 ? -20.164 -3.277 5.963 1.00 94.63 58 A 1 ATOM 466 N N . PRO A 1 59 ? -19.147 4.011 5.267 1.00 97.78 59 A 1 ATOM 467 C CA . PRO A 1 59 ? -19.136 5.467 5.437 1.00 97.66 59 A 1 ATOM 468 C C . PRO A 1 59 ? -19.313 5.928 6.889 1.00 97.85 59 A 1 ATOM 469 O O . PRO A 1 59 ? -18.839 7.010 7.238 1.00 97.48 59 A 1 ATOM 470 C CB . PRO A 1 59 ? -20.262 5.986 4.532 1.00 97.05 59 A 1 ATOM 471 C CG . PRO A 1 59 ? -21.203 4.792 4.378 1.00 95.82 59 A 1 ATOM 472 C CD . PRO A 1 59 ? -20.233 3.617 4.375 1.00 97.41 59 A 1 ATOM 473 N N . GLN A 1 60 ? -19.945 5.121 7.749 1.00 97.92 60 A 1 ATOM 474 C CA . GLN A 1 60 ? -20.113 5.432 9.174 1.00 98.05 60 A 1 ATOM 475 C C . GLN A 1 60 ? -18.949 4.933 10.053 1.00 98.30 60 A 1 ATOM 476 O O . GLN A 1 60 ? -18.908 5.274 11.236 1.00 98.10 60 A 1 ATOM 477 C CB . GLN A 1 60 ? -21.453 4.889 9.690 1.00 97.72 60 A 1 ATOM 478 C CG . GLN A 1 60 ? -22.667 5.522 8.996 1.00 95.81 60 A 1 ATOM 479 C CD . GLN A 1 60 ? -23.975 5.136 9.686 1.00 89.68 60 A 1 ATOM 480 O OE1 . GLN A 1 60 ? -24.153 5.302 10.885 1.00 80.23 60 A 1 ATOM 481 N NE2 . GLN A 1 60 ? -24.938 4.617 8.969 1.00 76.04 60 A 1 ATOM 482 N N . ALA A 1 61 ? -18.006 4.162 9.513 1.00 98.15 61 A 1 ATOM 483 C CA . ALA A 1 61 ? -16.809 3.776 10.248 1.00 98.36 61 A 1 ATOM 484 C C . ALA A 1 61 ? -15.846 4.967 10.393 1.00 98.46 61 A 1 ATOM 485 O O . ALA A 1 61 ? -15.703 5.790 9.477 1.00 98.32 61 A 1 ATOM 486 C CB . ALA A 1 61 ? -16.135 2.580 9.565 1.00 98.31 61 A 1 ATOM 487 N N . ARG A 1 62 ? -15.136 5.030 11.526 1.00 98.50 62 A 1 ATOM 488 C CA . ARG A 1 62 ? -13.925 5.846 11.656 1.00 98.63 62 A 1 ATOM 489 C C . ARG A 1 62 ? -12.822 5.149 10.863 1.00 98.76 62 A 1 ATOM 490 O O . ARG A 1 62 ? -12.530 3.991 11.136 1.00 98.61 62 A 1 ATOM 491 C CB . ARG A 1 62 ? -13.578 6.011 13.144 1.00 98.42 62 A 1 ATOM 492 C CG . ARG A 1 62 ? -12.335 6.885 13.383 1.00 97.53 62 A 1 ATOM 493 C CD . ARG A 1 62 ? -12.031 6.976 14.881 1.00 96.95 62 A 1 ATOM 494 N NE . ARG A 1 62 ? -10.803 7.748 15.153 1.00 94.91 62 A 1 ATOM 495 C CZ . ARG A 1 62 ? -9.952 7.587 16.155 1.00 95.73 62 A 1 ATOM 496 N NH1 . ARG A 1 62 ? -10.110 6.684 17.082 1.00 90.88 62 A 1 ATOM 497 N NH2 . ARG A 1 62 ? -8.901 8.350 16.249 1.00 91.09 62 A 1 ATOM 498 N N . VAL A 1 63 ? -12.246 5.811 9.870 1.00 98.65 63 A 1 ATOM 499 C CA . VAL A 1 63 ? -11.169 5.226 9.054 1.00 98.76 63 A 1 ATOM 500 C C . VAL A 1 63 ? -9.902 6.047 9.229 1.00 98.79 63 A 1 ATOM 501 O O . VAL A 1 63 ? -9.877 7.222 8.867 1.00 98.66 63 A 1 ATOM 502 C CB . VAL A 1 63 ? -11.549 5.088 7.571 1.00 98.70 63 A 1 ATOM 503 C CG1 . VAL A 1 63 ? -10.442 4.352 6.799 1.00 98.16 63 A 1 ATOM 504 C CG2 . VAL A 1 63 ? -12.850 4.291 7.386 1.00 98.20 63 A 1 ATOM 505 N N . ILE A 1 64 ? -8.876 5.420 9.784 1.00 98.80 64 A 1 ATOM 506 C CA . ILE A 1 64 ? -7.564 6.017 10.031 1.00 98.82 64 A 1 ATOM 507 C C . ILE A 1 64 ? -6.620 5.564 8.921 1.00 98.82 64 A 1 ATOM 508 O O . ILE A 1 64 ? -6.449 4.366 8.695 1.00 98.69 64 A 1 ATOM 509 C CB . ILE A 1 64 ? -7.038 5.652 11.437 1.00 98.78 64 A 1 ATOM 510 C CG1 . ILE A 1 64 ? -8.036 6.104 12.531 1.00 98.40 64 A 1 ATOM 511 C CG2 . ILE A 1 64 ? -5.654 6.285 11.665 1.00 98.54 64 A 1 ATOM 512 C CD1 . ILE A 1 64 ? -7.691 5.598 13.935 1.00 97.24 64 A 1 ATOM 513 N N . TYR A 1 65 ? -6.014 6.523 8.237 1.00 98.71 65 A 1 ATOM 514 C CA . TYR A 1 65 ? -4.998 6.323 7.214 1.00 98.68 65 A 1 ATOM 515 C C . TYR A 1 65 ? -3.644 6.769 7.761 1.00 98.64 65 A 1 ATOM 516 O O . TYR A 1 65 ? -3.416 7.962 7.971 1.00 98.22 65 A 1 ATOM 517 C CB . TYR A 1 65 ? -5.418 7.086 5.948 1.00 98.50 65 A 1 ATOM 518 C CG . TYR A 1 65 ? -4.337 7.256 4.894 1.00 98.48 65 A 1 ATOM 519 C CD1 . TYR A 1 65 ? -4.236 8.472 4.183 1.00 97.79 65 A 1 ATOM 520 C CD2 . TYR A 1 65 ? -3.425 6.221 4.624 1.00 97.89 65 A 1 ATOM 521 C CE1 . TYR A 1 65 ? -3.232 8.650 3.215 1.00 97.58 65 A 1 ATOM 522 C CE2 . TYR A 1 65 ? -2.407 6.398 3.669 1.00 97.48 65 A 1 ATOM 523 C CZ . TYR A 1 65 ? -2.309 7.616 2.964 1.00 97.72 65 A 1 ATOM 524 O OH . TYR A 1 65 ? -1.322 7.787 2.052 1.00 96.75 65 A 1 ATOM 525 N N . ASN A 1 66 ? -2.739 5.822 7.986 1.00 98.59 66 A 1 ATOM 526 C CA . ASN A 1 66 ? -1.380 6.133 8.418 1.00 98.39 66 A 1 ATOM 527 C C . ASN A 1 66 ? -0.492 6.454 7.208 1.00 98.19 66 A 1 ATOM 528 O O . ASN A 1 66 ? 0.101 5.563 6.591 1.00 97.10 66 A 1 ATOM 529 C CB . ASN A 1 66 ? -0.844 4.986 9.280 1.00 98.02 66 A 1 ATOM 530 C CG . ASN A 1 66 ? 0.475 5.347 9.935 1.00 97.62 66 A 1 ATOM 531 O OD1 . ASN A 1 66 ? 0.790 6.503 10.187 1.00 94.74 66 A 1 ATOM 532 N ND2 . ASN A 1 66 ? 1.274 4.361 10.267 1.00 94.63 66 A 1 ATOM 533 N N . ASP A 1 67 ? -0.408 7.730 6.869 1.00 97.85 67 A 1 ATOM 534 C CA . ASP A 1 67 ? 0.342 8.244 5.716 1.00 97.40 67 A 1 ATOM 535 C C . ASP A 1 67 ? 1.835 8.430 6.027 1.00 96.35 67 A 1 ATOM 536 O O . ASP A 1 67 ? 2.386 9.532 5.958 1.00 93.55 67 A 1 ATOM 537 C CB . ASP A 1 67 ? -0.325 9.525 5.203 1.00 96.93 67 A 1 ATOM 538 C CG . ASP A 1 67 ? 0.257 9.994 3.865 1.00 96.75 67 A 1 ATOM 539 O OD1 . ASP A 1 67 ? 0.919 9.197 3.152 1.00 95.18 67 A 1 ATOM 540 O OD2 . ASP A 1 67 ? -0.011 11.156 3.488 1.00 95.00 67 A 1 ATOM 541 N N . TYR A 1 68 ? 2.497 7.334 6.385 1.00 94.99 68 A 1 ATOM 542 C CA . TYR A 1 68 ? 3.907 7.353 6.791 1.00 92.97 68 A 1 ATOM 543 C C . TYR A 1 68 ? 4.850 7.872 5.691 1.00 91.45 68 A 1 ATOM 544 O O . TYR A 1 68 ? 5.861 8.517 5.969 1.00 87.77 68 A 1 ATOM 545 C CB . TYR A 1 68 ? 4.299 5.938 7.231 1.00 91.61 68 A 1 ATOM 546 C CG . TYR A 1 68 ? 5.637 5.885 7.937 1.00 90.54 68 A 1 ATOM 547 C CD1 . TYR A 1 68 ? 6.804 5.535 7.231 1.00 87.24 68 A 1 ATOM 548 C CD2 . TYR A 1 68 ? 5.715 6.217 9.306 1.00 87.54 68 A 1 ATOM 549 C CE1 . TYR A 1 68 ? 8.046 5.506 7.893 1.00 84.81 68 A 1 ATOM 550 C CE2 . TYR A 1 68 ? 6.955 6.189 9.973 1.00 85.34 68 A 1 ATOM 551 C CZ . TYR A 1 68 ? 8.123 5.833 9.265 1.00 85.75 68 A 1 ATOM 552 O OH . TYR A 1 68 ? 9.321 5.803 9.911 1.00 83.83 68 A 1 ATOM 553 N N . ASP A 1 69 ? 4.497 7.635 4.425 1.00 93.29 69 A 1 ATOM 554 C CA . ASP A 1 69 ? 5.265 8.028 3.234 1.00 91.73 69 A 1 ATOM 555 C C . ASP A 1 69 ? 4.887 9.412 2.673 1.00 92.64 69 A 1 ATOM 556 O O . ASP A 1 69 ? 5.368 9.788 1.596 1.00 90.59 69 A 1 ATOM 557 C CB . ASP A 1 69 ? 5.108 6.931 2.161 1.00 88.58 69 A 1 ATOM 558 C CG . ASP A 1 69 ? 6.115 5.778 2.234 1.00 84.41 69 A 1 ATOM 559 O OD1 . ASP A 1 69 ? 7.141 5.900 2.931 1.00 81.89 69 A 1 ATOM 560 O OD2 . ASP A 1 69 ? 5.959 4.864 1.388 1.00 80.09 69 A 1 ATOM 561 N N . ASN A 1 70 ? 4.014 10.152 3.362 1.00 93.36 70 A 1 ATOM 562 C CA . ASN A 1 70 ? 3.507 11.468 2.961 1.00 94.25 70 A 1 ATOM 563 C C . ASN A 1 70 ? 2.892 11.482 1.540 1.00 95.21 70 A 1 ATOM 564 O O . ASN A 1 70 ? 3.138 12.371 0.721 1.00 94.53 70 A 1 ATOM 565 C CB . ASN A 1 70 ? 4.591 12.532 3.216 1.00 92.95 70 A 1 ATOM 566 C CG . ASN A 1 70 ? 4.018 13.936 3.236 1.00 88.73 70 A 1 ATOM 567 O OD1 . ASN A 1 70 ? 2.864 14.152 3.564 1.00 84.23 70 A 1 ATOM 568 N ND2 . ASN A 1 70 ? 4.801 14.932 2.900 1.00 81.71 70 A 1 ATOM 569 N N . TYR A 1 71 ? 2.104 10.449 1.212 1.00 96.28 71 A 1 ATOM 570 C CA . TYR A 1 71 ? 1.432 10.339 -0.086 1.00 96.73 71 A 1 ATOM 571 C C . TYR A 1 71 ? 0.350 11.412 -0.266 1.00 97.21 71 A 1 ATOM 572 O O . TYR A 1 71 ? 0.123 11.871 -1.386 1.00 96.99 71 A 1 ATOM 573 C CB . TYR A 1 71 ? 0.857 8.930 -0.241 1.00 96.58 71 A 1 ATOM 574 C CG . TYR A 1 71 ? 0.233 8.654 -1.595 1.00 96.81 71 A 1 ATOM 575 C CD1 . TYR A 1 71 ? -1.144 8.865 -1.799 1.00 96.10 71 A 1 ATOM 576 C CD2 . TYR A 1 71 ? 1.033 8.179 -2.654 1.00 96.18 71 A 1 ATOM 577 C CE1 . TYR A 1 71 ? -1.719 8.597 -3.056 1.00 95.74 71 A 1 ATOM 578 C CE2 . TYR A 1 71 ? 0.460 7.907 -3.909 1.00 95.69 71 A 1 ATOM 579 C CZ . TYR A 1 71 ? -0.919 8.115 -4.111 1.00 96.23 71 A 1 ATOM 580 O OH . TYR A 1 71 ? -1.476 7.845 -5.318 1.00 95.42 71 A 1 ATOM 581 N N . SER A 1 72 ? -0.303 11.834 0.820 1.00 97.34 72 A 1 ATOM 582 C CA . SER A 1 72 ? -1.314 12.896 0.798 1.00 97.36 72 A 1 ATOM 583 C C . SER A 1 72 ? -0.752 14.223 0.288 1.00 97.46 72 A 1 ATOM 584 O O . SER A 1 72 ? -1.410 14.896 -0.504 1.00 96.96 72 A 1 ATOM 585 C CB . SER A 1 72 ? -1.927 13.081 2.190 1.00 96.78 72 A 1 ATOM 586 O OG . SER A 1 72 ? -0.963 13.495 3.128 1.00 89.08 72 A 1 ATOM 587 N N . ASP A 1 73 ? 0.479 14.566 0.656 1.00 97.01 73 A 1 ATOM 588 C CA . ASP A 1 73 ? 1.162 15.755 0.146 1.00 96.89 73 A 1 ATOM 589 C C . ASP A 1 73 ? 1.421 15.646 -1.362 1.00 97.25 73 A 1 ATOM 590 O O . ASP A 1 73 ? 1.081 16.550 -2.129 1.00 96.88 73 A 1 ATOM 591 C CB . ASP A 1 73 ? 2.465 15.960 0.918 1.00 96.18 73 A 1 ATOM 592 C CG . ASP A 1 73 ? 3.050 17.325 0.580 1.00 94.37 73 A 1 ATOM 593 O OD1 . ASP A 1 73 ? 2.396 18.320 0.986 1.00 90.40 73 A 1 ATOM 594 O OD2 . ASP A 1 73 ? 4.105 17.345 -0.086 1.00 89.22 73 A 1 ATOM 595 N N . ARG A 1 74 ? 1.893 14.493 -1.826 1.00 97.16 74 A 1 ATOM 596 C CA . ARG A 1 74 ? 2.104 14.236 -3.259 1.00 97.19 74 A 1 ATOM 597 C C . ARG A 1 74 ? 0.829 14.476 -4.073 1.00 97.71 74 A 1 ATOM 598 O O . ARG A 1 74 ? 0.909 15.006 -5.175 1.00 97.40 74 A 1 ATOM 599 C CB . ARG A 1 74 ? 2.618 12.808 -3.479 1.00 96.23 74 A 1 ATOM 600 C CG . ARG A 1 74 ? 4.006 12.557 -2.846 1.00 93.54 74 A 1 ATOM 601 C CD . ARG A 1 74 ? 4.382 11.069 -2.895 1.00 91.97 74 A 1 ATOM 602 N NE . ARG A 1 74 ? 4.508 10.581 -4.277 1.00 87.09 74 A 1 ATOM 603 C CZ . ARG A 1 74 ? 4.266 9.378 -4.746 1.00 87.57 74 A 1 ATOM 604 N NH1 . ARG A 1 74 ? 3.939 8.373 -3.981 1.00 79.26 74 A 1 ATOM 605 N NH2 . ARG A 1 74 ? 4.351 9.170 -6.022 1.00 77.43 74 A 1 ATOM 606 N N . LEU A 1 75 ? -0.344 14.120 -3.553 1.00 97.05 75 A 1 ATOM 607 C CA . LEU A 1 75 ? -1.621 14.343 -4.249 1.00 97.28 75 A 1 ATOM 608 C C . LEU A 1 75 ? -1.909 15.833 -4.494 1.00 97.45 75 A 1 ATOM 609 O O . LEU A 1 75 ? -2.480 16.173 -5.530 1.00 97.15 75 A 1 ATOM 610 C CB . LEU A 1 75 ? -2.781 13.702 -3.469 1.00 97.17 75 A 1 ATOM 611 C CG . LEU A 1 75 ? -2.780 12.164 -3.426 1.00 96.41 75 A 1 ATOM 612 C CD1 . LEU A 1 75 ? -3.926 11.688 -2.533 1.00 95.61 75 A 1 ATOM 613 C CD2 . LEU A 1 75 ? -2.979 11.549 -4.812 1.00 95.35 75 A 1 ATOM 614 N N . ARG A 1 76 ? -1.478 16.724 -3.599 1.00 97.30 76 A 1 ATOM 615 C CA . ARG A 1 76 ? -1.670 18.181 -3.745 1.00 97.01 76 A 1 ATOM 616 C C . ARG A 1 76 ? -0.912 18.755 -4.942 1.00 97.49 76 A 1 ATOM 617 O O . ARG A 1 76 ? -1.349 19.739 -5.530 1.00 97.14 76 A 1 ATOM 618 C CB . ARG A 1 76 ? -1.221 18.898 -2.465 1.00 95.95 76 A 1 ATOM 619 C CG . ARG A 1 76 ? -2.024 18.471 -1.230 1.00 88.48 76 A 1 ATOM 620 C CD . ARG A 1 76 ? -1.399 19.078 0.028 1.00 85.73 76 A 1 ATOM 621 N NE . ARG A 1 76 ? -2.124 18.675 1.244 1.00 75.38 76 A 1 ATOM 622 C CZ . ARG A 1 76 ? -1.655 18.744 2.476 1.00 67.21 76 A 1 ATOM 623 N NH1 . ARG A 1 76 ? -0.455 19.198 2.734 1.00 60.89 76 A 1 ATOM 624 N NH2 . ARG A 1 76 ? -2.389 18.356 3.484 1.00 56.92 76 A 1 ATOM 625 N N . HIS A 1 77 ? 0.167 18.097 -5.339 1.00 97.43 77 A 1 ATOM 626 C CA . HIS A 1 77 ? 1.035 18.524 -6.433 1.00 97.78 77 A 1 ATOM 627 C C . HIS A 1 77 ? 0.676 17.908 -7.797 1.00 98.12 77 A 1 ATOM 628 O O . HIS A 1 77 ? 1.395 18.103 -8.777 1.00 97.93 77 A 1 ATOM 629 C CB . HIS A 1 77 ? 2.485 18.276 -6.020 1.00 97.65 77 A 1 ATOM 630 C CG . HIS A 1 77 ? 2.890 19.112 -4.833 1.00 97.35 77 A 1 ATOM 631 N ND1 . HIS A 1 77 ? 2.985 20.486 -4.809 1.00 90.78 77 A 1 ATOM 632 C CD2 . HIS A 1 77 ? 3.211 18.653 -3.586 1.00 91.61 77 A 1 ATOM 633 C CE1 . HIS A 1 77 ? 3.365 20.845 -3.578 1.00 91.79 77 A 1 ATOM 634 N NE2 . HIS A 1 77 ? 3.515 19.767 -2.800 1.00 92.91 77 A 1 ATOM 635 N N . ILE A 1 78 ? -0.461 17.210 -7.916 1.00 97.91 78 A 1 ATOM 636 C CA . ILE A 1 78 ? -0.946 16.677 -9.205 1.00 98.00 78 A 1 ATOM 637 C C . ILE A 1 78 ? -0.984 17.744 -10.323 1.00 98.22 78 A 1 ATOM 638 O O . ILE A 1 78 ? -0.597 17.411 -11.450 1.00 98.14 78 A 1 ATOM 639 C CB . ILE A 1 78 ? -2.312 15.967 -9.024 1.00 97.75 78 A 1 ATOM 640 C CG1 . ILE A 1 78 ? -2.085 14.593 -8.356 1.00 97.04 78 A 1 ATOM 641 C CG2 . ILE A 1 78 ? -3.055 15.784 -10.368 1.00 97.08 78 A 1 ATOM 642 C CD1 . ILE A 1 78 ? -3.371 13.875 -7.927 1.00 95.53 78 A 1 ATOM 643 N N . PRO A 1 79 ? -1.398 19.006 -10.076 1.00 97.87 79 A 1 ATOM 644 C CA . PRO A 1 79 ? -1.353 20.052 -11.100 1.00 97.85 79 A 1 ATOM 645 C C . PRO A 1 79 ? 0.057 20.289 -11.662 1.00 98.22 79 A 1 ATOM 646 O O . PRO A 1 79 ? 0.222 20.351 -12.882 1.00 98.23 79 A 1 ATOM 647 C CB . PRO A 1 79 ? -1.929 21.305 -10.432 1.00 97.47 79 A 1 ATOM 648 C CG . PRO A 1 79 ? -2.854 20.737 -9.354 1.00 96.55 79 A 1 ATOM 649 C CD . PRO A 1 79 ? -2.080 19.511 -8.886 1.00 97.60 79 A 1 ATOM 650 N N . ASP A 1 80 ? 1.083 20.326 -10.807 1.00 98.21 80 A 1 ATOM 651 C CA . ASP A 1 80 ? 2.480 20.473 -11.230 1.00 98.39 80 A 1 ATOM 652 C C . ASP A 1 80 ? 2.952 19.275 -12.057 1.00 98.58 80 A 1 ATOM 653 O O . ASP A 1 80 ? 3.538 19.446 -13.129 1.00 98.41 80 A 1 ATOM 654 C CB . ASP A 1 80 ? 3.401 20.647 -10.013 1.00 98.14 80 A 1 ATOM 655 C CG . ASP A 1 80 ? 3.403 22.069 -9.457 1.00 97.81 80 A 1 ATOM 656 O OD1 . ASP A 1 80 ? 3.156 23.008 -10.254 1.00 95.76 80 A 1 ATOM 657 O OD2 . ASP A 1 80 ? 3.750 22.207 -8.268 1.00 95.63 80 A 1 ATOM 658 N N . TYR A 1 81 ? 2.619 18.064 -11.631 1.00 98.40 81 A 1 ATOM 659 C CA . TYR A 1 81 ? 2.967 16.861 -12.383 1.00 98.41 81 A 1 ATOM 660 C C . TYR A 1 81 ? 2.320 16.862 -13.767 1.00 98.49 81 A 1 ATOM 661 O O . TYR A 1 81 ? 2.969 16.508 -14.748 1.00 98.20 81 A 1 ATOM 662 C CB . TYR A 1 81 ? 2.563 15.597 -11.612 1.00 98.13 81 A 1 ATOM 663 C CG . TYR A 1 81 ? 3.043 15.503 -10.178 1.00 97.93 81 A 1 ATOM 664 C CD1 . TYR A 1 81 ? 4.230 16.139 -9.757 1.00 96.61 81 A 1 ATOM 665 C CD2 . TYR A 1 81 ? 2.267 14.786 -9.244 1.00 96.77 81 A 1 ATOM 666 C CE1 . TYR A 1 81 ? 4.615 16.090 -8.406 1.00 95.78 81 A 1 ATOM 667 C CE2 . TYR A 1 81 ? 2.650 14.730 -7.896 1.00 96.00 81 A 1 ATOM 668 C CZ . TYR A 1 81 ? 3.819 15.395 -7.471 1.00 96.20 81 A 1 ATOM 669 O OH . TYR A 1 81 ? 4.165 15.375 -6.161 1.00 94.75 81 A 1 ATOM 670 N N . ASN A 1 82 ? 1.058 17.287 -13.880 1.00 98.13 82 A 1 ATOM 671 C CA . ASN A 1 82 ? 0.374 17.378 -15.166 1.00 98.09 82 A 1 ATOM 672 C C . ASN A 1 82 ? 1.010 18.422 -16.093 1.00 98.26 82 A 1 ATOM 673 O O . ASN A 1 82 ? 1.194 18.138 -17.279 1.00 98.02 82 A 1 ATOM 674 C CB . ASN A 1 82 ? -1.114 17.649 -14.917 1.00 97.77 82 A 1 ATOM 675 C CG . ASN A 1 82 ? -1.866 16.405 -14.487 1.00 97.58 82 A 1 ATOM 676 O OD1 . ASN A 1 82 ? -1.502 15.277 -14.809 1.00 94.12 82 A 1 ATOM 677 N ND2 . ASN A 1 82 ? -2.982 16.564 -13.816 1.00 93.67 82 A 1 ATOM 678 N N . ARG A 1 83 ? 1.428 19.570 -15.554 1.00 98.46 83 A 1 ATOM 679 C CA . ARG A 1 83 ? 2.141 20.615 -16.303 1.00 98.50 83 A 1 ATOM 680 C C . ARG A 1 83 ? 3.513 20.126 -16.792 1.00 98.58 83 A 1 ATOM 681 O O . ARG A 1 83 ? 3.823 20.268 -17.976 1.00 98.39 83 A 1 ATOM 682 C CB . ARG A 1 83 ? 2.234 21.859 -15.400 1.00 98.36 83 A 1 ATOM 683 C CG . ARG A 1 83 ? 2.874 23.067 -16.098 1.00 95.50 83 A 1 ATOM 684 C CD . ARG A 1 83 ? 2.740 24.335 -15.239 1.00 95.33 83 A 1 ATOM 685 N NE . ARG A 1 83 ? 3.346 24.196 -13.897 1.00 90.98 83 A 1 ATOM 686 C CZ . ARG A 1 83 ? 4.539 24.606 -13.505 1.00 90.41 83 A 1 ATOM 687 N NH1 . ARG A 1 83 ? 5.392 25.192 -14.304 1.00 79.43 83 A 1 ATOM 688 N NH2 . ARG A 1 83 ? 4.903 24.440 -12.269 1.00 82.50 83 A 1 ATOM 689 N N . LEU A 1 84 ? 4.293 19.484 -15.926 1.00 98.60 84 A 1 ATOM 690 C CA . LEU A 1 84 ? 5.589 18.903 -16.307 1.00 98.59 84 A 1 ATOM 691 C C . LEU A 1 84 ? 5.427 17.763 -17.323 1.00 98.60 84 A 1 ATOM 692 O O . LEU A 1 84 ? 6.183 17.668 -18.289 1.00 98.45 84 A 1 ATOM 693 C CB . LEU A 1 84 ? 6.311 18.439 -15.028 1.00 98.55 84 A 1 ATOM 694 C CG . LEU A 1 84 ? 7.704 17.827 -15.269 1.00 98.11 84 A 1 ATOM 695 C CD1 . LEU A 1 84 ? 8.648 18.755 -16.035 1.00 97.44 84 A 1 ATOM 696 C CD2 . LEU A 1 84 ? 8.351 17.506 -13.919 1.00 97.57 84 A 1 ATOM 697 N N . ARG A 1 85 ? 4.413 16.916 -17.147 1.00 98.54 85 A 1 ATOM 698 C CA . ARG A 1 85 ? 4.064 15.850 -18.101 1.00 98.44 85 A 1 ATOM 699 C C . ARG A 1 85 ? 3.831 16.403 -19.498 1.00 98.47 85 A 1 ATOM 700 O O . ARG A 1 85 ? 4.282 15.793 -20.458 1.00 98.31 85 A 1 ATOM 701 C CB . ARG A 1 85 ? 2.813 15.112 -17.606 1.00 98.07 85 A 1 ATOM 702 C CG . ARG A 1 85 ? 2.408 13.911 -18.485 1.00 96.38 85 A 1 ATOM 703 C CD . ARG A 1 85 ? 0.929 13.575 -18.286 1.00 95.83 85 A 1 ATOM 704 N NE . ARG A 1 85 ? 0.056 14.595 -18.901 1.00 92.40 85 A 1 ATOM 705 C CZ . ARG A 1 85 ? -0.390 14.618 -20.143 1.00 92.73 85 A 1 ATOM 706 N NH1 . ARG A 1 85 ? -0.184 13.640 -20.976 1.00 82.22 85 A 1 ATOM 707 N NH2 . ARG A 1 85 ? -1.059 15.649 -20.582 1.00 83.72 85 A 1 ATOM 708 N N . GLU A 1 86 ? 3.097 17.506 -19.608 1.00 98.19 86 A 1 ATOM 709 C CA . GLU A 1 86 ? 2.786 18.123 -20.896 1.00 98.08 86 A 1 ATOM 710 C C . GLU A 1 86 ? 4.049 18.628 -21.600 1.00 98.23 86 A 1 ATOM 711 O O . GLU A 1 86 ? 4.258 18.303 -22.772 1.00 97.78 86 A 1 ATOM 712 C CB . GLU A 1 86 ? 1.747 19.224 -20.671 1.00 97.38 86 A 1 ATOM 713 C CG . GLU A 1 86 ? 1.279 19.865 -21.986 1.00 85.66 86 A 1 ATOM 714 C CD . GLU A 1 86 ? 0.018 20.718 -21.792 1.00 81.62 86 A 1 ATOM 715 O OE1 . GLU A 1 86 ? -0.709 20.866 -22.799 1.00 72.05 86 A 1 ATOM 716 O OE2 . GLU A 1 86 ? -0.249 21.134 -20.643 1.00 72.50 86 A 1 ATOM 717 N N . GLN A 1 87 ? 4.939 19.302 -20.876 1.00 98.39 87 A 1 ATOM 718 C CA . GLN A 1 87 ? 6.227 19.764 -21.409 1.00 98.42 87 A 1 ATOM 719 C C . GLN A 1 87 ? 7.092 18.597 -21.910 1.00 98.46 87 A 1 ATOM 720 O O . GLN A 1 87 ? 7.590 18.615 -23.036 1.00 98.23 87 A 1 ATOM 721 C CB . GLN A 1 87 ? 6.978 20.552 -20.322 1.00 98.44 87 A 1 ATOM 722 C CG . GLN A 1 87 ? 6.281 21.873 -19.946 1.00 97.93 87 A 1 ATOM 723 C CD . GLN A 1 87 ? 6.979 22.610 -18.806 1.00 97.54 87 A 1 ATOM 724 O OE1 . GLN A 1 87 ? 7.967 22.180 -18.234 1.00 92.84 87 A 1 ATOM 725 N NE2 . GLN A 1 87 ? 6.491 23.769 -18.422 1.00 90.85 87 A 1 ATOM 726 N N . ILE A 1 88 ? 7.226 17.536 -21.112 1.00 98.51 88 A 1 ATOM 727 C CA . ILE A 1 88 ? 8.000 16.351 -21.511 1.00 98.47 88 A 1 ATOM 728 C C . ILE A 1 88 ? 7.329 15.630 -22.690 1.00 98.35 88 A 1 ATOM 729 O O . ILE A 1 88 ? 8.014 15.176 -23.602 1.00 98.03 88 A 1 ATOM 730 C CB . ILE A 1 88 ? 8.231 15.415 -20.304 1.00 98.47 88 A 1 ATOM 731 C CG1 . ILE A 1 88 ? 9.101 16.116 -19.232 1.00 98.03 88 A 1 ATOM 732 C CG2 . ILE A 1 88 ? 8.924 14.111 -20.747 1.00 98.10 88 A 1 ATOM 733 C CD1 . ILE A 1 88 ? 9.226 15.336 -17.918 1.00 96.93 88 A 1 ATOM 734 N N . ALA A 1 89 ? 5.996 15.545 -22.715 1.00 98.08 89 A 1 ATOM 735 C CA . ALA A 1 89 ? 5.261 14.895 -23.799 1.00 97.79 89 A 1 ATOM 736 C C . ALA A 1 89 ? 5.489 15.568 -25.162 1.00 97.68 89 A 1 ATOM 737 O O . ALA A 1 89 ? 5.551 14.866 -26.172 1.00 96.99 89 A 1 ATOM 738 C CB . ALA A 1 89 ? 3.769 14.848 -23.444 1.00 97.34 89 A 1 ATOM 739 N N . GLN A 1 90 ? 5.662 16.888 -25.197 1.00 98.02 90 A 1 ATOM 740 C CA . GLN A 1 90 ? 6.015 17.623 -26.422 1.00 97.89 90 A 1 ATOM 741 C C . GLN A 1 90 ? 7.408 17.225 -26.936 1.00 97.95 90 A 1 ATOM 742 O O . GLN A 1 90 ? 7.571 16.963 -28.126 1.00 97.01 90 A 1 ATOM 743 C CB . GLN A 1 90 ? 5.940 19.133 -26.156 1.00 97.42 90 A 1 ATOM 744 C CG . GLN A 1 90 ? 4.496 19.633 -25.947 1.00 93.13 90 A 1 ATOM 745 C CD . GLN A 1 90 ? 4.427 21.089 -25.484 1.00 87.40 90 A 1 ATOM 746 O OE1 . GLN A 1 90 ? 5.418 21.782 -25.336 1.00 78.40 90 A 1 ATOM 747 N NE2 . GLN A 1 90 ? 3.244 21.612 -25.234 1.00 73.77 90 A 1 ATOM 748 N N . ILE A 1 91 ? 8.385 17.079 -26.049 1.00 97.75 91 A 1 ATOM 749 C CA . ILE A 1 91 ? 9.764 16.695 -26.408 1.00 97.80 91 A 1 ATOM 750 C C . ILE A 1 91 ? 9.820 15.259 -26.942 1.00 97.73 91 A 1 ATOM 751 O O . ILE A 1 91 ? 10.489 14.989 -27.942 1.00 97.02 91 A 1 ATOM 752 C CB . ILE A 1 91 ? 10.699 16.862 -25.187 1.00 97.97 91 A 1 ATOM 753 C CG1 . ILE A 1 91 ? 10.756 18.342 -24.742 1.00 97.42 91 A 1 ATOM 754 C CG2 . ILE A 1 91 ? 12.119 16.354 -25.505 1.00 97.32 91 A 1 ATOM 755 C CD1 . ILE A 1 91 ? 11.326 18.519 -23.336 1.00 96.04 91 A 1 ATOM 756 N N . VAL A 1 92 ? 9.118 14.328 -26.301 1.00 97.65 92 A 1 ATOM 757 C CA . VAL A 1 92 ? 9.134 12.906 -26.694 1.00 96.92 92 A 1 ATOM 758 C C . VAL A 1 92 ? 8.129 12.571 -27.804 1.00 96.17 92 A 1 ATOM 759 O O . VAL A 1 92 ? 8.018 11.410 -28.204 1.00 94.03 92 A 1 ATOM 760 C CB . VAL A 1 92 ? 9.002 11.959 -25.487 1.00 96.43 92 A 1 ATOM 761 C CG1 . VAL A 1 92 ? 10.027 12.289 -24.395 1.00 93.90 92 A 1 ATOM 762 C CG2 . VAL A 1 92 ? 7.599 11.950 -24.881 1.00 94.19 92 A 1 ATOM 763 N N . GLY A 1 93 ? 7.401 13.566 -28.312 1.00 94.29 93 A 1 ATOM 764 C CA . GLY A 1 93 ? 6.445 13.411 -29.405 1.00 91.97 93 A 1 ATOM 765 C C . GLY A 1 93 ? 7.074 12.730 -30.635 1.00 91.44 93 A 1 ATOM 766 O O . GLY A 1 93 ? 8.204 13.021 -31.021 1.00 83.63 93 A 1 ATOM 767 N N . GLY A 1 94 ? 6.349 11.790 -31.233 1.00 92.30 94 A 1 ATOM 768 C CA . GLY A 1 94 ? 6.815 11.005 -32.386 1.00 93.03 94 A 1 ATOM 769 C C . GLY A 1 94 ? 7.721 9.808 -32.055 1.00 95.09 94 A 1 ATOM 770 O O . GLY A 1 94 ? 7.951 8.976 -32.927 1.00 92.26 94 A 1 ATOM 771 N N . ILE A 1 95 ? 8.206 9.664 -30.813 1.00 96.40 95 A 1 ATOM 772 C CA . ILE A 1 95 ? 8.934 8.457 -30.386 1.00 96.64 95 A 1 ATOM 773 C C . ILE A 1 95 ? 7.927 7.363 -29.989 1.00 97.08 95 A 1 ATOM 774 O O . ILE A 1 95 ? 7.052 7.617 -29.154 1.00 96.24 95 A 1 ATOM 775 C CB . ILE A 1 95 ? 9.932 8.755 -29.244 1.00 95.94 95 A 1 ATOM 776 C CG1 . ILE A 1 95 ? 10.970 9.802 -29.699 1.00 92.64 95 A 1 ATOM 777 C CG2 . ILE A 1 95 ? 10.644 7.465 -28.795 1.00 92.86 95 A 1 ATOM 778 C CD1 . ILE A 1 95 ? 12.046 10.103 -28.651 1.00 84.07 95 A 1 ATOM 779 N N . PRO A 1 96 ? 8.046 6.116 -30.496 1.00 96.90 96 A 1 ATOM 780 C CA . PRO A 1 96 ? 7.194 5.008 -30.076 1.00 96.75 96 A 1 ATOM 781 C C . PRO A 1 96 ? 7.246 4.772 -28.559 1.00 96.84 96 A 1 ATOM 782 O O . PRO A 1 96 ? 8.280 4.925 -27.904 1.00 96.22 96 A 1 ATOM 783 C CB . PRO A 1 96 ? 7.672 3.782 -30.857 1.00 96.37 96 A 1 ATOM 784 C CG . PRO A 1 96 ? 8.318 4.384 -32.103 1.00 95.42 96 A 1 ATOM 785 C CD . PRO A 1 96 ? 8.920 5.685 -31.583 1.00 96.91 96 A 1 ATOM 786 N N . LYS A 1 97 ? 6.121 4.366 -27.980 1.00 96.64 97 A 1 ATOM 787 C CA . LYS A 1 97 ? 6.039 4.079 -26.544 1.00 96.17 97 A 1 ATOM 788 C C . LYS A 1 97 ? 7.000 2.952 -26.157 1.00 96.65 97 A 1 ATOM 789 O O . LYS A 1 97 ? 6.990 1.890 -26.770 1.00 95.31 97 A 1 ATOM 790 C CB . LYS A 1 97 ? 4.584 3.761 -26.171 1.00 94.52 97 A 1 ATOM 791 C CG . LYS A 1 97 ? 4.394 3.659 -24.652 1.00 85.04 97 A 1 ATOM 792 C CD . LYS A 1 97 ? 2.915 3.465 -24.312 1.00 79.16 97 A 1 ATOM 793 C CE . LYS A 1 97 ? 2.728 3.434 -22.792 1.00 72.94 97 A 1 ATOM 794 N NZ . LYS A 1 97 ? 1.291 3.347 -22.434 1.00 63.27 97 A 1 ATOM 795 N N . GLY A 1 98 ? 7.782 3.172 -25.109 1.00 95.68 98 A 1 ATOM 796 C CA . GLY A 1 98 ? 8.781 2.219 -24.618 1.00 95.44 98 A 1 ATOM 797 C C . GLY A 1 98 ? 10.144 2.302 -25.315 1.00 96.30 98 A 1 ATOM 798 O O . GLY A 1 98 ? 11.092 1.701 -24.813 1.00 95.32 98 A 1 ATOM 799 N N . SER A 1 99 ? 10.267 3.057 -26.410 1.00 96.73 99 A 1 ATOM 800 C CA . SER A 1 99 ? 11.553 3.258 -27.082 1.00 96.96 99 A 1 ATOM 801 C C . SER A 1 99 ? 12.476 4.174 -26.277 1.00 97.37 99 A 1 ATOM 802 O O . SER A 1 99 ? 12.020 5.100 -25.604 1.00 96.71 99 A 1 ATOM 803 C CB . SER A 1 99 ? 11.360 3.828 -28.486 1.00 96.30 99 A 1 ATOM 804 O OG . SER A 1 99 ? 10.597 2.926 -29.255 1.00 88.03 99 A 1 ATOM 805 N N . ARG A 1 100 ? 13.780 3.918 -26.374 1.00 97.12 100 A 1 ATOM 806 C CA . ARG A 1 100 ? 14.837 4.753 -25.786 1.00 97.30 100 A 1 ATOM 807 C C . ARG A 1 100 ? 14.834 6.139 -26.437 1.00 97.54 100 A 1 ATOM 808 O O . ARG A 1 100 ? 14.625 6.246 -27.644 1.00 96.97 100 A 1 ATOM 809 C CB . ARG A 1 100 ? 16.187 4.036 -25.946 1.00 96.60 100 A 1 ATOM 810 C CG . ARG A 1 100 ? 17.342 4.763 -25.253 1.00 93.55 100 A 1 ATOM 811 C CD . ARG A 1 100 ? 18.648 3.992 -25.456 1.00 90.72 100 A 1 ATOM 812 N NE . ARG A 1 100 ? 19.805 4.765 -24.988 1.00 80.76 100 A 1 ATOM 813 C CZ . ARG A 1 100 ? 20.976 4.273 -24.637 1.00 75.12 100 A 1 ATOM 814 N NH1 . ARG A 1 100 ? 21.264 3.011 -24.740 1.00 67.22 100 A 1 ATOM 815 N NH2 . ARG A 1 100 ? 21.890 5.052 -24.148 1.00 64.50 100 A 1 ATOM 816 N N . LEU A 1 101 ? 15.075 7.174 -25.646 1.00 97.55 101 A 1 ATOM 817 C CA . LEU A 1 101 ? 15.283 8.524 -26.159 1.00 97.77 101 A 1 ATOM 818 C C . LEU A 1 101 ? 16.695 8.651 -26.747 1.00 97.73 101 A 1 ATOM 819 O O . LEU A 1 101 ? 17.654 8.090 -26.212 1.00 97.35 101 A 1 ATOM 820 C CB . LEU A 1 101 ? 15.035 9.582 -25.068 1.00 97.85 101 A 1 ATOM 821 C CG . LEU A 1 101 ? 13.658 9.538 -24.378 1.00 97.10 101 A 1 ATOM 822 C CD1 . LEU A 1 101 ? 13.458 10.811 -23.546 1.00 95.80 101 A 1 ATOM 823 C CD2 . LEU A 1 101 ? 12.493 9.439 -25.356 1.00 95.85 101 A 1 ATOM 824 N N . ASP A 1 102 ? 16.813 9.405 -27.846 1.00 97.53 102 A 1 ATOM 825 C CA . ASP A 1 102 ? 18.111 9.814 -28.377 1.00 97.34 102 A 1 ATOM 826 C C . ASP A 1 102 ? 18.813 10.818 -27.430 1.00 97.74 102 A 1 ATOM 827 O O . ASP A 1 102 ? 18.178 11.377 -26.520 1.00 97.47 102 A 1 ATOM 828 C CB . ASP A 1 102 ? 17.931 10.359 -29.805 1.00 96.58 102 A 1 ATOM 829 C CG . ASP A 1 102 ? 17.033 11.586 -29.819 1.00 95.95 102 A 1 ATOM 830 O OD1 . ASP A 1 102 ? 17.497 12.637 -29.344 1.00 92.69 102 A 1 ATOM 831 O OD2 . ASP A 1 102 ? 15.847 11.436 -30.209 1.00 92.23 102 A 1 ATOM 832 N N . PRO A 1 103 ? 20.134 11.048 -27.594 1.00 97.49 103 A 1 ATOM 833 C CA . PRO A 1 103 ? 20.889 11.940 -26.713 1.00 97.37 103 A 1 ATOM 834 C C . PRO A 1 103 ? 20.376 13.385 -26.670 1.00 97.65 103 A 1 ATOM 835 O O . PRO A 1 103 ? 20.435 14.020 -25.618 1.00 97.31 103 A 1 ATOM 836 C CB . PRO A 1 103 ? 22.332 11.889 -27.230 1.00 96.98 103 A 1 ATOM 837 C CG . PRO A 1 103 ? 22.432 10.514 -27.882 1.00 95.89 103 A 1 ATOM 838 C CD . PRO A 1 103 ? 21.046 10.339 -28.495 1.00 97.23 103 A 1 ATOM 839 N N . GLU A 1 104 ? 19.871 13.909 -27.787 1.00 96.75 104 A 1 ATOM 840 C CA . GLU A 1 104 ? 19.365 15.280 -27.873 1.00 96.79 104 A 1 ATOM 841 C C . GLU A 1 104 ? 18.082 15.436 -27.053 1.00 97.37 104 A 1 ATOM 842 O O . GLU A 1 104 ? 18.015 16.277 -26.147 1.00 96.99 104 A 1 ATOM 843 C CB . GLU A 1 104 ? 19.151 15.643 -29.350 1.00 96.07 104 A 1 ATOM 844 C CG . GLU A 1 104 ? 18.756 17.115 -29.530 1.00 83.02 104 A 1 ATOM 845 C CD . GLU A 1 104 ? 18.484 17.492 -30.998 1.00 76.92 104 A 1 ATOM 846 O OE1 . GLU A 1 104 ? 18.006 18.628 -31.195 1.00 67.59 104 A 1 ATOM 847 O OE2 . GLU A 1 104 ? 18.755 16.656 -31.889 1.00 68.93 104 A 1 ATOM 848 N N . ARG A 1 105 ? 17.099 14.549 -27.268 1.00 97.74 105 A 1 ATOM 849 C CA . ARG A 1 105 ? 15.841 14.543 -26.513 1.00 97.84 105 A 1 ATOM 850 C C . ARG A 1 105 ? 16.058 14.227 -25.038 1.00 98.25 105 A 1 ATOM 851 O O . ARG A 1 105 ? 15.390 14.814 -24.190 1.00 97.99 105 A 1 ATOM 852 C CB . ARG A 1 105 ? 14.857 13.548 -27.132 1.00 97.05 105 A 1 ATOM 853 C CG . ARG A 1 105 ? 14.384 14.022 -28.513 1.00 92.69 105 A 1 ATOM 854 C CD . ARG A 1 105 ? 13.318 13.069 -29.050 1.00 90.09 105 A 1 ATOM 855 N NE . ARG A 1 105 ? 12.886 13.436 -30.410 1.00 85.99 105 A 1 ATOM 856 C CZ . ARG A 1 105 ? 11.762 13.066 -31.002 1.00 82.27 105 A 1 ATOM 857 N NH1 . ARG A 1 105 ? 10.861 12.339 -30.412 1.00 72.85 105 A 1 ATOM 858 N NH2 . ARG A 1 105 ? 11.512 13.424 -32.225 1.00 75.55 105 A 1 ATOM 859 N N . THR A 1 106 ? 17.005 13.347 -24.723 1.00 97.96 106 A 1 ATOM 860 C CA . THR A 1 106 ? 17.392 13.075 -23.332 1.00 98.01 106 A 1 ATOM 861 C C . THR A 1 106 ? 17.852 14.358 -22.646 1.00 98.25 106 A 1 ATOM 862 O O . THR A 1 106 ? 17.344 14.687 -21.575 1.00 98.13 106 A 1 ATOM 863 C CB . THR A 1 106 ? 18.482 11.996 -23.244 1.00 97.55 106 A 1 ATOM 864 O OG1 . THR A 1 106 ? 17.985 10.789 -23.767 1.00 95.78 106 A 1 ATOM 865 C CG2 . THR A 1 106 ? 18.914 11.706 -21.806 1.00 95.85 106 A 1 ATOM 866 N N . ARG A 1 107 ? 18.746 15.122 -23.281 1.00 97.94 107 A 1 ATOM 867 C CA . ARG A 1 107 ? 19.239 16.401 -22.753 1.00 97.90 107 A 1 ATOM 868 C C . ARG A 1 107 ? 18.113 17.432 -22.605 1.00 98.19 107 A 1 ATOM 869 O O . ARG A 1 107 ? 18.025 18.078 -21.564 1.00 98.01 107 A 1 ATOM 870 C CB . ARG A 1 107 ? 20.366 16.911 -23.659 1.00 97.47 107 A 1 ATOM 871 C CG . ARG A 1 107 ? 21.069 18.138 -23.062 1.00 87.15 107 A 1 ATOM 872 C CD . ARG A 1 107 ? 22.147 18.677 -24.013 1.00 86.93 107 A 1 ATOM 873 N NE . ARG A 1 107 ? 23.222 17.687 -24.248 1.00 76.83 107 A 1 ATOM 874 C CZ . ARG A 1 107 ? 24.059 17.658 -25.276 1.00 68.09 107 A 1 ATOM 875 N NH1 . ARG A 1 107 ? 24.025 18.564 -26.213 1.00 59.02 107 A 1 ATOM 876 N NH2 . ARG A 1 107 ? 24.944 16.711 -25.375 1.00 59.58 107 A 1 ATOM 877 N N . SER A 1 108 ? 17.218 17.538 -23.587 1.00 98.11 108 A 1 ATOM 878 C CA . SER A 1 108 ? 16.064 18.446 -23.521 1.00 98.30 108 A 1 ATOM 879 C C . SER A 1 108 ? 15.107 18.094 -22.373 1.00 98.54 108 A 1 ATOM 880 O O . SER A 1 108 ? 14.642 18.982 -21.657 1.00 98.39 108 A 1 ATOM 881 C CB . SER A 1 108 ? 15.306 18.425 -24.849 1.00 98.12 108 A 1 ATOM 882 O OG . SER A 1 108 ? 16.155 18.841 -25.899 1.00 93.97 108 A 1 ATOM 883 N N . VAL A 1 109 ? 14.840 16.806 -22.142 1.00 98.33 109 A 1 ATOM 884 C CA . VAL A 1 109 ? 14.031 16.343 -21.000 1.00 98.43 109 A 1 ATOM 885 C C . VAL A 1 109 ? 14.730 16.652 -19.673 1.00 98.56 109 A 1 ATOM 886 O O . VAL A 1 109 ? 14.092 17.180 -18.765 1.00 98.46 109 A 1 ATOM 887 C CB . VAL A 1 109 ? 13.691 14.843 -21.127 1.00 98.31 109 A 1 ATOM 888 C CG1 . VAL A 1 109 ? 13.044 14.273 -19.856 1.00 97.79 109 A 1 ATOM 889 C CG2 . VAL A 1 109 ? 12.694 14.606 -22.269 1.00 97.71 109 A 1 ATOM 890 N N . GLN A 1 110 ? 16.036 16.388 -19.559 1.00 98.47 110 A 1 ATOM 891 C CA . GLN A 1 110 ? 16.819 16.708 -18.357 1.00 98.36 110 A 1 ATOM 892 C C . GLN A 1 110 ? 16.769 18.208 -18.040 1.00 98.40 110 A 1 ATOM 893 O O . GLN A 1 110 ? 16.449 18.582 -16.913 1.00 98.22 110 A 1 ATOM 894 C CB . GLN A 1 110 ? 18.273 16.253 -18.545 1.00 98.07 110 A 1 ATOM 895 C CG . GLN A 1 110 ? 18.447 14.729 -18.449 1.00 96.68 110 A 1 ATOM 896 C CD . GLN A 1 110 ? 19.846 14.267 -18.837 1.00 96.22 110 A 1 ATOM 897 O OE1 . GLN A 1 110 ? 20.545 14.896 -19.612 1.00 92.23 110 A 1 ATOM 898 N NE2 . GLN A 1 110 ? 20.295 13.138 -18.335 1.00 90.18 110 A 1 ATOM 899 N N . GLN A 1 111 ? 16.998 19.072 -19.036 1.00 98.44 111 A 1 ATOM 900 C CA . GLN A 1 111 ? 16.911 20.528 -18.880 1.00 98.42 111 A 1 ATOM 901 C C . GLN A 1 111 ? 15.508 20.982 -18.463 1.00 98.59 111 A 1 ATOM 902 O O . GLN A 1 111 ? 15.370 21.827 -17.581 1.00 98.40 111 A 1 ATOM 903 C CB . GLN A 1 111 ? 17.293 21.207 -20.202 1.00 98.10 111 A 1 ATOM 904 C CG . GLN A 1 111 ? 18.806 21.145 -20.478 1.00 88.46 111 A 1 ATOM 905 C CD . GLN A 1 111 ? 19.167 21.678 -21.865 1.00 84.57 111 A 1 ATOM 906 O OE1 . GLN A 1 111 ? 18.346 21.829 -22.755 1.00 77.35 111 A 1 ATOM 907 N NE2 . GLN A 1 111 ? 20.421 21.977 -22.112 1.00 71.87 111 A 1 ATOM 908 N N . THR A 1 112 ? 14.464 20.398 -19.054 1.00 98.33 112 A 1 ATOM 909 C CA . THR A 1 112 ? 13.068 20.698 -18.697 1.00 98.48 112 A 1 ATOM 910 C C . THR A 1 112 ? 12.782 20.350 -17.241 1.00 98.62 112 A 1 ATOM 911 O O . THR A 1 112 ? 12.175 21.151 -16.536 1.00 98.47 112 A 1 ATOM 912 C CB . THR A 1 112 ? 12.097 19.951 -19.619 1.00 98.42 112 A 1 ATOM 913 O OG1 . THR A 1 112 ? 12.319 20.363 -20.945 1.00 97.06 112 A 1 ATOM 914 C CG2 . THR A 1 112 ? 10.628 20.234 -19.308 1.00 97.11 112 A 1 ATOM 915 N N . ILE A 1 113 ? 13.249 19.195 -16.774 1.00 98.55 113 A 1 ATOM 916 C CA . ILE A 1 113 ? 13.092 18.773 -15.376 1.00 98.50 113 A 1 ATOM 917 C C . ILE A 1 113 ? 13.865 19.713 -14.444 1.00 98.50 113 A 1 ATOM 918 O O . ILE A 1 113 ? 13.294 20.206 -13.479 1.00 98.27 113 A 1 ATOM 919 C CB . ILE A 1 113 ? 13.526 17.299 -15.210 1.00 98.46 113 A 1 ATOM 920 C CG1 . ILE A 1 113 ? 12.556 16.351 -15.960 1.00 98.11 113 A 1 ATOM 921 C CG2 . ILE A 1 113 ? 13.584 16.898 -13.724 1.00 98.11 113 A 1 ATOM 922 C CD1 . ILE A 1 113 ? 13.120 14.936 -16.155 1.00 97.43 113 A 1 ATOM 923 N N . THR A 1 114 ? 15.139 20.000 -14.734 1.00 98.46 114 A 1 ATOM 924 C CA . THR A 1 114 ? 15.994 20.839 -13.874 1.00 98.29 114 A 1 ATOM 925 C C . THR A 1 114 ? 15.496 22.286 -13.773 1.00 98.39 114 A 1 ATOM 926 O O . THR A 1 114 ? 15.581 22.887 -12.705 1.00 97.88 114 A 1 ATOM 927 C CB . THR A 1 114 ? 17.441 20.819 -14.386 1.00 97.72 114 A 1 ATOM 928 O OG1 . THR A 1 114 ? 17.917 19.494 -14.411 1.00 92.84 114 A 1 ATOM 929 C CG2 . THR A 1 114 ? 18.418 21.599 -13.503 1.00 91.14 114 A 1 ATOM 930 N N . ASN A 1 115 ? 14.933 22.833 -14.846 1.00 98.23 115 A 1 ATOM 931 C CA . ASN A 1 115 ? 14.435 24.213 -14.884 1.00 98.27 115 A 1 ATOM 932 C C . ASN A 1 115 ? 12.955 24.343 -14.484 1.00 98.46 115 A 1 ATOM 933 O O . ASN A 1 115 ? 12.403 25.447 -14.504 1.00 97.95 115 A 1 ATOM 934 C CB . ASN A 1 115 ? 14.699 24.787 -16.287 1.00 98.06 115 A 1 ATOM 935 C CG . ASN A 1 115 ? 16.179 24.893 -16.623 1.00 96.80 115 A 1 ATOM 936 O OD1 . ASN A 1 115 ? 17.047 25.008 -15.775 1.00 90.66 115 A 1 ATOM 937 N ND2 . ASN A 1 115 ? 16.523 24.883 -17.891 1.00 90.91 115 A 1 ATOM 938 N N . PHE A 1 116 ? 12.280 23.242 -14.148 1.00 98.38 116 A 1 ATOM 939 C CA . PHE A 1 116 ? 10.852 23.248 -13.853 1.00 98.31 116 A 1 ATOM 940 C C . PHE A 1 116 ? 10.540 24.022 -12.565 1.00 98.33 116 A 1 ATOM 941 O O . PHE A 1 116 ? 11.045 23.712 -11.486 1.00 97.78 116 A 1 ATOM 942 C CB . PHE A 1 116 ? 10.332 21.810 -13.784 1.00 98.30 116 A 1 ATOM 943 C CG . PHE A 1 116 ? 8.836 21.732 -13.583 1.00 98.61 116 A 1 ATOM 944 C CD1 . PHE A 1 116 ? 8.309 21.368 -12.330 1.00 98.27 116 A 1 ATOM 945 C CD2 . PHE A 1 116 ? 7.967 22.033 -14.648 1.00 98.39 116 A 1 ATOM 946 C CE1 . PHE A 1 116 ? 6.919 21.285 -12.149 1.00 98.22 116 A 1 ATOM 947 C CE2 . PHE A 1 116 ? 6.576 21.954 -14.463 1.00 98.29 116 A 1 ATOM 948 C CZ . PHE A 1 116 ? 6.051 21.575 -13.215 1.00 98.50 116 A 1 ATOM 949 N N . GLN A 1 117 ? 9.663 25.009 -12.671 1.00 97.87 117 A 1 ATOM 950 C CA . GLN A 1 117 ? 9.178 25.787 -11.535 1.00 97.78 117 A 1 ATOM 951 C C . GLN A 1 117 ? 7.908 25.135 -10.974 1.00 97.95 117 A 1 ATOM 952 O O . GLN A 1 117 ? 6.803 25.381 -11.470 1.00 96.56 117 A 1 ATOM 953 C CB . GLN A 1 117 ? 8.944 27.252 -11.955 1.00 97.29 117 A 1 ATOM 954 C CG . GLN A 1 117 ? 10.206 27.937 -12.521 1.00 93.76 117 A 1 ATOM 955 C CD . GLN A 1 117 ? 11.363 27.917 -11.530 1.00 86.21 117 A 1 ATOM 956 O OE1 . GLN A 1 117 ? 11.230 28.302 -10.383 1.00 78.17 117 A 1 ATOM 957 N NE2 . GLN A 1 117 ? 12.531 27.457 -11.926 1.00 75.03 117 A 1 ATOM 958 N N . GLY A 1 118 ? 8.072 24.258 -9.994 1.00 97.90 118 A 1 ATOM 959 C CA . GLY A 1 118 ? 6.992 23.503 -9.356 1.00 97.86 118 A 1 ATOM 960 C C . GLY A 1 118 ? 7.524 22.276 -8.621 1.00 98.08 118 A 1 ATOM 961 O O . GLY A 1 118 ? 8.733 22.027 -8.595 1.00 97.22 118 A 1 ATOM 962 N N . HIS A 1 119 ? 6.634 21.500 -8.035 1.00 98.20 119 A 1 ATOM 963 C CA . HIS A 1 119 ? 7.020 20.301 -7.299 1.00 98.05 119 A 1 ATOM 964 C C . HIS A 1 119 ? 7.431 19.166 -8.249 1.00 98.20 119 A 1 ATOM 965 O O . HIS A 1 119 ? 6.723 18.835 -9.203 1.00 97.64 119 A 1 ATOM 966 C CB . HIS A 1 119 ? 5.891 19.881 -6.357 1.00 97.25 119 A 1 ATOM 967 C CG . HIS A 1 119 ? 6.328 18.829 -5.371 1.00 94.44 119 A 1 ATOM 968 N ND1 . HIS A 1 119 ? 6.876 19.063 -4.128 1.00 81.25 119 A 1 ATOM 969 C CD2 . HIS A 1 119 ? 6.283 17.471 -5.542 1.00 82.63 119 A 1 ATOM 970 C CE1 . HIS A 1 119 ? 7.141 17.871 -3.563 1.00 84.54 119 A 1 ATOM 971 N NE2 . HIS A 1 119 ? 6.802 16.874 -4.392 1.00 87.54 119 A 1 ATOM 972 N N . ILE A 1 120 ? 8.569 18.540 -7.963 1.00 98.17 120 A 1 ATOM 973 C CA . ILE A 1 120 ? 9.094 17.393 -8.713 1.00 98.03 120 A 1 ATOM 974 C C . ILE A 1 120 ? 9.016 16.145 -7.839 1.00 97.82 120 A 1 ATOM 975 O O . ILE A 1 120 ? 9.613 16.077 -6.769 1.00 96.85 120 A 1 ATOM 976 C CB . ILE A 1 120 ? 10.532 17.671 -9.214 1.00 97.48 120 A 1 ATOM 977 C CG1 . ILE A 1 120 ? 10.524 18.835 -10.234 1.00 94.96 120 A 1 ATOM 978 C CG2 . ILE A 1 120 ? 11.142 16.401 -9.842 1.00 95.07 120 A 1 ATOM 979 C CD1 . ILE A 1 120 ? 11.914 19.241 -10.733 1.00 89.98 120 A 1 ATOM 980 N N . ASP A 1 121 ? 8.327 15.120 -8.333 1.00 97.86 121 A 1 ATOM 981 C CA . ASP A 1 121 ? 8.297 13.797 -7.711 1.00 97.64 121 A 1 ATOM 982 C C . ASP A 1 121 ? 9.088 12.796 -8.560 1.00 97.84 121 A 1 ATOM 983 O O . ASP A 1 121 ? 8.668 12.379 -9.644 1.00 97.32 121 A 1 ATOM 984 C CB . ASP A 1 121 ? 6.844 13.367 -7.480 1.00 96.64 121 A 1 ATOM 985 C CG . ASP A 1 121 ? 6.691 11.999 -6.807 1.00 95.67 121 A 1 ATOM 986 O OD1 . ASP A 1 121 ? 7.676 11.245 -6.629 1.00 93.52 121 A 1 ATOM 987 O OD2 . ASP A 1 121 ? 5.537 11.639 -6.492 1.00 91.95 121 A 1 ATOM 988 N N . VAL A 1 122 ? 10.222 12.372 -8.030 1.00 97.06 122 A 1 ATOM 989 C CA . VAL A 1 122 ? 11.119 11.403 -8.676 1.00 97.07 122 A 1 ATOM 990 C C . VAL A 1 122 ? 10.419 10.064 -8.947 1.00 97.06 122 A 1 ATOM 991 O O . VAL A 1 122 ? 10.701 9.414 -9.957 1.00 96.29 122 A 1 ATOM 992 C CB . VAL A 1 122 ? 12.377 11.204 -7.810 1.00 96.28 122 A 1 ATOM 993 C CG1 . VAL A 1 122 ? 13.349 10.189 -8.416 1.00 92.67 122 A 1 ATOM 994 C CG2 . VAL A 1 122 ? 13.141 12.523 -7.644 1.00 92.72 122 A 1 ATOM 995 N N . ARG A 1 123 ? 9.459 9.656 -8.123 1.00 96.47 123 A 1 ATOM 996 C CA . ARG A 1 123 ? 8.687 8.414 -8.322 1.00 96.03 123 A 1 ATOM 997 C C . ARG A 1 123 ? 7.749 8.539 -9.527 1.00 96.44 123 A 1 ATOM 998 O O . ARG A 1 123 ? 7.638 7.610 -10.331 1.00 95.60 123 A 1 ATOM 999 C CB . ARG A 1 123 ? 7.900 8.045 -7.046 1.00 94.89 123 A 1 ATOM 1000 C CG . ARG A 1 123 ? 8.755 7.894 -5.772 1.00 89.85 123 A 1 ATOM 1001 C CD . ARG A 1 123 ? 7.869 7.634 -4.535 1.00 83.39 123 A 1 ATOM 1002 N NE . ARG A 1 123 ? 8.643 7.500 -3.276 1.00 75.15 123 A 1 ATOM 1003 C CZ . ARG A 1 123 ? 8.155 7.215 -2.065 1.00 65.27 123 A 1 ATOM 1004 N NH1 . ARG A 1 123 ? 6.887 7.055 -1.834 1.00 58.84 123 A 1 ATOM 1005 N NH2 . ARG A 1 123 ? 8.936 7.075 -1.030 1.00 57.78 123 A 1 ATOM 1006 N N . VAL A 1 124 ? 7.124 9.706 -9.688 1.00 96.85 124 A 1 ATOM 1007 C CA . VAL A 1 124 ? 6.307 10.026 -10.870 1.00 97.19 124 A 1 ATOM 1008 C C . VAL A 1 124 ? 7.184 10.047 -12.124 1.00 97.48 124 A 1 ATOM 1009 O O . VAL A 1 124 ? 6.883 9.326 -13.080 1.00 97.24 124 A 1 ATOM 1010 C CB . VAL A 1 124 ? 5.538 11.348 -10.669 1.00 97.06 124 A 1 ATOM 1011 C CG1 . VAL A 1 124 ? 4.860 11.831 -11.953 1.00 96.16 124 A 1 ATOM 1012 C CG2 . VAL A 1 124 ? 4.430 11.168 -9.622 1.00 96.19 124 A 1 ATOM 1013 N N . LEU A 1 125 ? 8.303 10.772 -12.110 1.00 97.71 125 A 1 ATOM 1014 C CA . LEU A 1 125 ? 9.235 10.834 -13.241 1.00 97.91 125 A 1 ATOM 1015 C C . LEU A 1 125 ? 9.811 9.460 -13.610 1.00 97.87 125 A 1 ATOM 1016 O O . LEU A 1 125 ? 9.863 9.108 -14.787 1.00 97.54 125 A 1 ATOM 1017 C CB . LEU A 1 125 ? 10.378 11.808 -12.922 1.00 97.95 125 A 1 ATOM 1018 C CG . LEU A 1 125 ? 9.981 13.292 -12.883 1.00 97.33 125 A 1 ATOM 1019 C CD1 . LEU A 1 125 ? 11.231 14.117 -12.592 1.00 96.54 125 A 1 ATOM 1020 C CD2 . LEU A 1 125 ? 9.396 13.764 -14.214 1.00 96.48 125 A 1 ATOM 1021 N N . SER A 1 126 ? 10.166 8.639 -12.622 1.00 97.22 126 A 1 ATOM 1022 C CA . SER A 1 126 ? 10.632 7.264 -12.854 1.00 96.77 126 A 1 ATOM 1023 C C . SER A 1 126 ? 9.597 6.440 -13.628 1.00 96.81 126 A 1 ATOM 1024 O O . SER A 1 126 ? 9.950 5.687 -14.533 1.00 96.34 126 A 1 ATOM 1025 C CB . SER A 1 126 ? 10.946 6.561 -11.532 1.00 95.96 126 A 1 ATOM 1026 O OG . SER A 1 126 ? 12.014 7.187 -10.858 1.00 92.78 126 A 1 ATOM 1027 N N . SER A 1 127 ? 8.300 6.622 -13.343 1.00 96.72 127 A 1 ATOM 1028 C CA . SER A 1 127 ? 7.232 5.928 -14.080 1.00 96.43 127 A 1 ATOM 1029 C C . SER A 1 127 ? 7.100 6.370 -15.546 1.00 96.76 127 A 1 ATOM 1030 O O . SER A 1 127 ? 6.614 5.597 -16.377 1.00 96.10 127 A 1 ATOM 1031 C CB . SER A 1 127 ? 5.897 6.071 -13.338 1.00 95.80 127 A 1 ATOM 1032 O OG . SER A 1 127 ? 5.261 7.309 -13.569 1.00 92.49 127 A 1 ATOM 1033 N N . TRP A 1 128 ? 7.538 7.602 -15.866 1.00 96.90 128 A 1 ATOM 1034 C CA . TRP A 1 128 ? 7.467 8.171 -17.216 1.00 97.32 128 A 1 ATOM 1035 C C . TRP A 1 128 ? 8.712 7.915 -18.056 1.00 97.55 128 A 1 ATOM 1036 O O . TRP A 1 128 ? 8.604 7.866 -19.281 1.00 97.06 128 A 1 ATOM 1037 C CB . TRP A 1 128 ? 7.255 9.682 -17.121 1.00 97.32 128 A 1 ATOM 1038 C CG . TRP A 1 128 ? 6.031 10.162 -16.423 1.00 97.52 128 A 1 ATOM 1039 C CD1 . TRP A 1 128 ? 4.932 9.433 -16.110 1.00 96.58 128 A 1 ATOM 1040 C CD2 . TRP A 1 128 ? 5.762 11.511 -15.950 1.00 97.43 128 A 1 ATOM 1041 N NE1 . TRP A 1 128 ? 4.009 10.232 -15.474 1.00 96.52 128 A 1 ATOM 1042 C CE2 . TRP A 1 128 ? 4.468 11.526 -15.350 1.00 97.01 128 A 1 ATOM 1043 C CE3 . TRP A 1 128 ? 6.485 12.726 -15.970 1.00 96.67 128 A 1 ATOM 1044 C CZ2 . TRP A 1 128 ? 3.917 12.690 -14.800 1.00 96.26 128 A 1 ATOM 1045 C CZ3 . TRP A 1 128 ? 5.941 13.896 -15.421 1.00 96.21 128 A 1 ATOM 1046 C CH2 . TRP A 1 128 ? 4.658 13.881 -14.835 1.00 95.82 128 A 1 ATOM 1047 N N . LEU A 1 129 ? 9.873 7.787 -17.420 1.00 97.48 129 A 1 ATOM 1048 C CA . LEU A 1 129 ? 11.172 7.822 -18.092 1.00 97.76 129 A 1 ATOM 1049 C C . LEU A 1 129 ? 11.986 6.538 -17.911 1.00 97.78 129 A 1 ATOM 1050 O O . LEU A 1 129 ? 12.884 6.284 -18.699 1.00 97.28 129 A 1 ATOM 1051 C CB . LEU A 1 129 ? 11.952 9.047 -17.586 1.00 97.80 129 A 1 ATOM 1052 C CG . LEU A 1 129 ? 11.274 10.402 -17.867 1.00 97.64 129 A 1 ATOM 1053 C CD1 . LEU A 1 129 ? 12.068 11.526 -17.204 1.00 97.08 129 A 1 ATOM 1054 C CD2 . LEU A 1 129 ? 11.159 10.699 -19.363 1.00 97.04 129 A 1 ATOM 1055 N N . LEU A 1 130 ? 11.678 5.690 -16.916 1.00 96.87 130 A 1 ATOM 1056 C CA . LEU A 1 130 ? 12.439 4.467 -16.632 1.00 96.35 130 A 1 ATOM 1057 C C . LEU A 1 130 ? 11.604 3.197 -16.842 1.00 95.11 130 A 1 ATOM 1058 O O . LEU A 1 130 ? 10.373 3.205 -16.788 1.00 93.03 130 A 1 ATOM 1059 C CB . LEU A 1 130 ? 13.027 4.521 -15.206 1.00 96.33 130 A 1 ATOM 1060 C CG . LEU A 1 130 ? 13.824 5.790 -14.849 1.00 96.06 130 A 1 ATOM 1061 C CD1 . LEU A 1 130 ? 14.386 5.642 -13.438 1.00 94.98 130 A 1 ATOM 1062 C CD2 . LEU A 1 130 ? 14.993 6.043 -15.802 1.00 94.81 130 A 1 ATOM 1063 N N . PHE A 1 131 ? 12.273 2.053 -17.057 1.00 91.67 131 A 1 ATOM 1064 C CA . PHE A 1 131 ? 11.601 0.751 -16.998 1.00 87.67 131 A 1 ATOM 1065 C C . PHE A 1 131 ? 11.128 0.430 -15.575 1.00 86.35 131 A 1 ATOM 1066 O O . PHE A 1 131 ? 11.736 0.854 -14.603 1.00 79.29 131 A 1 ATOM 1067 C CB . PHE A 1 131 ? 12.504 -0.360 -17.545 1.00 81.52 131 A 1 ATOM 1068 C CG . PHE A 1 131 ? 12.553 -0.393 -19.059 1.00 75.65 131 A 1 ATOM 1069 C CD1 . PHE A 1 131 ? 11.426 -0.815 -19.792 1.00 69.17 131 A 1 ATOM 1070 C CD2 . PHE A 1 131 ? 13.723 -0.011 -19.736 1.00 67.41 131 A 1 ATOM 1071 C CE1 . PHE A 1 131 ? 11.472 -0.851 -21.198 1.00 61.32 131 A 1 ATOM 1072 C CE2 . PHE A 1 131 ? 13.765 -0.052 -21.139 1.00 61.73 131 A 1 ATOM 1073 C CZ . PHE A 1 131 ? 12.641 -0.470 -21.872 1.00 59.86 131 A 1 ATOM 1074 N N . SER A 1 132 ? 10.056 -0.366 -15.456 1.00 80.67 132 A 1 ATOM 1075 C CA . SER A 1 132 ? 9.390 -0.642 -14.169 1.00 75.89 132 A 1 ATOM 1076 C C . SER A 1 132 ? 10.286 -1.295 -13.107 1.00 75.58 132 A 1 ATOM 1077 O O . SER A 1 132 ? 10.002 -1.168 -11.925 1.00 67.89 132 A 1 ATOM 1078 C CB . SER A 1 132 ? 8.162 -1.533 -14.394 1.00 68.31 132 A 1 ATOM 1079 O OG . SER A 1 132 ? 7.369 -1.034 -15.463 1.00 60.18 132 A 1 ATOM 1080 N N . ALA A 1 133 ? 11.353 -1.982 -13.533 1.00 76.19 133 A 1 ATOM 1081 C CA . ALA A 1 133 ? 12.336 -2.582 -12.626 1.00 75.06 133 A 1 ATOM 1082 C C . ALA A 1 133 ? 13.416 -1.591 -12.147 1.00 78.32 133 A 1 ATOM 1083 O O . ALA A 1 133 ? 14.201 -1.929 -11.268 1.00 74.55 133 A 1 ATOM 1084 C CB . ALA A 1 133 ? 12.960 -3.782 -13.340 1.00 69.70 133 A 1 ATOM 1085 N N . LYS A 1 134 ? 13.481 -0.397 -12.735 1.00 85.41 134 A 1 ATOM 1086 C CA . LYS A 1 134 ? 14.474 0.626 -12.410 1.00 86.77 134 A 1 ATOM 1087 C C . LYS A 1 134 ? 13.773 1.803 -11.742 1.00 87.72 134 A 1 ATOM 1088 O O . LYS A 1 134 ? 12.830 2.360 -12.301 1.00 84.29 134 A 1 ATOM 1089 C CB . LYS A 1 134 ? 15.247 1.002 -13.685 1.00 84.63 134 A 1 ATOM 1090 C CG . LYS A 1 134 ? 16.608 1.643 -13.381 1.00 79.40 134 A 1 ATOM 1091 C CD . LYS A 1 134 ? 17.432 1.819 -14.672 1.00 77.12 134 A 1 ATOM 1092 C CE . LYS A 1 134 ? 18.865 2.231 -14.339 1.00 72.04 134 A 1 ATOM 1093 N NZ . LYS A 1 134 ? 19.709 2.417 -15.550 1.00 63.39 134 A 1 ATOM 1094 N N . GLN A 1 135 ? 14.215 2.162 -10.553 1.00 90.59 135 A 1 ATOM 1095 C CA . GLN A 1 135 ? 13.688 3.294 -9.795 1.00 89.49 135 A 1 ATOM 1096 C C . GLN A 1 135 ? 14.838 4.195 -9.369 1.00 91.19 135 A 1 ATOM 1097 O O . GLN A 1 135 ? 15.935 3.711 -9.092 1.00 89.71 135 A 1 ATOM 1098 C CB . GLN A 1 135 ? 12.874 2.820 -8.584 1.00 85.88 135 A 1 ATOM 1099 C CG . GLN A 1 135 ? 11.622 2.046 -9.017 1.00 78.24 135 A 1 ATOM 1100 C CD . GLN A 1 135 ? 10.736 1.628 -7.850 1.00 73.76 135 A 1 ATOM 1101 O OE1 . GLN A 1 135 ? 10.777 2.154 -6.754 1.00 66.47 135 A 1 ATOM 1102 N NE2 . GLN A 1 135 ? 9.872 0.659 -8.055 1.00 61.94 135 A 1 ATOM 1103 N N . ALA A 1 136 ? 14.585 5.492 -9.352 1.00 90.72 136 A 1 ATOM 1104 C CA . ALA A 1 136 ? 15.501 6.483 -8.816 1.00 91.63 136 A 1 ATOM 1105 C C . ALA A 1 136 ? 15.036 6.885 -7.416 1.00 90.75 136 A 1 ATOM 1106 O O . ALA A 1 136 ? 13.844 7.101 -7.192 1.00 89.08 136 A 1 ATOM 1107 C CB . ALA A 1 136 ? 15.560 7.673 -9.774 1.00 92.85 136 A 1 ATOM 1108 N N . ASN A 1 137 ? 15.986 7.010 -6.496 1.00 92.01 137 A 1 ATOM 1109 C CA . ASN A 1 137 ? 15.745 7.478 -5.128 1.00 90.54 137 A 1 ATOM 1110 C C . ASN A 1 137 ? 16.009 8.983 -4.974 1.00 92.02 137 A 1 ATOM 1111 O O . ASN A 1 137 ? 15.590 9.586 -3.992 1.00 90.65 137 A 1 ATOM 1112 C CB . ASN A 1 137 ? 16.611 6.647 -4.167 1.00 87.66 137 A 1 ATOM 1113 C CG . ASN A 1 137 ? 16.245 5.175 -4.176 1.00 83.68 137 A 1 ATOM 1114 O OD1 . ASN A 1 137 ? 15.096 4.787 -4.297 1.00 77.91 137 A 1 ATOM 1115 N ND2 . ASN A 1 137 ? 17.212 4.298 -4.060 1.00 75.99 137 A 1 ATOM 1116 N N . SER A 1 138 ? 16.683 9.596 -5.944 1.00 93.10 138 A 1 ATOM 1117 C CA . SER A 1 138 ? 16.947 11.036 -5.995 1.00 94.19 138 A 1 ATOM 1118 C C . SER A 1 138 ? 16.852 11.561 -7.427 1.00 95.47 138 A 1 ATOM 1119 O O . SER A 1 138 ? 16.902 10.794 -8.393 1.00 95.90 138 A 1 ATOM 1120 C CB . SER A 1 138 ? 18.323 11.348 -5.386 1.00 94.16 138 A 1 ATOM 1121 O OG . SER A 1 138 ? 19.360 10.891 -6.234 1.00 94.07 138 A 1 ATOM 1122 N N . LEU A 1 139 ? 16.723 12.877 -7.565 1.00 96.09 139 A 1 ATOM 1123 C CA . LEU A 1 139 ? 16.719 13.537 -8.868 1.00 97.20 139 A 1 ATOM 1124 C C . LEU A 1 139 ? 18.059 13.345 -9.588 1.00 97.70 139 A 1 ATOM 1125 O O . LEU A 1 139 ? 18.067 13.022 -10.770 1.00 97.54 139 A 1 ATOM 1126 C CB . LEU A 1 139 ? 16.367 15.024 -8.680 1.00 97.18 139 A 1 ATOM 1127 C CG . LEU A 1 139 ? 16.281 15.810 -10.002 1.00 95.83 139 A 1 ATOM 1128 C CD1 . LEU A 1 139 ? 15.231 15.228 -10.954 1.00 94.06 139 A 1 ATOM 1129 C CD2 . LEU A 1 139 ? 15.905 17.262 -9.709 1.00 94.05 139 A 1 ATOM 1130 N N . GLU A 1 140 ? 19.160 13.463 -8.872 1.00 96.84 140 A 1 ATOM 1131 C CA . GLU A 1 140 ? 20.504 13.216 -9.403 1.00 96.63 140 A 1 ATOM 1132 C C . GLU A 1 140 ? 20.629 11.808 -9.997 1.00 96.68 140 A 1 ATOM 1133 O O . GLU A 1 140 ? 21.038 11.643 -11.147 1.00 96.02 140 A 1 ATOM 1134 C CB . GLU A 1 140 ? 21.503 13.419 -8.258 1.00 96.06 140 A 1 ATOM 1135 C CG . GLU A 1 140 ? 22.962 13.268 -8.703 1.00 83.48 140 A 1 ATOM 1136 C CD . GLU A 1 140 ? 23.946 13.380 -7.527 1.00 77.52 140 A 1 ATOM 1137 O OE1 . GLU A 1 140 ? 25.159 13.317 -7.800 1.00 68.91 140 A 1 ATOM 1138 O OE2 . GLU A 1 140 ? 23.471 13.493 -6.370 1.00 69.73 140 A 1 ATOM 1139 N N . GLN A 1 141 ? 20.186 10.792 -9.253 1.00 96.66 141 A 1 ATOM 1140 C CA . GLN A 1 141 ? 20.192 9.414 -9.738 1.00 95.98 141 A 1 ATOM 1141 C C . GLN A 1 141 ? 19.303 9.246 -10.979 1.00 96.68 141 A 1 ATOM 1142 O O . GLN A 1 141 ? 19.688 8.543 -11.913 1.00 96.38 141 A 1 ATOM 1143 C CB . GLN A 1 141 ? 19.744 8.475 -8.608 1.00 94.15 141 A 1 ATOM 1144 C CG . GLN A 1 141 ? 19.967 7.001 -8.979 1.00 88.87 141 A 1 ATOM 1145 C CD . GLN A 1 141 ? 19.402 6.030 -7.955 1.00 88.74 141 A 1 ATOM 1146 O OE1 . GLN A 1 141 ? 18.466 6.303 -7.224 1.00 84.37 141 A 1 ATOM 1147 N NE2 . GLN A 1 141 ? 19.913 4.820 -7.892 1.00 81.55 141 A 1 ATOM 1148 N N . LEU A 1 142 ? 18.123 9.875 -11.001 1.00 96.73 142 A 1 ATOM 1149 C CA . LEU A 1 142 ? 17.221 9.843 -12.154 1.00 97.45 142 A 1 ATOM 1150 C C . LEU A 1 142 ? 17.903 10.410 -13.402 1.00 97.82 142 A 1 ATOM 1151 O O . LEU A 1 142 ? 17.870 9.766 -14.448 1.00 97.70 142 A 1 ATOM 1152 C CB . LEU A 1 142 ? 15.936 10.624 -11.824 1.00 97.53 142 A 1 ATOM 1153 C CG . LEU A 1 142 ? 14.915 10.659 -12.979 1.00 97.01 142 A 1 ATOM 1154 C CD1 . LEU A 1 142 ? 14.189 9.330 -13.141 1.00 95.31 142 A 1 ATOM 1155 C CD2 . LEU A 1 142 ? 13.868 11.736 -12.717 1.00 95.15 142 A 1 ATOM 1156 N N . LEU A 1 143 ? 18.527 11.580 -13.295 1.00 97.84 143 A 1 ATOM 1157 C CA . LEU A 1 143 ? 19.180 12.274 -14.411 1.00 97.59 143 A 1 ATOM 1158 C C . LEU A 1 143 ? 20.395 11.507 -14.958 1.00 97.44 143 A 1 ATOM 1159 O O . LEU A 1 143 ? 20.738 11.676 -16.123 1.00 96.77 143 A 1 ATOM 1160 C CB . LEU A 1 143 ? 19.570 13.697 -13.961 1.00 97.63 143 A 1 ATOM 1161 C CG . LEU A 1 143 ? 18.387 14.633 -13.629 1.00 97.13 143 A 1 ATOM 1162 C CD1 . LEU A 1 143 ? 18.916 15.963 -13.096 1.00 96.11 143 A 1 ATOM 1163 C CD2 . LEU A 1 143 ? 17.492 14.917 -14.832 1.00 96.33 143 A 1 ATOM 1164 N N . GLY A 1 144 ? 20.995 10.621 -14.163 1.00 97.23 144 A 1 ATOM 1165 C CA . GLY A 1 144 ? 22.073 9.724 -14.597 1.00 96.69 144 A 1 ATOM 1166 C C . GLY A 1 144 ? 21.610 8.478 -15.363 1.00 96.58 144 A 1 ATOM 1167 O O . GLY A 1 144 ? 22.435 7.687 -15.809 1.00 95.07 144 A 1 ATOM 1168 N N . PHE A 1 145 ? 20.303 8.243 -15.492 1.00 96.65 145 A 1 ATOM 1169 C CA . PHE A 1 145 ? 19.776 7.067 -16.178 1.00 96.45 145 A 1 ATOM 1170 C C . PHE A 1 145 ? 19.451 7.325 -17.654 1.00 96.70 145 A 1 ATOM 1171 O O . PHE A 1 145 ? 19.160 8.432 -18.081 1.00 95.92 145 A 1 ATOM 1172 C CB . PHE A 1 145 ? 18.559 6.506 -15.425 1.00 96.03 145 A 1 ATOM 1173 C CG . PHE A 1 145 ? 18.826 5.852 -14.077 1.00 95.80 145 A 1 ATOM 1174 C CD1 . PHE A 1 145 ? 20.045 5.211 -13.792 1.00 93.97 145 A 1 ATOM 1175 C CD2 . PHE A 1 145 ? 17.802 5.838 -13.110 1.00 93.95 145 A 1 ATOM 1176 C CE1 . PHE A 1 145 ? 20.245 4.567 -12.552 1.00 92.91 145 A 1 ATOM 1177 C CE2 . PHE A 1 145 ? 17.997 5.190 -11.872 1.00 93.13 145 A 1 ATOM 1178 C CZ . PHE A 1 145 ? 19.220 4.555 -11.594 1.00 93.47 145 A 1 ATOM 1179 N N . GLU A 1 146 ? 19.438 6.242 -18.434 1.00 96.54 146 A 1 ATOM 1180 C CA . GLU A 1 146 ? 18.890 6.248 -19.790 1.00 96.16 146 A 1 ATOM 1181 C C . GLU A 1 146 ? 17.369 6.424 -19.732 1.00 96.76 146 A 1 ATOM 1182 O O . GLU A 1 146 ? 16.684 5.738 -18.962 1.00 95.91 146 A 1 ATOM 1183 C CB . GLU A 1 146 ? 19.221 4.942 -20.519 1.00 94.56 146 A 1 ATOM 1184 C CG . GLU A 1 146 ? 20.734 4.683 -20.623 1.00 87.86 146 A 1 ATOM 1185 C CD . GLU A 1 146 ? 21.045 3.402 -21.407 1.00 85.02 146 A 1 ATOM 1186 O OE1 . GLU A 1 146 ? 22.107 3.370 -22.073 1.00 75.69 146 A 1 ATOM 1187 O OE2 . GLU A 1 146 ? 20.209 2.470 -21.423 1.00 76.33 146 A 1 ATOM 1188 N N . PHE A 1 147 ? 16.841 7.313 -20.582 1.00 97.21 147 A 1 ATOM 1189 C CA . PHE A 1 147 ? 15.418 7.615 -20.638 1.00 97.75 147 A 1 ATOM 1190 C C . PHE A 1 147 ? 14.721 6.876 -21.777 1.00 97.81 147 A 1 ATOM 1191 O O . PHE A 1 147 ? 15.267 6.648 -22.854 1.00 97.39 147 A 1 ATOM 1192 C CB . PHE A 1 147 ? 15.196 9.128 -20.722 1.00 97.68 147 A 1 ATOM 1193 C CG . PHE A 1 147 ? 15.537 9.950 -19.487 1.00 97.92 147 A 1 ATOM 1194 C CD1 . PHE A 1 147 ? 15.880 9.363 -18.252 1.00 97.21 147 A 1 ATOM 1195 C CD2 . PHE A 1 147 ? 15.481 11.356 -19.585 1.00 97.11 147 A 1 ATOM 1196 C CE1 . PHE A 1 147 ? 16.171 10.170 -17.136 1.00 96.89 147 A 1 ATOM 1197 C CE2 . PHE A 1 147 ? 15.767 12.159 -18.471 1.00 96.81 147 A 1 ATOM 1198 C CZ . PHE A 1 147 ? 16.117 11.570 -17.247 1.00 97.43 147 A 1 ATOM 1199 N N . TYR A 1 148 ? 13.459 6.549 -21.518 1.00 97.80 148 A 1 ATOM 1200 C CA . TYR A 1 148 ? 12.562 5.864 -22.437 1.00 97.61 148 A 1 ATOM 1201 C C . TYR A 1 148 ? 11.217 6.587 -22.490 1.00 97.77 148 A 1 ATOM 1202 O O . TYR A 1 148 ? 10.744 7.094 -21.469 1.00 97.29 148 A 1 ATOM 1203 C CB . TYR A 1 148 ? 12.377 4.410 -21.994 1.00 97.12 148 A 1 ATOM 1204 C CG . TYR A 1 148 ? 13.653 3.587 -21.996 1.00 96.79 148 A 1 ATOM 1205 C CD1 . TYR A 1 148 ? 13.970 2.782 -23.106 1.00 95.47 148 A 1 ATOM 1206 C CD2 . TYR A 1 148 ? 14.537 3.656 -20.903 1.00 95.83 148 A 1 ATOM 1207 C CE1 . TYR A 1 148 ? 15.171 2.050 -23.130 1.00 94.67 148 A 1 ATOM 1208 C CE2 . TYR A 1 148 ? 15.746 2.930 -20.927 1.00 94.87 148 A 1 ATOM 1209 C CZ . TYR A 1 148 ? 16.062 2.126 -22.041 1.00 94.96 148 A 1 ATOM 1210 O OH . TYR A 1 148 ? 17.232 1.433 -22.069 1.00 93.18 148 A 1 ATOM 1211 N N . ASN A 1 149 ? 10.563 6.590 -23.646 1.00 97.46 149 A 1 ATOM 1212 C CA . ASN A 1 149 ? 9.234 7.178 -23.772 1.00 97.53 149 A 1 ATOM 1213 C C . ASN A 1 149 ? 8.169 6.290 -23.113 1.00 97.37 149 A 1 ATOM 1214 O O . ASN A 1 149 ? 7.547 5.436 -23.747 1.00 96.46 149 A 1 ATOM 1215 C CB . ASN A 1 149 ? 8.910 7.488 -25.241 1.00 97.11 149 A 1 ATOM 1216 C CG . ASN A 1 149 ? 7.561 8.183 -25.368 1.00 97.15 149 A 1 ATOM 1217 O OD1 . ASN A 1 149 ? 6.964 8.629 -24.392 1.00 93.96 149 A 1 ATOM 1218 N ND2 . ASN A 1 149 ? 7.031 8.289 -26.560 1.00 93.20 149 A 1 ATOM 1219 N N . LYS A 1 150 ? 7.938 6.498 -21.831 1.00 97.30 150 A 1 ATOM 1220 C CA . LYS A 1 150 ? 6.827 5.916 -21.067 1.00 96.91 150 A 1 ATOM 1221 C C . LYS A 1 150 ? 5.885 6.988 -20.516 1.00 97.13 150 A 1 ATOM 1222 O O . LYS A 1 150 ? 5.053 6.682 -19.658 1.00 96.15 150 A 1 ATOM 1223 C CB . LYS A 1 150 ? 7.362 4.992 -19.966 1.00 96.11 150 A 1 ATOM 1224 C CG . LYS A 1 150 ? 8.093 3.755 -20.518 1.00 93.74 150 A 1 ATOM 1225 C CD . LYS A 1 150 ? 8.631 2.879 -19.377 1.00 89.54 150 A 1 ATOM 1226 C CE . LYS A 1 150 ? 7.512 2.280 -18.520 1.00 80.62 150 A 1 ATOM 1227 N NZ . LYS A 1 150 ? 8.012 1.864 -17.195 1.00 73.16 150 A 1 ATOM 1228 N N . VAL A 1 151 ? 6.004 8.216 -21.004 1.00 97.22 151 A 1 ATOM 1229 C CA . VAL A 1 151 ? 5.178 9.342 -20.571 1.00 97.10 151 A 1 ATOM 1230 C C . VAL A 1 151 ? 3.704 8.984 -20.736 1.00 96.56 151 A 1 ATOM 1231 O O . VAL A 1 151 ? 3.257 8.443 -21.750 1.00 94.86 151 A 1 ATOM 1232 C CB . VAL A 1 151 ? 5.538 10.642 -21.314 1.00 96.78 151 A 1 ATOM 1233 C CG1 . VAL A 1 151 ? 4.714 11.828 -20.802 1.00 94.52 151 A 1 ATOM 1234 C CG2 . VAL A 1 151 ? 7.014 10.988 -21.106 1.00 94.77 151 A 1 ATOM 1235 N N . ARG A 1 152 ? 2.945 9.258 -19.681 1.00 95.70 152 A 1 ATOM 1236 C CA . ARG A 1 152 ? 1.504 9.027 -19.657 1.00 95.04 152 A 1 ATOM 1237 C C . ARG A 1 152 ? 0.821 9.942 -20.678 1.00 96.04 152 A 1 ATOM 1238 O O . ARG A 1 152 ? 1.088 11.141 -20.708 1.00 94.81 152 A 1 ATOM 1239 C CB . ARG A 1 152 ? 1.006 9.249 -18.221 1.00 92.75 152 A 1 ATOM 1240 C CG . ARG A 1 152 ? -0.456 8.843 -18.043 1.00 87.84 152 A 1 ATOM 1241 C CD . ARG A 1 152 ? -0.932 9.131 -16.623 1.00 87.31 152 A 1 ATOM 1242 N NE . ARG A 1 152 ? -2.375 8.850 -16.476 1.00 85.19 152 A 1 ATOM 1243 C CZ . ARG A 1 152 ? -2.949 7.896 -15.770 1.00 84.45 152 A 1 ATOM 1244 N NH1 . ARG A 1 152 ? -2.262 7.026 -15.084 1.00 75.43 152 A 1 ATOM 1245 N NH2 . ARG A 1 152 ? -4.248 7.801 -15.736 1.00 76.94 152 A 1 ATOM 1246 N N . GLN A 1 153 ? -0.082 9.384 -21.486 1.00 95.57 153 A 1 ATOM 1247 C CA . GLN A 1 153 ? -0.801 10.151 -22.515 1.00 95.10 153 A 1 ATOM 1248 C C . GLN A 1 153 ? -1.838 11.112 -21.910 1.00 96.02 153 A 1 ATOM 1249 O O . GLN A 1 153 ? -1.896 12.274 -22.290 1.00 94.76 153 A 1 ATOM 1250 C CB . GLN A 1 153 ? -1.468 9.187 -23.503 1.00 93.30 153 A 1 ATOM 1251 C CG . GLN A 1 153 ? -0.444 8.446 -24.379 1.00 86.13 153 A 1 ATOM 1252 C CD . GLN A 1 153 ? -1.101 7.461 -25.345 1.00 77.94 153 A 1 ATOM 1253 O OE1 . GLN A 1 153 ? -2.192 6.972 -25.126 1.00 69.42 153 A 1 ATOM 1254 N NE2 . GLN A 1 153 ? -0.445 7.090 -26.419 1.00 65.90 153 A 1 ATOM 1255 N N . SER A 1 154 ? -2.604 10.648 -20.924 1.00 95.87 154 A 1 ATOM 1256 C CA . SER A 1 154 ? -3.600 11.470 -20.227 1.00 95.79 154 A 1 ATOM 1257 C C . SER A 1 154 ? -3.037 12.092 -18.940 1.00 96.60 154 A 1 ATOM 1258 O O . SER A 1 154 ? -2.167 11.481 -18.301 1.00 95.96 154 A 1 ATOM 1259 C CB . SER A 1 154 ? -4.850 10.636 -19.926 1.00 94.30 154 A 1 ATOM 1260 O OG . SER A 1 154 ? -4.543 9.484 -19.168 1.00 89.13 154 A 1 ATOM 1261 N N . PRO A 1 155 ? -3.542 13.255 -18.512 1.00 96.59 155 A 1 ATOM 1262 C CA . PRO A 1 155 ? -3.206 13.812 -17.203 1.00 96.75 155 A 1 ATOM 1263 C C . PRO A 1 155 ? -3.646 12.879 -16.062 1.00 96.84 155 A 1 ATOM 1264 O O . PRO A 1 155 ? -4.512 12.008 -16.232 1.00 95.95 155 A 1 ATOM 1265 C CB . PRO A 1 155 ? -3.906 15.176 -17.153 1.00 95.93 155 A 1 ATOM 1266 C CG . PRO A 1 155 ? -5.093 15.006 -18.098 1.00 94.12 155 A 1 ATOM 1267 C CD . PRO A 1 155 ? -4.544 14.079 -19.175 1.00 96.17 155 A 1 ATOM 1268 N N . TYR A 1 156 ? -3.044 13.058 -14.895 1.00 96.83 156 A 1 ATOM 1269 C CA . TYR A 1 156 ? -3.571 12.487 -13.659 1.00 96.94 156 A 1 ATOM 1270 C C . TYR A 1 156 ? -4.870 13.202 -13.285 1.00 97.24 156 A 1 ATOM 1271 O O . TYR A 1 156 ? -4.960 14.426 -13.407 1.00 96.59 156 A 1 ATOM 1272 C CB . TYR A 1 156 ? -2.546 12.591 -12.524 1.00 96.61 156 A 1 ATOM 1273 C CG . TYR A 1 156 ? -1.297 11.759 -12.745 1.00 96.91 156 A 1 ATOM 1274 C CD1 . TYR A 1 156 ? -1.366 10.355 -12.655 1.00 95.64 156 A 1 ATOM 1275 C CD2 . TYR A 1 156 ? -0.069 12.381 -13.042 1.00 95.81 156 A 1 ATOM 1276 C CE1 . TYR A 1 156 ? -0.217 9.572 -12.872 1.00 94.95 156 A 1 ATOM 1277 C CE2 . TYR A 1 156 ? 1.084 11.599 -13.258 1.00 95.22 156 A 1 ATOM 1278 C CZ . TYR A 1 156 ? 1.008 10.192 -13.179 1.00 95.52 156 A 1 ATOM 1279 O OH . TYR A 1 156 ? 2.111 9.432 -13.403 1.00 94.19 156 A 1 ATOM 1280 N N . SER A 1 157 ? -5.847 12.440 -12.806 1.00 95.09 157 A 1 ATOM 1281 C CA . SER A 1 157 ? -7.041 13.019 -12.183 1.00 94.31 157 A 1 ATOM 1282 C C . SER A 1 157 ? -6.645 13.746 -10.900 1.00 95.51 157 A 1 ATOM 1283 O O . SER A 1 157 ? -5.818 13.229 -10.148 1.00 94.47 157 A 1 ATOM 1284 C CB . SER A 1 157 ? -8.061 11.922 -11.862 1.00 91.35 157 A 1 ATOM 1285 O OG . SER A 1 157 ? -9.205 12.490 -11.258 1.00 78.30 157 A 1 ATOM 1286 N N . ILE A 1 158 ? -7.249 14.899 -10.639 1.00 94.43 158 A 1 ATOM 1287 C CA . ILE A 1 158 ? -7.034 15.652 -9.389 1.00 92.57 158 A 1 ATOM 1288 C C . ILE A 1 158 ? -7.448 14.815 -8.164 1.00 90.44 158 A 1 ATOM 1289 O O . ILE A 1 158 ? -6.846 14.939 -7.111 1.00 83.02 158 A 1 ATOM 1290 C CB . ILE A 1 158 ? -7.783 17.010 -9.453 1.00 90.20 158 A 1 ATOM 1291 C CG1 . ILE A 1 158 ? -7.195 17.885 -10.590 1.00 85.72 158 A 1 ATOM 1292 C CG2 . ILE A 1 158 ? -7.707 17.767 -8.111 1.00 84.77 158 A 1 ATOM 1293 C CD1 . ILE A 1 158 ? -7.959 19.192 -10.852 1.00 77.41 158 A 1 ATOM 1294 N N . ALA A 1 159 ? -8.439 13.924 -8.321 1.00 91.17 159 A 1 ATOM 1295 C CA . ALA A 1 159 ? -8.882 13.015 -7.265 1.00 90.39 159 A 1 ATOM 1296 C C . ALA A 1 159 ? -9.179 13.735 -5.933 1.00 91.68 159 A 1 ATOM 1297 O O . ALA A 1 159 ? -8.753 13.292 -4.871 1.00 89.34 159 A 1 ATOM 1298 C CB . ALA A 1 159 ? -7.875 11.853 -7.154 1.00 87.62 159 A 1 ATOM 1299 N N . ALA A 1 160 ? -9.885 14.866 -6.017 1.00 91.58 160 A 1 ATOM 1300 C CA . ALA A 1 160 ? -10.152 15.743 -4.871 1.00 91.27 160 A 1 ATOM 1301 C C . ALA A 1 160 ? -10.887 15.024 -3.722 1.00 92.38 160 A 1 ATOM 1302 O O . ALA A 1 160 ? -10.662 15.335 -2.563 1.00 90.36 160 A 1 ATOM 1303 C CB . ALA A 1 160 ? -10.955 16.951 -5.375 1.00 89.02 160 A 1 ATOM 1304 N N . ASP A 1 161 ? -11.709 14.021 -4.041 1.00 93.97 161 A 1 ATOM 1305 C CA . ASP A 1 161 ? -12.477 13.220 -3.083 1.00 94.53 161 A 1 ATOM 1306 C C . ASP A 1 161 ? -11.688 12.048 -2.472 1.00 96.07 161 A 1 ATOM 1307 O O . ASP A 1 161 ? -12.214 11.302 -1.643 1.00 95.62 161 A 1 ATOM 1308 C CB . ASP A 1 161 ? -13.743 12.707 -3.795 1.00 92.75 161 A 1 ATOM 1309 C CG . ASP A 1 161 ? -13.458 11.615 -4.845 1.00 90.60 161 A 1 ATOM 1310 O OD1 . ASP A 1 161 ? -12.523 11.795 -5.664 1.00 88.47 161 A 1 ATOM 1311 O OD2 . ASP A 1 161 ? -14.155 10.571 -4.824 1.00 86.97 161 A 1 ATOM 1312 N N . TYR A 1 162 ? -10.429 11.835 -2.889 1.00 95.96 162 A 1 ATOM 1313 C CA . TYR A 1 162 ? -9.703 10.600 -2.573 1.00 96.83 162 A 1 ATOM 1314 C C . TYR A 1 162 ? -9.457 10.415 -1.071 1.00 97.46 162 A 1 ATOM 1315 O O . TYR A 1 162 ? -9.545 9.299 -0.570 1.00 97.03 162 A 1 ATOM 1316 C CB . TYR A 1 162 ? -8.386 10.573 -3.356 1.00 96.76 162 A 1 ATOM 1317 C CG . TYR A 1 162 ? -7.658 9.245 -3.284 1.00 97.13 162 A 1 ATOM 1318 C CD1 . TYR A 1 162 ? -6.494 9.109 -2.500 1.00 96.39 162 A 1 ATOM 1319 C CD2 . TYR A 1 162 ? -8.144 8.143 -4.013 1.00 96.44 162 A 1 ATOM 1320 C CE1 . TYR A 1 162 ? -5.808 7.881 -2.465 1.00 96.15 162 A 1 ATOM 1321 C CE2 . TYR A 1 162 ? -7.459 6.913 -3.980 1.00 96.16 162 A 1 ATOM 1322 C CZ . TYR A 1 162 ? -6.285 6.785 -3.212 1.00 97.11 162 A 1 ATOM 1323 O OH . TYR A 1 162 ? -5.612 5.606 -3.200 1.00 96.67 162 A 1 ATOM 1324 N N . LEU A 1 163 ? -9.190 11.504 -0.349 1.00 97.21 163 A 1 ATOM 1325 C CA . LEU A 1 163 ? -8.917 11.483 1.092 1.00 97.22 163 A 1 ATOM 1326 C C . LEU A 1 163 ? -10.129 11.897 1.948 1.00 97.56 163 A 1 ATOM 1327 O O . LEU A 1 163 ? -10.025 11.980 3.167 1.00 96.92 163 A 1 ATOM 1328 C CB . LEU A 1 163 ? -7.660 12.331 1.378 1.00 96.60 163 A 1 ATOM 1329 C CG . LEU A 1 163 ? -6.389 11.890 0.619 1.00 95.87 163 A 1 ATOM 1330 C CD1 . LEU A 1 163 ? -5.224 12.805 0.991 1.00 94.40 163 A 1 ATOM 1331 C CD2 . LEU A 1 163 ? -5.981 10.444 0.924 1.00 94.24 163 A 1 ATOM 1332 N N . ASP A 1 164 ? -11.299 12.133 1.334 1.00 97.17 164 A 1 ATOM 1333 C CA . ASP A 1 164 ? -12.468 12.637 2.048 1.00 97.13 164 A 1 ATOM 1334 C C . ASP A 1 164 ? -12.962 11.670 3.122 1.00 97.69 164 A 1 ATOM 1335 O O . ASP A 1 164 ? -13.255 10.492 2.876 1.00 97.42 164 A 1 ATOM 1336 C CB . ASP A 1 164 ? -13.631 12.942 1.093 1.00 96.18 164 A 1 ATOM 1337 C CG . ASP A 1 164 ? -13.451 14.200 0.247 1.00 93.58 164 A 1 ATOM 1338 O OD1 . ASP A 1 164 ? -12.471 14.937 0.484 1.00 90.87 164 A 1 ATOM 1339 O OD2 . ASP A 1 164 ? -14.346 14.409 -0.609 1.00 90.09 164 A 1 ATOM 1340 N N . GLY A 1 165 ? -13.133 12.201 4.329 1.00 97.22 165 A 1 ATOM 1341 C CA . GLY A 1 165 ? -13.640 11.472 5.486 1.00 97.59 165 A 1 ATOM 1342 C C . GLY A 1 165 ? -12.634 10.506 6.118 1.00 98.17 165 A 1 ATOM 1343 O O . GLY A 1 165 ? -13.033 9.750 7.006 1.00 97.80 165 A 1 ATOM 1344 N N . LEU A 1 166 ? -11.374 10.513 5.682 1.00 98.39 166 A 1 ATOM 1345 C CA . LEU A 1 166 ? -10.274 9.821 6.349 1.00 98.53 166 A 1 ATOM 1346 C C . LEU A 1 166 ? -9.717 10.678 7.490 1.00 98.58 166 A 1 ATOM 1347 O O . LEU A 1 166 ? -9.580 11.891 7.357 1.00 98.25 166 A 1 ATOM 1348 C CB . LEU A 1 166 ? -9.158 9.468 5.348 1.00 98.40 166 A 1 ATOM 1349 C CG . LEU A 1 166 ? -9.594 8.584 4.164 1.00 97.84 166 A 1 ATOM 1350 C CD1 . LEU A 1 166 ? -8.383 8.271 3.280 1.00 97.55 166 A 1 ATOM 1351 C CD2 . LEU A 1 166 ? -10.201 7.255 4.628 1.00 97.46 166 A 1 ATOM 1352 N N . GLU A 1 167 ? -9.361 10.036 8.580 1.00 98.59 167 A 1 ATOM 1353 C CA . GLU A 1 167 ? -8.483 10.610 9.593 1.00 98.60 167 A 1 ATOM 1354 C C . GLU A 1 167 ? -7.044 10.261 9.209 1.00 98.69 167 A 1 ATOM 1355 O O . GLU A 1 167 ? -6.686 9.086 9.150 1.00 98.39 167 A 1 ATOM 1356 C CB . GLU A 1 167 ? -8.887 10.064 10.965 1.00 98.30 167 A 1 ATOM 1357 C CG . GLU A 1 167 ? -8.058 10.649 12.112 1.00 92.78 167 A 1 ATOM 1358 C CD . GLU A 1 167 ? -8.499 10.046 13.457 1.00 94.95 167 A 1 ATOM 1359 O OE1 . GLU A 1 167 ? -7.646 9.793 14.328 1.00 86.30 167 A 1 ATOM 1360 O OE2 . GLU A 1 167 ? -9.712 9.771 13.641 1.00 89.92 167 A 1 ATOM 1361 N N . ILE A 1 168 ? -6.243 11.272 8.881 1.00 98.64 168 A 1 ATOM 1362 C CA . ILE A 1 168 ? -4.871 11.072 8.406 1.00 98.61 168 A 1 ATOM 1363 C C . ILE A 1 168 ? -3.918 11.248 9.581 1.00 98.58 168 A 1 ATOM 1364 O O . ILE A 1 168 ? -3.935 12.282 10.246 1.00 98.16 168 A 1 ATOM 1365 C CB . ILE A 1 168 ? -4.526 11.995 7.215 1.00 98.42 168 A 1 ATOM 1366 C CG1 . ILE A 1 168 ? -5.572 11.831 6.082 1.00 97.66 168 A 1 ATOM 1367 C CG2 . ILE A 1 168 ? -3.104 11.674 6.705 1.00 97.85 168 A 1 ATOM 1368 C CD1 . ILE A 1 168 ? -5.350 12.753 4.877 1.00 95.13 168 A 1 ATOM 1369 N N . THR A 1 169 ? -3.076 10.250 9.810 1.00 98.62 169 A 1 ATOM 1370 C CA . THR A 1 169 ? -2.011 10.286 10.812 1.00 98.54 169 A 1 ATOM 1371 C C . THR A 1 169 ? -0.670 9.925 10.182 1.00 98.49 169 A 1 ATOM 1372 O O . THR A 1 169 ? -0.617 9.436 9.053 1.00 97.82 169 A 1 ATOM 1373 C CB . THR A 1 169 ? -2.367 9.390 12.012 1.00 98.10 169 A 1 ATOM 1374 O OG1 . THR A 1 169 ? -1.482 9.676 13.072 1.00 95.02 169 A 1 ATOM 1375 C CG2 . THR A 1 169 ? -2.292 7.887 11.719 1.00 94.04 169 A 1 ATOM 1376 N N . GLN A 1 170 ? 0.421 10.189 10.886 1.00 97.88 170 A 1 ATOM 1377 C CA . GLN A 1 170 ? 1.773 9.817 10.479 1.00 97.27 170 A 1 ATOM 1378 C C . GLN A 1 170 ? 2.532 9.321 11.712 1.00 96.83 170 A 1 ATOM 1379 O O . GLN A 1 170 ? 3.192 10.097 12.405 1.00 95.08 170 A 1 ATOM 1380 C CB . GLN A 1 170 ? 2.449 11.001 9.774 1.00 96.01 170 A 1 ATOM 1381 C CG . GLN A 1 170 ? 3.815 10.586 9.196 1.00 89.19 170 A 1 ATOM 1382 C CD . GLN A 1 170 ? 4.502 11.683 8.395 1.00 88.70 170 A 1 ATOM 1383 O OE1 . GLN A 1 170 ? 4.081 12.820 8.299 1.00 81.56 170 A 1 ATOM 1384 N NE2 . GLN A 1 170 ? 5.627 11.379 7.784 1.00 77.95 170 A 1 ATOM 1385 N N . GLN A 1 171 ? 2.396 8.039 12.008 1.00 97.29 171 A 1 ATOM 1386 C CA . GLN A 1 171 ? 2.914 7.429 13.231 1.00 96.64 171 A 1 ATOM 1387 C C . GLN A 1 171 ? 3.707 6.149 12.939 1.00 97.01 171 A 1 ATOM 1388 O O . GLN A 1 171 ? 3.507 5.490 11.917 1.00 96.08 171 A 1 ATOM 1389 C CB . GLN A 1 171 ? 1.763 7.132 14.201 1.00 94.13 171 A 1 ATOM 1390 C CG . GLN A 1 171 ? 1.045 8.382 14.738 1.00 85.56 171 A 1 ATOM 1391 C CD . GLN A 1 171 ? -0.020 8.010 15.771 1.00 87.57 171 A 1 ATOM 1392 O OE1 . GLN A 1 171 ? -0.241 6.850 16.065 1.00 79.99 171 A 1 ATOM 1393 N NE2 . GLN A 1 171 ? -0.720 8.944 16.370 1.00 76.25 171 A 1 ATOM 1394 N N . ASP A 1 172 ? 4.579 5.779 13.872 1.00 96.39 172 A 1 ATOM 1395 C CA . ASP A 1 172 ? 5.171 4.447 13.876 1.00 96.21 172 A 1 ATOM 1396 C C . ASP A 1 172 ? 4.066 3.386 14.046 1.00 96.87 172 A 1 ATOM 1397 O O . ASP A 1 172 ? 3.171 3.524 14.887 1.00 96.61 172 A 1 ATOM 1398 C CB . ASP A 1 172 ? 6.238 4.336 14.976 1.00 94.83 172 A 1 ATOM 1399 C CG . ASP A 1 172 ? 6.900 2.956 14.932 1.00 92.80 172 A 1 ATOM 1400 O OD1 . ASP A 1 172 ? 6.321 2.013 15.514 1.00 89.47 172 A 1 ATOM 1401 O OD2 . ASP A 1 172 ? 7.934 2.816 14.251 1.00 87.17 172 A 1 ATOM 1402 N N . TYR A 1 173 ? 4.132 2.322 13.249 1.00 96.82 173 A 1 ATOM 1403 C CA . TYR A 1 173 ? 3.097 1.288 13.232 1.00 97.02 173 A 1 ATOM 1404 C C . TYR A 1 173 ? 2.916 0.607 14.595 1.00 97.48 173 A 1 ATOM 1405 O O . TYR A 1 173 ? 1.798 0.224 14.928 1.00 97.34 173 A 1 ATOM 1406 C CB . TYR A 1 173 ? 3.405 0.252 12.130 1.00 96.49 173 A 1 ATOM 1407 C CG . TYR A 1 173 ? 4.532 -0.699 12.469 1.00 96.00 173 A 1 ATOM 1408 C CD1 . TYR A 1 173 ? 5.866 -0.353 12.182 1.00 95.11 173 A 1 ATOM 1409 C CD2 . TYR A 1 173 ? 4.249 -1.910 13.129 1.00 94.95 173 A 1 ATOM 1410 C CE1 . TYR A 1 173 ? 6.915 -1.190 12.588 1.00 93.83 173 A 1 ATOM 1411 C CE2 . TYR A 1 173 ? 5.299 -2.751 13.543 1.00 93.89 173 A 1 ATOM 1412 C CZ . TYR A 1 173 ? 6.633 -2.381 13.285 1.00 93.36 173 A 1 ATOM 1413 O OH . TYR A 1 173 ? 7.646 -3.157 13.732 1.00 91.59 173 A 1 ATOM 1414 N N . ASN A 1 174 ? 3.979 0.472 15.410 1.00 96.33 174 A 1 ATOM 1415 C CA . ASN A 1 174 ? 3.875 -0.149 16.731 1.00 95.86 174 A 1 ATOM 1416 C C . ASN A 1 174 ? 3.008 0.691 17.665 1.00 96.75 174 A 1 ATOM 1417 O O . ASN A 1 174 ? 2.160 0.147 18.368 1.00 96.15 174 A 1 ATOM 1418 C CB . ASN A 1 174 ? 5.257 -0.324 17.380 1.00 93.49 174 A 1 ATOM 1419 C CG . ASN A 1 174 ? 6.160 -1.283 16.649 1.00 85.45 174 A 1 ATOM 1420 O OD1 . ASN A 1 174 ? 6.002 -2.493 16.706 1.00 76.48 174 A 1 ATOM 1421 N ND2 . ASN A 1 174 ? 7.157 -0.766 15.972 1.00 75.30 174 A 1 ATOM 1422 N N . LEU A 1 175 ? 3.219 2.013 17.673 1.00 96.86 175 A 1 ATOM 1423 C CA . LEU A 1 175 ? 2.450 2.936 18.504 1.00 97.06 175 A 1 ATOM 1424 C C . LEU A 1 175 ? 0.984 2.929 18.079 1.00 97.57 175 A 1 ATOM 1425 O O . LEU A 1 175 ? 0.106 2.699 18.908 1.00 97.23 175 A 1 ATOM 1426 C CB . LEU A 1 175 ? 3.055 4.351 18.421 1.00 96.56 175 A 1 ATOM 1427 C CG . LEU A 1 175 ? 4.494 4.474 18.959 1.00 93.27 175 A 1 ATOM 1428 C CD1 . LEU A 1 175 ? 4.979 5.918 18.802 1.00 90.19 175 A 1 ATOM 1429 C CD2 . LEU A 1 175 ? 4.605 4.090 20.435 1.00 90.32 175 A 1 ATOM 1430 N N . LEU A 1 176 ? 0.727 3.059 16.773 1.00 97.63 176 A 1 ATOM 1431 C CA . LEU A 1 176 ? -0.629 3.053 16.226 1.00 98.06 176 A 1 ATOM 1432 C C . LEU A 1 176 ? -1.368 1.739 16.523 1.00 98.22 176 A 1 ATOM 1433 O O . LEU A 1 176 ? -2.539 1.743 16.906 1.00 97.92 176 A 1 ATOM 1434 C CB . LEU A 1 176 ? -0.532 3.335 14.717 1.00 98.06 176 A 1 ATOM 1435 C CG . LEU A 1 176 ? -1.892 3.440 14.011 1.00 97.47 176 A 1 ATOM 1436 C CD1 . LEU A 1 176 ? -2.751 4.577 14.566 1.00 97.08 176 A 1 ATOM 1437 C CD2 . LEU A 1 176 ? -1.664 3.697 12.522 1.00 97.10 176 A 1 ATOM 1438 N N . MET A 1 177 ? -0.712 0.595 16.380 1.00 98.10 177 A 1 ATOM 1439 C CA . MET A 1 177 ? -1.318 -0.697 16.712 1.00 98.04 177 A 1 ATOM 1440 C C . MET A 1 177 ? -1.567 -0.848 18.216 1.00 97.77 177 A 1 ATOM 1441 O O . MET A 1 177 ? -2.619 -1.365 18.600 1.00 97.11 177 A 1 ATOM 1442 C CB . MET A 1 177 ? -0.454 -1.854 16.197 1.00 97.91 177 A 1 ATOM 1443 C CG . MET A 1 177 ? -0.502 -1.981 14.672 1.00 97.24 177 A 1 ATOM 1444 S SD . MET A 1 177 ? 0.442 -3.384 14.019 1.00 96.89 177 A 1 ATOM 1445 C CE . MET A 1 177 ? -0.656 -4.749 14.478 1.00 92.64 177 A 1 ATOM 1446 N N . ALA A 1 178 ? -0.650 -0.377 19.069 1.00 97.45 178 A 1 ATOM 1447 C CA . ALA A 1 178 ? -0.806 -0.420 20.519 1.00 97.02 178 A 1 ATOM 1448 C C . ALA A 1 178 ? -2.023 0.391 20.996 1.00 96.91 178 A 1 ATOM 1449 O O . ALA A 1 178 ? -2.760 -0.074 21.866 1.00 96.05 178 A 1 ATOM 1450 C CB . ALA A 1 178 ? 0.490 0.065 21.177 1.00 96.39 178 A 1 ATOM 1451 N N . GLU A 1 179 ? -2.293 1.553 20.387 1.00 96.75 179 A 1 ATOM 1452 C CA . GLU A 1 179 ? -3.477 2.379 20.677 1.00 96.42 179 A 1 ATOM 1453 C C . GLU A 1 179 ? -4.801 1.652 20.388 1.00 96.41 179 A 1 ATOM 1454 O O . GLU A 1 179 ? -5.814 1.881 21.054 1.00 94.92 179 A 1 ATOM 1455 C CB . GLU A 1 179 ? -3.421 3.664 19.834 1.00 95.82 179 A 1 ATOM 1456 C CG . GLU A 1 179 ? -2.360 4.670 20.308 1.00 90.10 179 A 1 ATOM 1457 C CD . GLU A 1 179 ? -2.227 5.893 19.379 1.00 89.79 179 A 1 ATOM 1458 O OE1 . GLU A 1 179 ? -1.287 6.684 19.596 1.00 80.76 179 A 1 ATOM 1459 O OE2 . GLU A 1 179 ? -3.068 6.057 18.462 1.00 83.39 179 A 1 ATOM 1460 N N . HIS A 1 180 ? -4.813 0.755 19.403 1.00 96.44 180 A 1 ATOM 1461 C CA . HIS A 1 180 ? -6.031 0.110 18.904 1.00 95.92 180 A 1 ATOM 1462 C C . HIS A 1 180 ? -6.194 -1.364 19.302 1.00 95.06 180 A 1 ATOM 1463 O O . HIS A 1 180 ? -7.253 -1.948 19.049 1.00 92.67 180 A 1 ATOM 1464 C CB . HIS A 1 180 ? -6.107 0.344 17.392 1.00 96.33 180 A 1 ATOM 1465 C CG . HIS A 1 180 ? -6.393 1.790 17.061 1.00 96.79 180 A 1 ATOM 1466 N ND1 . HIS A 1 180 ? -7.545 2.472 17.397 1.00 90.52 180 A 1 ATOM 1467 C CD2 . HIS A 1 180 ? -5.557 2.676 16.442 1.00 91.80 180 A 1 ATOM 1468 C CE1 . HIS A 1 180 ? -7.393 3.744 17.002 1.00 92.45 180 A 1 ATOM 1469 N NE2 . HIS A 1 180 ? -6.208 3.913 16.403 1.00 93.68 180 A 1 ATOM 1470 N N . GLN A 1 181 ? -5.205 -1.956 19.961 1.00 95.15 181 A 1 ATOM 1471 C CA . GLN A 1 181 ? -5.175 -3.401 20.245 1.00 93.28 181 A 1 ATOM 1472 C C . GLN A 1 181 ? -6.332 -3.906 21.125 1.00 93.48 181 A 1 ATOM 1473 O O . GLN A 1 181 ? -6.723 -5.065 21.009 1.00 91.19 181 A 1 ATOM 1474 C CB . GLN A 1 181 ? -3.812 -3.777 20.853 1.00 89.85 181 A 1 ATOM 1475 C CG . GLN A 1 181 ? -3.638 -3.309 22.305 1.00 84.04 181 A 1 ATOM 1476 C CD . GLN A 1 181 ? -2.229 -3.540 22.829 1.00 81.70 181 A 1 ATOM 1477 O OE1 . GLN A 1 181 ? -1.728 -4.650 22.844 1.00 75.00 181 A 1 ATOM 1478 N NE2 . GLN A 1 181 ? -1.550 -2.512 23.285 1.00 71.29 181 A 1 ATOM 1479 N N . HIS A 1 182 ? -6.900 -3.054 21.984 1.00 93.54 182 A 1 ATOM 1480 C CA . HIS A 1 182 ? -7.922 -3.451 22.964 1.00 93.27 182 A 1 ATOM 1481 C C . HIS A 1 182 ? -9.366 -3.191 22.519 1.00 93.66 182 A 1 ATOM 1482 O O . HIS A 1 182 ? -10.297 -3.614 23.201 1.00 90.96 182 A 1 ATOM 1483 C CB . HIS A 1 182 ? -7.621 -2.779 24.308 1.00 91.71 182 A 1 ATOM 1484 C CG . HIS A 1 182 ? -6.283 -3.191 24.875 1.00 89.70 182 A 1 ATOM 1485 N ND1 . HIS A 1 182 ? -5.869 -4.481 25.123 1.00 80.23 182 A 1 ATOM 1486 C CD2 . HIS A 1 182 ? -5.248 -2.360 25.212 1.00 80.34 182 A 1 ATOM 1487 C CE1 . HIS A 1 182 ? -4.616 -4.426 25.599 1.00 81.14 182 A 1 ATOM 1488 N NE2 . HIS A 1 182 ? -4.200 -3.157 25.674 1.00 82.21 182 A 1 ATOM 1489 N N . ASN A 1 183 ? -9.583 -2.511 21.389 1.00 94.62 183 A 1 ATOM 1490 C CA . ASN A 1 183 ? -10.932 -2.232 20.903 1.00 94.97 183 A 1 ATOM 1491 C C . ASN A 1 183 ? -11.426 -3.368 19.987 1.00 96.00 183 A 1 ATOM 1492 O O . ASN A 1 183 ? -10.924 -3.481 18.866 1.00 95.59 183 A 1 ATOM 1493 C CB . ASN A 1 183 ? -10.938 -0.855 20.220 1.00 93.56 183 A 1 ATOM 1494 C CG . ASN A 1 183 ? -12.299 -0.476 19.656 1.00 90.66 183 A 1 ATOM 1495 O OD1 . ASN A 1 183 ? -13.260 -1.230 19.653 1.00 85.70 183 A 1 ATOM 1496 N ND2 . ASN A 1 183 ? -12.426 0.723 19.136 1.00 83.10 183 A 1 ATOM 1497 N N . PRO A 1 184 ? -12.431 -4.176 20.385 1.00 96.15 184 A 1 ATOM 1498 C CA . PRO A 1 184 ? -12.894 -5.317 19.588 1.00 96.30 184 A 1 ATOM 1499 C C . PRO A 1 184 ? -13.504 -4.911 18.238 1.00 96.94 184 A 1 ATOM 1500 O O . PRO A 1 184 ? -13.431 -5.678 17.287 1.00 96.14 184 A 1 ATOM 1501 C CB . PRO A 1 184 ? -13.914 -6.041 20.480 1.00 95.22 184 A 1 ATOM 1502 C CG . PRO A 1 184 ? -14.450 -4.934 21.384 1.00 93.22 184 A 1 ATOM 1503 C CD . PRO A 1 184 ? -13.225 -4.051 21.601 1.00 95.57 184 A 1 ATOM 1504 N N . ASN A 1 185 ? -14.017 -3.683 18.122 1.00 97.11 185 A 1 ATOM 1505 C CA . ASN A 1 185 ? -14.594 -3.148 16.885 1.00 97.51 185 A 1 ATOM 1506 C C . ASN A 1 185 ? -13.562 -2.396 16.022 1.00 98.11 185 A 1 ATOM 1507 O O . ASN A 1 185 ? -13.923 -1.516 15.236 1.00 97.65 185 A 1 ATOM 1508 C CB . ASN A 1 185 ? -15.818 -2.286 17.230 1.00 96.43 185 A 1 ATOM 1509 C CG . ASN A 1 185 ? -16.957 -3.062 17.868 1.00 93.83 185 A 1 ATOM 1510 O OD1 . ASN A 1 185 ? -17.030 -4.276 17.861 1.00 84.68 185 A 1 ATOM 1511 N ND2 . ASN A 1 185 ? -17.904 -2.368 18.456 1.00 83.58 185 A 1 ATOM 1512 N N . THR A 1 186 ? -12.272 -2.694 16.179 1.00 98.11 186 A 1 ATOM 1513 C CA . THR A 1 186 ? -11.220 -2.147 15.311 1.00 98.34 186 A 1 ATOM 1514 C C . THR A 1 186 ? -10.685 -3.214 14.367 1.00 98.45 186 A 1 ATOM 1515 O O . THR A 1 186 ? -10.033 -4.160 14.809 1.00 98.12 186 A 1 ATOM 1516 C CB . THR A 1 186 ? -10.078 -1.521 16.108 1.00 98.05 186 A 1 ATOM 1517 O OG1 . THR A 1 186 ? -10.564 -0.423 16.841 1.00 96.05 186 A 1 ATOM 1518 C CG2 . THR A 1 186 ? -8.967 -0.978 15.207 1.00 96.32 186 A 1 ATOM 1519 N N . LEU A 1 187 ? -10.899 -3.016 13.064 1.00 98.53 187 A 1 ATOM 1520 C CA . LEU A 1 187 ? -10.253 -3.785 12.002 1.00 98.65 187 A 1 ATOM 1521 C C . LEU A 1 187 ? -8.856 -3.214 11.733 1.00 98.69 187 A 1 ATOM 1522 O O . LEU A 1 187 ? -8.730 -2.066 11.303 1.00 98.53 187 A 1 ATOM 1523 C CB . LEU A 1 187 ? -11.139 -3.754 10.745 1.00 98.63 187 A 1 ATOM 1524 C CG . LEU A 1 187 ? -10.502 -4.422 9.510 1.00 98.39 187 A 1 ATOM 1525 C CD1 . LEU A 1 187 ? -10.288 -5.921 9.708 1.00 98.00 187 A 1 ATOM 1526 C CD2 . LEU A 1 187 ? -11.393 -4.226 8.287 1.00 97.94 187 A 1 ATOM 1527 N N . LEU A 1 188 ? -7.824 -4.029 11.930 1.00 98.66 188 A 1 ATOM 1528 C CA . LEU A 1 188 ? -6.454 -3.709 11.534 1.00 98.58 188 A 1 ATOM 1529 C C . LEU A 1 188 ? -6.225 -4.166 10.089 1.00 98.65 188 A 1 ATOM 1530 O O . LEU A 1 188 ? -6.325 -5.355 9.787 1.00 98.47 188 A 1 ATOM 1531 C CB . LEU A 1 188 ? -5.461 -4.371 12.506 1.00 98.34 188 A 1 ATOM 1532 C CG . LEU A 1 188 ? -5.576 -3.910 13.977 1.00 97.50 188 A 1 ATOM 1533 C CD1 . LEU A 1 188 ? -4.581 -4.690 14.832 1.00 96.34 188 A 1 ATOM 1534 C CD2 . LEU A 1 188 ? -5.293 -2.414 14.140 1.00 96.21 188 A 1 ATOM 1535 N N . VAL A 1 189 ? -5.907 -3.230 9.197 1.00 98.65 189 A 1 ATOM 1536 C CA . VAL A 1 189 ? -5.493 -3.506 7.818 1.00 98.67 189 A 1 ATOM 1537 C C . VAL A 1 189 ? -3.979 -3.348 7.746 1.00 98.56 189 A 1 ATOM 1538 O O . VAL A 1 189 ? -3.450 -2.263 7.985 1.00 98.23 189 A 1 ATOM 1539 C CB . VAL A 1 189 ? -6.222 -2.599 6.813 1.00 98.63 189 A 1 ATOM 1540 C CG1 . VAL A 1 189 ? -5.831 -2.956 5.375 1.00 98.23 189 A 1 ATOM 1541 C CG2 . VAL A 1 189 ? -7.748 -2.726 6.935 1.00 98.24 189 A 1 ATOM 1542 N N . LEU A 1 190 ? -3.280 -4.439 7.452 1.00 98.50 190 A 1 ATOM 1543 C CA . LEU A 1 190 ? -1.833 -4.567 7.546 1.00 98.35 190 A 1 ATOM 1544 C C . LEU A 1 190 ? -1.263 -4.910 6.169 1.00 98.18 190 A 1 ATOM 1545 O O . LEU A 1 190 ? -1.487 -6.005 5.658 1.00 97.60 190 A 1 ATOM 1546 C CB . LEU A 1 190 ? -1.492 -5.656 8.585 1.00 98.20 190 A 1 ATOM 1547 C CG . LEU A 1 190 ? -2.100 -5.452 9.990 1.00 97.59 190 A 1 ATOM 1548 C CD1 . LEU A 1 190 ? -1.882 -6.693 10.852 1.00 96.77 190 A 1 ATOM 1549 C CD2 . LEU A 1 190 ? -1.470 -4.264 10.709 1.00 96.46 190 A 1 ATOM 1550 N N . ASP A 1 191 ? -0.523 -3.989 5.572 1.00 97.68 191 A 1 ATOM 1551 C CA . ASP A 1 191 ? 0.244 -4.205 4.339 1.00 97.14 191 A 1 ATOM 1552 C C . ASP A 1 191 ? 1.722 -3.838 4.554 1.00 96.66 191 A 1 ATOM 1553 O O . ASP A 1 191 ? 2.205 -2.845 3.997 1.00 95.35 191 A 1 ATOM 1554 C CB . ASP A 1 191 ? -0.397 -3.443 3.167 1.00 96.51 191 A 1 ATOM 1555 C CG . ASP A 1 191 ? 0.267 -3.791 1.830 1.00 95.25 191 A 1 ATOM 1556 O OD1 . ASP A 1 191 ? 0.872 -4.883 1.705 1.00 93.45 191 A 1 ATOM 1557 O OD2 . ASP A 1 191 ? 0.077 -3.063 0.823 1.00 92.53 191 A 1 ATOM 1558 N N . PRO A 1 192 ? 2.440 -4.576 5.422 1.00 96.36 192 A 1 ATOM 1559 C CA . PRO A 1 192 ? 3.809 -4.236 5.766 1.00 95.79 192 A 1 ATOM 1560 C C . PRO A 1 192 ? 4.746 -4.396 4.560 1.00 94.87 192 A 1 ATOM 1561 O O . PRO A 1 192 ? 4.498 -5.226 3.675 1.00 93.54 192 A 1 ATOM 1562 C CB . PRO A 1 192 ? 4.192 -5.186 6.904 1.00 95.63 192 A 1 ATOM 1563 C CG . PRO A 1 192 ? 3.359 -6.431 6.603 1.00 95.17 192 A 1 ATOM 1564 C CD . PRO A 1 192 ? 2.065 -5.837 6.057 1.00 96.15 192 A 1 ATOM 1565 N N . PRO A 1 193 ? 5.880 -3.680 4.534 1.00 93.50 193 A 1 ATOM 1566 C CA . PRO A 1 193 ? 6.985 -4.022 3.650 1.00 92.39 193 A 1 ATOM 1567 C C . PRO A 1 193 ? 7.407 -5.489 3.839 1.00 91.84 193 A 1 ATOM 1568 O O . PRO A 1 193 ? 7.365 -6.026 4.943 1.00 90.12 193 A 1 ATOM 1569 C CB . PRO A 1 193 ? 8.123 -3.059 4.006 1.00 90.99 193 A 1 ATOM 1570 C CG . PRO A 1 193 ? 7.414 -1.890 4.691 1.00 89.90 193 A 1 ATOM 1571 C CD . PRO A 1 193 ? 6.238 -2.561 5.391 1.00 92.36 193 A 1 ATOM 1572 N N . TYR A 1 194 ? 7.848 -6.153 2.762 1.00 87.37 194 A 1 ATOM 1573 C CA . TYR A 1 194 ? 8.303 -7.540 2.863 1.00 85.27 194 A 1 ATOM 1574 C C . TYR A 1 194 ? 9.567 -7.654 3.718 1.00 84.80 194 A 1 ATOM 1575 O O . TYR A 1 194 ? 10.536 -6.925 3.504 1.00 80.73 194 A 1 ATOM 1576 C CB . TYR A 1 194 ? 8.520 -8.146 1.471 1.00 81.67 194 A 1 ATOM 1577 C CG . TYR A 1 194 ? 7.261 -8.239 0.622 1.00 79.01 194 A 1 ATOM 1578 C CD1 . TYR A 1 194 ? 6.097 -8.841 1.143 1.00 74.93 194 A 1 ATOM 1579 C CD2 . TYR A 1 194 ? 7.250 -7.721 -0.689 1.00 73.60 194 A 1 ATOM 1580 C CE1 . TYR A 1 194 ? 4.925 -8.922 0.359 1.00 69.13 194 A 1 ATOM 1581 C CE2 . TYR A 1 194 ? 6.081 -7.806 -1.475 1.00 69.29 194 A 1 ATOM 1582 C CZ . TYR A 1 194 ? 4.918 -8.407 -0.952 1.00 67.80 194 A 1 ATOM 1583 O OH . TYR A 1 194 ? 3.790 -8.491 -1.711 1.00 64.66 194 A 1 ATOM 1584 N N . VAL A 1 195 ? 9.570 -8.620 4.643 1.00 83.98 195 A 1 ATOM 1585 C CA . VAL A 1 195 ? 10.790 -9.052 5.329 1.00 81.42 195 A 1 ATOM 1586 C C . VAL A 1 195 ? 11.687 -9.706 4.282 1.00 77.28 195 A 1 ATOM 1587 O O . VAL A 1 195 ? 11.345 -10.747 3.731 1.00 68.40 195 A 1 ATOM 1588 C CB . VAL A 1 195 ? 10.476 -10.017 6.489 1.00 79.90 195 A 1 ATOM 1589 C CG1 . VAL A 1 195 ? 11.755 -10.375 7.249 1.00 75.95 195 A 1 ATOM 1590 C CG2 . VAL A 1 195 ? 9.494 -9.392 7.486 1.00 77.36 195 A 1 ATOM 1591 N N . SER A 1 196 ? 12.807 -9.075 3.947 1.00 70.26 196 A 1 ATOM 1592 C CA . SER A 1 196 ? 13.762 -9.585 2.956 1.00 66.21 196 A 1 ATOM 1593 C C . SER A 1 196 ? 15.134 -9.747 3.599 1.00 65.52 196 A 1 ATOM 1594 O O . SER A 1 196 ? 15.705 -8.789 4.110 1.00 58.66 196 A 1 ATOM 1595 C CB . SER A 1 196 ? 13.829 -8.654 1.743 1.00 59.26 196 A 1 ATOM 1596 O OG . SER A 1 196 ? 14.842 -9.069 0.841 1.00 51.98 196 A 1 ATOM 1597 N N . THR A 1 197 ? 15.701 -10.942 3.503 1.00 59.44 197 A 1 ATOM 1598 C CA . THR A 1 197 ? 17.072 -11.230 3.956 1.00 57.68 197 A 1 ATOM 1599 C C . THR A 1 197 ? 18.149 -10.733 2.986 1.00 57.31 197 A 1 ATOM 1600 O O . THR A 1 197 ? 19.329 -10.742 3.308 1.00 53.43 197 A 1 ATOM 1601 C CB . THR A 1 197 ? 17.224 -12.739 4.188 1.00 52.18 197 A 1 ATOM 1602 O OG1 . THR A 1 197 ? 16.759 -13.431 3.051 1.00 46.74 197 A 1 ATOM 1603 C CG2 . THR A 1 197 ? 16.385 -13.222 5.376 1.00 46.33 197 A 1 ATOM 1604 N N . ALA A 1 198 ? 17.756 -10.271 1.788 1.00 50.51 198 A 1 ATOM 1605 C CA . ALA A 1 198 ? 18.669 -9.999 0.671 1.00 50.66 198 A 1 ATOM 1606 C C . ALA A 1 198 ? 19.075 -8.522 0.483 1.00 51.07 198 A 1 ATOM 1607 O O . ALA A 1 198 ? 19.759 -8.207 -0.492 1.00 47.65 198 A 1 ATOM 1608 C CB . ALA A 1 198 ? 18.052 -10.597 -0.598 1.00 46.07 198 A 1 ATOM 1609 N N . GLN A 1 199 ? 18.667 -7.602 1.352 1.00 54.07 199 A 1 ATOM 1610 C CA . GLN A 1 199 ? 19.066 -6.191 1.246 1.00 54.17 199 A 1 ATOM 1611 C C . GLN A 1 199 ? 20.136 -5.850 2.289 1.00 55.01 199 A 1 ATOM 1612 O O . GLN A 1 199 ? 19.906 -5.938 3.488 1.00 51.46 199 A 1 ATOM 1613 C CB . GLN A 1 199 ? 17.844 -5.267 1.270 1.00 50.55 199 A 1 ATOM 1614 C CG . GLN A 1 199 ? 17.039 -5.400 -0.039 1.00 45.78 199 A 1 ATOM 1615 C CD . GLN A 1 199 ? 15.925 -4.365 -0.186 1.00 42.88 199 A 1 ATOM 1616 O OE1 . GLN A 1 199 ? 15.595 -3.607 0.707 1.00 41.61 199 A 1 ATOM 1617 N NE2 . GLN A 1 199 ? 15.294 -4.288 -1.339 1.00 40.64 199 A 1 ATOM 1618 N N . GLY A 1 200 ? 21.324 -5.509 1.795 1.00 50.97 200 A 1 ATOM 1619 C CA . GLY A 1 200 ? 22.516 -5.254 2.595 1.00 51.43 200 A 1 ATOM 1620 C C . GLY A 1 200 ? 22.317 -4.231 3.720 1.00 52.03 200 A 1 ATOM 1621 O O . GLY A 1 200 ? 21.499 -3.318 3.627 1.00 49.44 200 A 1 ATOM 1622 N N . ALA A 1 201 ? 23.115 -4.382 4.757 1.00 46.83 201 A 1 ATOM 1623 C CA . ALA A 1 201 ? 23.066 -3.786 6.098 1.00 46.58 201 A 1 ATOM 1624 C C . ALA A 1 201 ? 23.232 -2.245 6.204 1.00 47.30 201 A 1 ATOM 1625 O O . ALA A 1 201 ? 23.763 -1.757 7.197 1.00 44.46 201 A 1 ATOM 1626 C CB . ALA A 1 201 ? 24.127 -4.537 6.915 1.00 42.37 201 A 1 ATOM 1627 N N . TYR A 1 202 ? 22.790 -1.454 5.217 1.00 42.92 202 A 1 ATOM 1628 C CA . TYR A 1 202 ? 23.094 -0.016 5.133 1.00 45.78 202 A 1 ATOM 1629 C C . TYR A 1 202 ? 21.885 0.936 5.171 1.00 47.21 202 A 1 ATOM 1630 O O . TYR A 1 202 ? 22.005 2.089 4.778 1.00 44.25 202 A 1 ATOM 1631 C CB . TYR A 1 202 ? 24.074 0.236 3.974 1.00 40.48 202 A 1 ATOM 1632 C CG . TYR A 1 202 ? 25.514 -0.015 4.386 1.00 35.75 202 A 1 ATOM 1633 C CD1 . TYR A 1 202 ? 26.212 0.980 5.103 1.00 32.57 202 A 1 ATOM 1634 C CD2 . TYR A 1 202 ? 26.150 -1.233 4.087 1.00 31.52 202 A 1 ATOM 1635 C CE1 . TYR A 1 202 ? 27.541 0.760 5.512 1.00 30.11 202 A 1 ATOM 1636 C CE2 . TYR A 1 202 ? 27.480 -1.459 4.500 1.00 32.53 202 A 1 ATOM 1637 C CZ . TYR A 1 202 ? 28.179 -0.460 5.209 1.00 33.78 202 A 1 ATOM 1638 O OH . TYR A 1 202 ? 29.463 -0.673 5.605 1.00 33.38 202 A 1 ATOM 1639 N N . ALA A 1 203 ? 20.730 0.500 5.687 1.00 51.23 203 A 1 ATOM 1640 C CA . ALA A 1 203 ? 19.605 1.405 5.975 1.00 52.25 203 A 1 ATOM 1641 C C . ALA A 1 203 ? 18.855 0.996 7.260 1.00 54.40 203 A 1 ATOM 1642 O O . ALA A 1 203 ? 17.651 0.760 7.251 1.00 51.84 203 A 1 ATOM 1643 C CB . ALA A 1 203 ? 18.701 1.494 4.739 1.00 48.60 203 A 1 ATOM 1644 N N . ALA A 1 204 ? 19.579 0.874 8.367 1.00 51.31 204 A 1 ATOM 1645 C CA . ALA A 1 204 ? 19.096 0.263 9.610 1.00 52.81 204 A 1 ATOM 1646 C C . ALA A 1 204 ? 17.863 0.944 10.239 1.00 56.16 204 A 1 ATOM 1647 O O . ALA A 1 204 ? 17.046 0.258 10.842 1.00 52.27 204 A 1 ATOM 1648 C CB . ALA A 1 204 ? 20.273 0.192 10.593 1.00 47.45 204 A 1 ATOM 1649 N N . ASP A 1 205 ? 17.655 2.251 10.044 1.00 56.23 205 A 1 ATOM 1650 C CA . ASP A 1 205 ? 16.605 2.998 10.762 1.00 58.17 205 A 1 ATOM 1651 C C . ASP A 1 205 ? 15.222 3.016 10.080 1.00 59.50 205 A 1 ATOM 1652 O O . ASP A 1 205 ? 14.258 3.521 10.647 1.00 56.59 205 A 1 ATOM 1653 C CB . ASP A 1 205 ? 17.105 4.423 11.058 1.00 55.23 205 A 1 ATOM 1654 C CG . ASP A 1 205 ? 18.270 4.463 12.054 1.00 49.39 205 A 1 ATOM 1655 O OD1 . ASP A 1 205 ? 18.400 3.512 12.849 1.00 46.08 205 A 1 ATOM 1656 O OD2 . ASP A 1 205 ? 19.038 5.443 11.972 1.00 45.87 205 A 1 ATOM 1657 N N . LYS A 1 206 ? 15.087 2.466 8.863 1.00 64.05 206 A 1 ATOM 1658 C CA . LYS A 1 206 ? 13.808 2.436 8.114 1.00 65.36 206 A 1 ATOM 1659 C C . LYS A 1 206 ? 13.428 1.053 7.576 1.00 69.54 206 A 1 ATOM 1660 O O . LYS A 1 206 ? 12.483 0.933 6.797 1.00 64.91 206 A 1 ATOM 1661 C CB . LYS A 1 206 ? 13.809 3.493 6.998 1.00 58.76 206 A 1 ATOM 1662 C CG . LYS A 1 206 ? 13.835 4.919 7.558 1.00 51.72 206 A 1 ATOM 1663 C CD . LYS A 1 206 ? 13.607 5.949 6.449 1.00 48.18 206 A 1 ATOM 1664 C CE . LYS A 1 206 ? 13.603 7.351 7.069 1.00 43.34 206 A 1 ATOM 1665 N NZ . LYS A 1 206 ? 13.259 8.396 6.079 1.00 38.37 206 A 1 ATOM 1666 N N . TYR A 1 207 ? 14.151 0.013 7.957 1.00 74.43 207 A 1 ATOM 1667 C CA . TYR A 1 207 ? 13.947 -1.314 7.397 1.00 77.82 207 A 1 ATOM 1668 C C . TYR A 1 207 ? 12.970 -2.139 8.242 1.00 83.06 207 A 1 ATOM 1669 O O . TYR A 1 207 ? 13.180 -2.353 9.433 1.00 81.16 207 A 1 ATOM 1670 C CB . TYR A 1 207 ? 15.306 -2.002 7.209 1.00 70.35 207 A 1 ATOM 1671 C CG . TYR A 1 207 ? 15.179 -3.238 6.353 1.00 61.76 207 A 1 ATOM 1672 C CD1 . TYR A 1 207 ? 15.247 -4.513 6.937 1.00 57.57 207 A 1 ATOM 1673 C CD2 . TYR A 1 207 ? 14.916 -3.096 4.979 1.00 53.64 207 A 1 ATOM 1674 C CE1 . TYR A 1 207 ? 15.013 -5.650 6.148 1.00 46.04 207 A 1 ATOM 1675 C CE2 . TYR A 1 207 ? 14.673 -4.228 4.191 1.00 48.59 207 A 1 ATOM 1676 C CZ . TYR A 1 207 ? 14.706 -5.504 4.781 1.00 46.65 207 A 1 ATOM 1677 O OH . TYR A 1 207 ? 14.406 -6.578 4.036 1.00 45.58 207 A 1 ATOM 1678 N N . PHE A 1 208 ? 11.896 -2.626 7.607 1.00 85.66 208 A 1 ATOM 1679 C CA . PHE A 1 208 ? 10.970 -3.565 8.234 1.00 87.26 208 A 1 ATOM 1680 C C . PHE A 1 208 ? 11.616 -4.962 8.264 1.00 86.49 208 A 1 ATOM 1681 O O . PHE A 1 208 ? 11.631 -5.689 7.276 1.00 84.74 208 A 1 ATOM 1682 C CB . PHE A 1 208 ? 9.624 -3.533 7.502 1.00 88.85 208 A 1 ATOM 1683 C CG . PHE A 1 208 ? 8.526 -4.259 8.249 1.00 90.35 208 A 1 ATOM 1684 C CD1 . PHE A 1 208 ? 8.237 -5.604 7.958 1.00 89.81 208 A 1 ATOM 1685 C CD2 . PHE A 1 208 ? 7.791 -3.587 9.242 1.00 90.28 208 A 1 ATOM 1686 C CE1 . PHE A 1 208 ? 7.213 -6.270 8.655 1.00 89.91 208 A 1 ATOM 1687 C CE2 . PHE A 1 208 ? 6.767 -4.254 9.938 1.00 90.55 208 A 1 ATOM 1688 C CZ . PHE A 1 208 ? 6.473 -5.594 9.642 1.00 91.57 208 A 1 ATOM 1689 N N . ASN A 1 209 ? 12.217 -5.311 9.397 1.00 88.82 209 A 1 ATOM 1690 C CA . ASN A 1 209 ? 12.967 -6.551 9.604 1.00 89.36 209 A 1 ATOM 1691 C C . ASN A 1 209 ? 12.140 -7.602 10.370 1.00 90.89 209 A 1 ATOM 1692 O O . ASN A 1 209 ? 10.984 -7.364 10.729 1.00 90.91 209 A 1 ATOM 1693 C CB . ASN A 1 209 ? 14.310 -6.191 10.273 1.00 87.49 209 A 1 ATOM 1694 C CG . ASN A 1 209 ? 14.181 -5.620 11.678 1.00 87.21 209 A 1 ATOM 1695 O OD1 . ASN A 1 209 ? 13.297 -5.956 12.447 1.00 83.75 209 A 1 ATOM 1696 N ND2 . ASN A 1 209 ? 15.081 -4.754 12.080 1.00 83.11 209 A 1 ATOM 1697 N N . MET A 1 210 ? 12.739 -8.753 10.666 1.00 88.75 210 A 1 ATOM 1698 C CA . MET A 1 210 ? 12.090 -9.830 11.421 1.00 90.08 210 A 1 ATOM 1699 C C . MET A 1 210 ? 11.570 -9.363 12.792 1.00 91.78 210 A 1 ATOM 1700 O O . MET A 1 210 ? 10.453 -9.700 13.175 1.00 91.86 210 A 1 ATOM 1701 C CB . MET A 1 210 ? 13.081 -11.000 11.580 1.00 88.59 210 A 1 ATOM 1702 C CG . MET A 1 210 ? 12.460 -12.214 12.273 1.00 81.40 210 A 1 ATOM 1703 S SD . MET A 1 210 ? 10.980 -12.890 11.471 1.00 75.06 210 A 1 ATOM 1704 C CE . MET A 1 210 ? 11.724 -13.727 10.042 1.00 63.85 210 A 1 ATOM 1705 N N . VAL A 1 211 ? 12.320 -8.529 13.514 1.00 91.20 211 A 1 ATOM 1706 C CA . VAL A 1 211 ? 11.881 -7.998 14.818 1.00 91.96 211 A 1 ATOM 1707 C C . VAL A 1 211 ? 10.657 -7.094 14.651 1.00 92.97 211 A 1 ATOM 1708 O O . VAL A 1 211 ? 9.715 -7.183 15.437 1.00 93.08 211 A 1 ATOM 1709 C CB . VAL A 1 211 ? 13.023 -7.248 15.528 1.00 91.34 211 A 1 ATOM 1710 C CG1 . VAL A 1 211 ? 12.577 -6.668 16.876 1.00 89.38 211 A 1 ATOM 1711 C CG2 . VAL A 1 211 ? 14.213 -8.182 15.790 1.00 89.20 211 A 1 ATOM 1712 N N . SER A 1 212 ? 10.634 -6.264 13.611 1.00 93.16 212 A 1 ATOM 1713 C CA . SER A 1 212 ? 9.478 -5.432 13.254 1.00 93.39 212 A 1 ATOM 1714 C C . SER A 1 212 ? 8.248 -6.291 12.943 1.00 94.51 212 A 1 ATOM 1715 O O . SER A 1 212 ? 7.160 -6.024 13.455 1.00 94.53 212 A 1 ATOM 1716 C CB . SER A 1 212 ? 9.809 -4.550 12.048 1.00 92.18 212 A 1 ATOM 1717 O OG . SER A 1 212 ? 10.956 -3.755 12.285 1.00 88.82 212 A 1 ATOM 1718 N N . PHE A 1 213 ? 8.428 -7.364 12.174 1.00 93.66 213 A 1 ATOM 1719 C CA . PHE A 1 213 ? 7.374 -8.328 11.877 1.00 94.38 213 A 1 ATOM 1720 C C . PHE A 1 213 ? 6.837 -9.000 13.150 1.00 95.32 213 A 1 ATOM 1721 O O . PHE A 1 213 ? 5.628 -8.993 13.379 1.00 95.46 213 A 1 ATOM 1722 C CB . PHE A 1 213 ? 7.906 -9.358 10.869 1.00 94.14 213 A 1 ATOM 1723 C CG . PHE A 1 213 ? 6.947 -10.501 10.615 1.00 93.85 213 A 1 ATOM 1724 C CD1 . PHE A 1 213 ? 7.126 -11.735 11.273 1.00 92.64 213 A 1 ATOM 1725 C CD2 . PHE A 1 213 ? 5.861 -10.325 9.742 1.00 92.77 213 A 1 ATOM 1726 C CE1 . PHE A 1 213 ? 6.220 -12.788 11.053 1.00 91.95 213 A 1 ATOM 1727 C CE2 . PHE A 1 213 ? 4.956 -11.378 9.523 1.00 91.71 213 A 1 ATOM 1728 C CZ . PHE A 1 213 ? 5.134 -12.608 10.179 1.00 91.41 213 A 1 ATOM 1729 N N . LEU A 1 214 ? 7.708 -9.502 14.019 1.00 94.43 214 A 1 ATOM 1730 C CA . LEU A 1 214 ? 7.300 -10.141 15.277 1.00 94.85 214 A 1 ATOM 1731 C C . LEU A 1 214 ? 6.547 -9.177 16.210 1.00 95.40 214 A 1 ATOM 1732 O O . LEU A 1 214 ? 5.550 -9.569 16.817 1.00 95.27 214 A 1 ATOM 1733 C CB . LEU A 1 214 ? 8.536 -10.726 15.980 1.00 94.77 214 A 1 ATOM 1734 C CG . LEU A 1 214 ? 9.186 -11.926 15.263 1.00 93.55 214 A 1 ATOM 1735 C CD1 . LEU A 1 214 ? 10.458 -12.329 16.010 1.00 92.43 214 A 1 ATOM 1736 C CD2 . LEU A 1 214 ? 8.262 -13.138 15.192 1.00 92.11 214 A 1 ATOM 1737 N N . ARG A 1 215 ? 6.967 -7.910 16.280 1.00 95.38 215 A 1 ATOM 1738 C CA . ARG A 1 215 ? 6.243 -6.864 17.023 1.00 95.19 215 A 1 ATOM 1739 C C . ARG A 1 215 ? 4.856 -6.604 16.435 1.00 95.75 215 A 1 ATOM 1740 O O . ARG A 1 215 ? 3.885 -6.529 17.183 1.00 95.31 215 A 1 ATOM 1741 C CB . ARG A 1 215 ? 7.049 -5.561 17.034 1.00 94.38 215 A 1 ATOM 1742 C CG . ARG A 1 215 ? 8.235 -5.617 18.001 1.00 87.33 215 A 1 ATOM 1743 C CD . ARG A 1 215 ? 9.033 -4.317 17.878 1.00 84.65 215 A 1 ATOM 1744 N NE . ARG A 1 215 ? 10.166 -4.277 18.820 1.00 79.98 215 A 1 ATOM 1745 C CZ . ARG A 1 215 ? 11.062 -3.311 18.908 1.00 74.80 215 A 1 ATOM 1746 N NH1 . ARG A 1 215 ? 11.026 -2.264 18.127 1.00 67.05 215 A 1 ATOM 1747 N NH2 . ARG A 1 215 ? 12.021 -3.377 19.791 1.00 68.59 215 A 1 ATOM 1748 N N . MET A 1 216 ? 4.745 -6.513 15.113 1.00 96.22 216 A 1 ATOM 1749 C CA . MET A 1 216 ? 3.454 -6.377 14.434 1.00 96.62 216 A 1 ATOM 1750 C C . MET A 1 216 ? 2.524 -7.551 14.785 1.00 96.89 216 A 1 ATOM 1751 O O . MET A 1 216 ? 1.379 -7.343 15.183 1.00 96.59 216 A 1 ATOM 1752 C CB . MET A 1 216 ? 3.687 -6.285 12.919 1.00 96.50 216 A 1 ATOM 1753 C CG . MET A 1 216 ? 2.388 -6.117 12.130 1.00 95.87 216 A 1 ATOM 1754 S SD . MET A 1 216 ? 2.551 -6.429 10.356 1.00 95.25 216 A 1 ATOM 1755 C CE . MET A 1 216 ? 2.747 -8.233 10.368 1.00 91.64 216 A 1 ATOM 1756 N N . ILE A 1 217 ? 3.031 -8.783 14.714 1.00 96.39 217 A 1 ATOM 1757 C CA . ILE A 1 217 ? 2.268 -9.980 15.084 1.00 96.31 217 A 1 ATOM 1758 C C . ILE A 1 217 ? 1.869 -9.961 16.563 1.00 96.54 217 A 1 ATOM 1759 O O . ILE A 1 217 ? 0.774 -10.406 16.894 1.00 95.99 217 A 1 ATOM 1760 C CB . ILE A 1 217 ? 3.057 -11.254 14.728 1.00 95.66 217 A 1 ATOM 1761 C CG1 . ILE A 1 217 ? 3.287 -11.403 13.203 1.00 93.17 217 A 1 ATOM 1762 C CG2 . ILE A 1 217 ? 2.362 -12.512 15.280 1.00 93.55 217 A 1 ATOM 1763 C CD1 . ILE A 1 217 ? 2.048 -11.633 12.344 1.00 86.09 217 A 1 ATOM 1764 N N . GLN A 1 218 ? 2.691 -9.422 17.454 1.00 96.12 218 A 1 ATOM 1765 C CA . GLN A 1 218 ? 2.356 -9.315 18.876 1.00 95.60 218 A 1 ATOM 1766 C C . GLN A 1 218 ? 1.074 -8.504 19.107 1.00 96.00 218 A 1 ATOM 1767 O O . GLN A 1 218 ? 0.218 -8.941 19.877 1.00 95.04 218 A 1 ATOM 1768 C CB . GLN A 1 218 ? 3.551 -8.730 19.636 1.00 94.20 218 A 1 ATOM 1769 C CG . GLN A 1 218 ? 3.304 -8.676 21.152 1.00 78.82 218 A 1 ATOM 1770 C CD . GLN A 1 218 ? 4.508 -8.154 21.933 1.00 72.03 218 A 1 ATOM 1771 O OE1 . GLN A 1 218 ? 5.595 -7.948 21.424 1.00 64.63 218 A 1 ATOM 1772 N NE2 . GLN A 1 218 ? 4.362 -7.936 23.220 1.00 59.88 218 A 1 ATOM 1773 N N . TYR A 1 219 ? 0.914 -7.378 18.406 1.00 95.73 219 A 1 ATOM 1774 C CA . TYR A 1 219 ? -0.278 -6.523 18.505 1.00 95.59 219 A 1 ATOM 1775 C C . TYR A 1 219 ? -1.451 -6.997 17.640 1.00 95.91 219 A 1 ATOM 1776 O O . TYR A 1 219 ? -2.600 -6.609 17.875 1.00 94.43 219 A 1 ATOM 1777 C CB . TYR A 1 219 ? 0.104 -5.088 18.133 1.00 94.92 219 A 1 ATOM 1778 C CG . TYR A 1 219 ? 1.104 -4.452 19.074 1.00 93.75 219 A 1 ATOM 1779 C CD1 . TYR A 1 219 ? 0.762 -4.256 20.426 1.00 89.58 219 A 1 ATOM 1780 C CD2 . TYR A 1 219 ? 2.367 -4.047 18.606 1.00 89.87 219 A 1 ATOM 1781 C CE1 . TYR A 1 219 ? 1.683 -3.666 21.307 1.00 87.60 219 A 1 ATOM 1782 C CE2 . TYR A 1 219 ? 3.290 -3.453 19.486 1.00 88.19 219 A 1 ATOM 1783 C CZ . TYR A 1 219 ? 2.949 -3.263 20.839 1.00 88.20 219 A 1 ATOM 1784 O OH . TYR A 1 219 ? 3.838 -2.688 21.691 1.00 85.73 219 A 1 ATOM 1785 N N . MET A 1 220 ? -1.193 -7.825 16.635 1.00 95.87 220 A 1 ATOM 1786 C CA . MET A 1 220 ? -2.229 -8.292 15.721 1.00 96.06 220 A 1 ATOM 1787 C C . MET A 1 220 ? -3.198 -9.243 16.425 1.00 95.91 220 A 1 ATOM 1788 O O . MET A 1 220 ? -2.792 -10.211 17.069 1.00 94.37 220 A 1 ATOM 1789 C CB . MET A 1 220 ? -1.583 -8.928 14.485 1.00 95.55 220 A 1 ATOM 1790 C CG . MET A 1 220 ? -2.612 -9.190 13.382 1.00 92.88 220 A 1 ATOM 1791 S SD . MET A 1 220 ? -1.881 -9.823 11.853 1.00 93.18 220 A 1 ATOM 1792 C CE . MET A 1 220 ? -1.601 -11.539 12.321 1.00 85.72 220 A 1 ATOM 1793 N N . ARG A 1 221 ? -4.494 -8.984 16.276 1.00 96.44 221 A 1 ATOM 1794 C CA . ARG A 1 221 ? -5.596 -9.803 16.788 1.00 96.06 221 A 1 ATOM 1795 C C . ARG A 1 221 ? -6.836 -9.607 15.906 1.00 97.02 221 A 1 ATOM 1796 O O . ARG A 1 221 ? -6.916 -8.574 15.233 1.00 96.24 221 A 1 ATOM 1797 C CB . ARG A 1 221 ? -5.829 -9.463 18.278 1.00 93.06 221 A 1 ATOM 1798 C CG . ARG A 1 221 ? -6.136 -7.977 18.585 1.00 84.72 221 A 1 ATOM 1799 C CD . ARG A 1 221 ? -7.627 -7.669 18.461 1.00 79.49 221 A 1 ATOM 1800 N NE . ARG A 1 221 ? -7.896 -6.234 18.548 1.00 76.22 221 A 1 ATOM 1801 C CZ . ARG A 1 221 ? -8.860 -5.597 17.915 1.00 69.87 221 A 1 ATOM 1802 N NH1 . ARG A 1 221 ? -9.741 -6.194 17.161 1.00 60.79 221 A 1 ATOM 1803 N NH2 . ARG A 1 221 ? -8.952 -4.312 18.014 1.00 64.04 221 A 1 ATOM 1804 N N . PRO A 1 222 ? -7.808 -10.535 15.889 1.00 96.92 222 A 1 ATOM 1805 C CA . PRO A 1 222 ? -9.066 -10.317 15.177 1.00 97.11 222 A 1 ATOM 1806 C C . PRO A 1 222 ? -9.828 -9.090 15.706 1.00 97.45 222 A 1 ATOM 1807 O O . PRO A 1 222 ? -9.824 -8.845 16.915 1.00 96.73 222 A 1 ATOM 1808 C CB . PRO A 1 222 ? -9.873 -11.606 15.342 1.00 96.13 222 A 1 ATOM 1809 C CG . PRO A 1 222 ? -8.807 -12.648 15.654 1.00 93.98 222 A 1 ATOM 1810 C CD . PRO A 1 222 ? -7.770 -11.865 16.449 1.00 96.07 222 A 1 ATOM 1811 N N . PRO A 1 223 ? -10.508 -8.340 14.829 1.00 97.91 223 A 1 ATOM 1812 C CA . PRO A 1 223 ? -10.517 -8.456 13.374 1.00 98.17 223 A 1 ATOM 1813 C C . PRO A 1 223 ? -9.240 -7.909 12.709 1.00 98.45 223 A 1 ATOM 1814 O O . PRO A 1 223 ? -8.750 -6.837 13.069 1.00 98.23 223 A 1 ATOM 1815 C CB . PRO A 1 223 ? -11.763 -7.690 12.930 1.00 97.48 223 A 1 ATOM 1816 C CG . PRO A 1 223 ? -11.938 -6.638 14.019 1.00 95.27 223 A 1 ATOM 1817 C CD . PRO A 1 223 ? -11.473 -7.346 15.275 1.00 97.41 223 A 1 ATOM 1818 N N . PHE A 1 224 ? -8.718 -8.629 11.710 1.00 98.26 224 A 1 ATOM 1819 C CA . PHE A 1 224 ? -7.575 -8.181 10.911 1.00 98.39 224 A 1 ATOM 1820 C C . PHE A 1 224 ? -7.671 -8.592 9.437 1.00 98.56 224 A 1 ATOM 1821 O O . PHE A 1 224 ? -8.326 -9.575 9.082 1.00 98.47 224 A 1 ATOM 1822 C CB . PHE A 1 224 ? -6.249 -8.667 11.518 1.00 98.20 224 A 1 ATOM 1823 C CG . PHE A 1 224 ? -5.978 -10.154 11.356 1.00 98.16 224 A 1 ATOM 1824 C CD1 . PHE A 1 224 ? -6.350 -11.052 12.371 1.00 97.73 224 A 1 ATOM 1825 C CD2 . PHE A 1 224 ? -5.366 -10.645 10.188 1.00 97.59 224 A 1 ATOM 1826 C CE1 . PHE A 1 224 ? -6.120 -12.429 12.220 1.00 97.11 224 A 1 ATOM 1827 C CE2 . PHE A 1 224 ? -5.137 -12.030 10.034 1.00 97.04 224 A 1 ATOM 1828 C CZ . PHE A 1 224 ? -5.516 -12.923 11.050 1.00 97.02 224 A 1 ATOM 1829 N N . ILE A 1 225 ? -6.953 -7.861 8.594 1.00 98.53 225 A 1 ATOM 1830 C CA . ILE A 1 225 ? -6.584 -8.227 7.225 1.00 98.61 225 A 1 ATOM 1831 C C . ILE A 1 225 ? -5.074 -8.017 7.108 1.00 98.52 225 A 1 ATOM 1832 O O . ILE A 1 225 ? -4.600 -6.904 7.308 1.00 98.33 225 A 1 ATOM 1833 C CB . ILE A 1 225 ? -7.355 -7.388 6.182 1.00 98.65 225 A 1 ATOM 1834 C CG1 . ILE A 1 225 ? -8.875 -7.617 6.304 1.00 98.32 225 A 1 ATOM 1835 C CG2 . ILE A 1 225 ? -6.869 -7.720 4.756 1.00 98.37 225 A 1 ATOM 1836 C CD1 . ILE A 1 225 ? -9.727 -6.669 5.450 1.00 97.42 225 A 1 ATOM 1837 N N . LEU A 1 226 ? -4.334 -9.064 6.770 1.00 98.37 226 A 1 ATOM 1838 C CA . LEU A 1 226 ? -2.893 -9.028 6.544 1.00 98.21 226 A 1 ATOM 1839 C C . LEU A 1 226 ? -2.606 -9.342 5.076 1.00 98.19 226 A 1 ATOM 1840 O O . LEU A 1 226 ? -2.932 -10.425 4.589 1.00 97.77 226 A 1 ATOM 1841 C CB . LEU A 1 226 ? -2.205 -10.016 7.506 1.00 97.84 226 A 1 ATOM 1842 C CG . LEU A 1 226 ? -0.695 -10.212 7.259 1.00 97.19 226 A 1 ATOM 1843 C CD1 . LEU A 1 226 ? 0.102 -8.930 7.502 1.00 96.16 226 A 1 ATOM 1844 C CD2 . LEU A 1 226 ? -0.149 -11.299 8.179 1.00 96.01 226 A 1 ATOM 1845 N N . PHE A 1 227 ? -1.955 -8.411 4.376 1.00 97.75 227 A 1 ATOM 1846 C CA . PHE A 1 227 ? -1.386 -8.669 3.061 1.00 97.40 227 A 1 ATOM 1847 C C . PHE A 1 227 ? 0.025 -9.240 3.204 1.00 96.65 227 A 1 ATOM 1848 O O . PHE A 1 227 ? 0.837 -8.771 3.998 1.00 95.77 227 A 1 ATOM 1849 C CB . PHE A 1 227 ? -1.429 -7.409 2.198 1.00 97.49 227 A 1 ATOM 1850 C CG . PHE A 1 227 ? -2.840 -6.957 1.874 1.00 97.87 227 A 1 ATOM 1851 C CD1 . PHE A 1 227 ? -3.522 -7.508 0.774 1.00 97.46 227 A 1 ATOM 1852 C CD2 . PHE A 1 227 ? -3.482 -6.010 2.693 1.00 97.43 227 A 1 ATOM 1853 C CE1 . PHE A 1 227 ? -4.839 -7.106 0.486 1.00 97.28 227 A 1 ATOM 1854 C CE2 . PHE A 1 227 ? -4.800 -5.612 2.408 1.00 97.29 227 A 1 ATOM 1855 C CZ . PHE A 1 227 ? -5.478 -6.158 1.303 1.00 97.65 227 A 1 ATOM 1856 N N . SER A 1 228 ? 0.300 -10.279 2.429 1.00 96.32 228 A 1 ATOM 1857 C CA . SER A 1 228 ? 1.572 -10.994 2.426 1.00 95.45 228 A 1 ATOM 1858 C C . SER A 1 228 ? 1.825 -11.569 1.027 1.00 95.01 228 A 1 ATOM 1859 O O . SER A 1 228 ? 1.053 -11.330 0.098 1.00 93.24 228 A 1 ATOM 1860 C CB . SER A 1 228 ? 1.516 -12.078 3.509 1.00 94.22 228 A 1 ATOM 1861 O OG . SER A 1 228 ? 2.760 -12.724 3.638 1.00 87.75 228 A 1 ATOM 1862 N N . SER A 1 229 ? 2.895 -12.312 0.848 1.00 93.39 229 A 1 ATOM 1863 C CA . SER A 1 229 ? 3.145 -13.094 -0.362 1.00 91.87 229 A 1 ATOM 1864 C C . SER A 1 229 ? 3.925 -14.359 -0.029 1.00 91.56 229 A 1 ATOM 1865 O O . SER A 1 229 ? 4.466 -14.484 1.066 1.00 89.30 229 A 1 ATOM 1866 C CB . SER A 1 229 ? 3.893 -12.251 -1.401 1.00 88.92 229 A 1 ATOM 1867 O OG . SER A 1 229 ? 5.231 -12.001 -1.002 1.00 81.77 229 A 1 ATOM 1868 N N . THR A 1 230 ? 4.069 -15.274 -0.993 1.00 90.57 230 A 1 ATOM 1869 C CA . THR A 1 230 ? 4.970 -16.439 -0.867 1.00 89.38 230 A 1 ATOM 1870 C C . THR A 1 230 ? 6.451 -16.066 -0.732 1.00 88.56 230 A 1 ATOM 1871 O O . THR A 1 230 ? 7.291 -16.926 -0.505 1.00 85.44 230 A 1 ATOM 1872 C CB . THR A 1 230 ? 4.811 -17.388 -2.062 1.00 88.29 230 A 1 ATOM 1873 O OG1 . THR A 1 230 ? 4.975 -16.679 -3.267 1.00 84.53 230 A 1 ATOM 1874 C CG2 . THR A 1 230 ? 3.437 -18.046 -2.079 1.00 83.36 230 A 1 ATOM 1875 N N . ARG A 1 231 ? 6.794 -14.778 -0.864 1.00 88.30 231 A 1 ATOM 1876 C CA . ARG A 1 231 ? 8.137 -14.230 -0.611 1.00 85.31 231 A 1 ATOM 1877 C C . ARG A 1 231 ? 8.299 -13.699 0.817 1.00 85.74 231 A 1 ATOM 1878 O O . ARG A 1 231 ? 9.365 -13.194 1.157 1.00 81.04 231 A 1 ATOM 1879 C CB . ARG A 1 231 ? 8.461 -13.132 -1.634 1.00 83.02 231 A 1 ATOM 1880 C CG . ARG A 1 231 ? 8.204 -13.570 -3.084 1.00 79.72 231 A 1 ATOM 1881 C CD . ARG A 1 231 ? 8.573 -12.457 -4.076 1.00 74.44 231 A 1 ATOM 1882 N NE . ARG A 1 231 ? 10.017 -12.423 -4.338 1.00 69.22 231 A 1 ATOM 1883 C CZ . ARG A 1 231 ? 10.673 -11.491 -5.007 1.00 61.57 231 A 1 ATOM 1884 N NH1 . ARG A 1 231 ? 10.081 -10.421 -5.453 1.00 58.04 231 A 1 ATOM 1885 N NH2 . ARG A 1 231 ? 11.948 -11.634 -5.246 1.00 54.54 231 A 1 ATOM 1886 N N . SER A 1 232 ? 7.242 -13.758 1.608 1.00 85.80 232 A 1 ATOM 1887 C CA . SER A 1 232 ? 7.191 -13.376 3.017 1.00 85.61 232 A 1 ATOM 1888 C C . SER A 1 232 ? 6.904 -14.622 3.846 1.00 86.59 232 A 1 ATOM 1889 O O . SER A 1 232 ? 6.042 -15.417 3.486 1.00 82.72 232 A 1 ATOM 1890 C CB . SER A 1 232 ? 6.093 -12.334 3.216 1.00 82.58 232 A 1 ATOM 1891 O OG . SER A 1 232 ? 5.868 -12.055 4.583 1.00 73.59 232 A 1 ATOM 1892 N N . GLU A 1 233 ? 7.567 -14.743 4.985 1.00 85.84 233 A 1 ATOM 1893 C CA . GLU A 1 233 ? 7.456 -15.903 5.880 1.00 87.00 233 A 1 ATOM 1894 C C . GLU A 1 233 ? 6.190 -15.876 6.764 1.00 90.09 233 A 1 ATOM 1895 O O . GLU A 1 233 ? 6.101 -16.584 7.758 1.00 88.75 233 A 1 ATOM 1896 C CB . GLU A 1 233 ? 8.740 -15.997 6.721 1.00 81.84 233 A 1 ATOM 1897 C CG . GLU A 1 233 ? 10.006 -16.192 5.863 1.00 75.43 233 A 1 ATOM 1898 C CD . GLU A 1 233 ? 11.315 -16.122 6.671 1.00 68.97 233 A 1 ATOM 1899 O OE1 . GLU A 1 233 ? 12.355 -16.533 6.113 1.00 62.85 233 A 1 ATOM 1900 O OE2 . GLU A 1 233 ? 11.305 -15.546 7.784 1.00 61.74 233 A 1 ATOM 1901 N N . ALA A 1 234 ? 5.186 -15.055 6.450 1.00 91.20 234 A 1 ATOM 1902 C CA . ALA A 1 234 ? 4.022 -14.893 7.325 1.00 92.53 234 A 1 ATOM 1903 C C . ALA A 1 234 ? 3.194 -16.183 7.477 1.00 93.93 234 A 1 ATOM 1904 O O . ALA A 1 234 ? 2.738 -16.481 8.580 1.00 93.76 234 A 1 ATOM 1905 C CB . ALA A 1 234 ? 3.153 -13.744 6.801 1.00 91.76 234 A 1 ATOM 1906 N N . LEU A 1 235 ? 2.994 -16.943 6.391 1.00 93.92 235 A 1 ATOM 1907 C CA . LEU A 1 235 ? 2.278 -18.226 6.449 1.00 94.35 235 A 1 ATOM 1908 C C . LEU A 1 235 ? 3.110 -19.299 7.159 1.00 94.95 235 A 1 ATOM 1909 O O . LEU A 1 235 ? 2.573 -19.998 8.015 1.00 94.58 235 A 1 ATOM 1910 C CB . LEU A 1 235 ? 1.872 -18.676 5.034 1.00 93.99 235 A 1 ATOM 1911 C CG . LEU A 1 235 ? 0.763 -17.825 4.386 1.00 92.65 235 A 1 ATOM 1912 C CD1 . LEU A 1 235 ? 0.502 -18.315 2.959 1.00 91.05 235 A 1 ATOM 1913 C CD2 . LEU A 1 235 ? -0.561 -17.904 5.152 1.00 91.05 235 A 1 ATOM 1914 N N . ASP A 1 236 ? 4.413 -19.361 6.877 1.00 94.05 236 A 1 ATOM 1915 C CA . ASP A 1 236 ? 5.343 -20.272 7.560 1.00 94.02 236 A 1 ATOM 1916 C C . ASP A 1 236 ? 5.398 -19.969 9.060 1.00 95.20 236 A 1 ATOM 1917 O O . ASP A 1 236 ? 5.380 -20.873 9.894 1.00 95.05 236 A 1 ATOM 1918 C CB . ASP A 1 236 ? 6.746 -20.142 6.945 1.00 92.87 236 A 1 ATOM 1919 C CG . ASP A 1 236 ? 6.814 -20.521 5.464 1.00 89.77 236 A 1 ATOM 1920 O OD1 . ASP A 1 236 ? 5.941 -21.289 5.002 1.00 85.92 236 A 1 ATOM 1921 O OD2 . ASP A 1 236 ? 7.720 -19.990 4.788 1.00 84.30 236 A 1 ATOM 1922 N N . TYR A 1 237 ? 5.370 -18.688 9.423 1.00 94.31 237 A 1 ATOM 1923 C CA . TYR A 1 237 ? 5.291 -18.277 10.818 1.00 94.84 237 A 1 ATOM 1924 C C . TYR A 1 237 ? 3.974 -18.700 11.486 1.00 95.76 237 A 1 ATOM 1925 O O . TYR A 1 237 ? 3.983 -19.126 12.634 1.00 95.87 237 A 1 ATOM 1926 C CB . TYR A 1 237 ? 5.508 -16.767 10.917 1.00 94.63 237 A 1 ATOM 1927 C CG . TYR A 1 237 ? 5.525 -16.296 12.353 1.00 94.26 237 A 1 ATOM 1928 C CD1 . TYR A 1 237 ? 4.423 -15.605 12.888 1.00 92.70 237 A 1 ATOM 1929 C CD2 . TYR A 1 237 ? 6.625 -16.604 13.176 1.00 92.82 237 A 1 ATOM 1930 C CE1 . TYR A 1 237 ? 4.425 -15.215 14.240 1.00 91.89 237 A 1 ATOM 1931 C CE2 . TYR A 1 237 ? 6.630 -16.221 14.528 1.00 91.67 237 A 1 ATOM 1932 C CZ . TYR A 1 237 ? 5.529 -15.524 15.060 1.00 91.54 237 A 1 ATOM 1933 O OH . TYR A 1 237 ? 5.528 -15.153 16.369 1.00 90.26 237 A 1 ATOM 1934 N N . PHE A 1 238 ? 2.834 -18.634 10.797 1.00 95.80 238 A 1 ATOM 1935 C CA . PHE A 1 238 ? 1.566 -19.135 11.346 1.00 96.34 238 A 1 ATOM 1936 C C . PHE A 1 238 ? 1.579 -20.655 11.522 1.00 96.98 238 A 1 ATOM 1937 O O . PHE A 1 238 ? 1.071 -21.142 12.534 1.00 96.71 238 A 1 ATOM 1938 C CB . PHE A 1 238 ? 0.384 -18.705 10.469 1.00 95.95 238 A 1 ATOM 1939 C CG . PHE A 1 238 ? -0.051 -17.249 10.561 1.00 95.61 238 A 1 ATOM 1940 C CD1 . PHE A 1 238 ? 0.621 -16.298 11.354 1.00 92.30 238 A 1 ATOM 1941 C CD2 . PHE A 1 238 ? -1.192 -16.850 9.838 1.00 91.90 238 A 1 ATOM 1942 C CE1 . PHE A 1 238 ? 0.172 -14.968 11.411 1.00 90.64 238 A 1 ATOM 1943 C CE2 . PHE A 1 238 ? -1.642 -15.523 9.896 1.00 91.07 238 A 1 ATOM 1944 C CZ . PHE A 1 238 ? -0.960 -14.581 10.678 1.00 92.21 238 A 1 ATOM 1945 N N . GLN A 1 239 ? 2.199 -21.385 10.597 1.00 96.22 239 A 1 ATOM 1946 C CA . GLN A 1 239 ? 2.423 -22.825 10.730 1.00 96.23 239 A 1 ATOM 1947 C C . GLN A 1 239 ? 3.311 -23.135 11.943 1.00 96.91 239 A 1 ATOM 1948 O O . GLN A 1 239 ? 2.936 -23.948 12.788 1.00 96.96 239 A 1 ATOM 1949 C CB . GLN A 1 239 ? 3.024 -23.358 9.415 1.00 95.72 239 A 1 ATOM 1950 C CG . GLN A 1 239 ? 3.158 -24.887 9.406 1.00 85.39 239 A 1 ATOM 1951 C CD . GLN A 1 239 ? 1.817 -25.609 9.503 1.00 79.42 239 A 1 ATOM 1952 O OE1 . GLN A 1 239 ? 0.773 -25.139 9.073 1.00 72.10 239 A 1 ATOM 1953 N NE2 . GLN A 1 239 ? 1.793 -26.791 10.063 1.00 67.30 239 A 1 ATOM 1954 N N . PHE A 1 240 ? 4.424 -22.416 12.109 1.00 95.97 240 A 1 ATOM 1955 C CA . PHE A 1 240 ? 5.282 -22.517 13.291 1.00 96.08 240 A 1 ATOM 1956 C C . PHE A 1 240 ? 4.503 -22.263 14.592 1.00 96.84 240 A 1 ATOM 1957 O O . PHE A 1 240 ? 4.628 -23.026 15.546 1.00 96.89 240 A 1 ATOM 1958 C CB . PHE A 1 240 ? 6.451 -21.530 13.156 1.00 95.73 240 A 1 ATOM 1959 C CG . PHE A 1 240 ? 7.228 -21.339 14.444 1.00 94.77 240 A 1 ATOM 1960 C CD1 . PHE A 1 240 ? 6.908 -20.278 15.316 1.00 93.25 240 A 1 ATOM 1961 C CD2 . PHE A 1 240 ? 8.219 -22.267 14.809 1.00 93.92 240 A 1 ATOM 1962 C CE1 . PHE A 1 240 ? 7.575 -20.150 16.547 1.00 92.58 240 A 1 ATOM 1963 C CE2 . PHE A 1 240 ? 8.887 -22.138 16.038 1.00 92.53 240 A 1 ATOM 1964 C CZ . PHE A 1 240 ? 8.563 -21.080 16.909 1.00 92.38 240 A 1 ATOM 1965 N N . LEU A 1 241 ? 3.673 -21.217 14.641 1.00 96.50 241 A 1 ATOM 1966 C CA . LEU A 1 241 ? 2.842 -20.952 15.817 1.00 96.59 241 A 1 ATOM 1967 C C . LEU A 1 241 ? 1.861 -22.094 16.091 1.00 97.21 241 A 1 ATOM 1968 O O . LEU A 1 241 ? 1.666 -22.453 17.242 1.00 97.11 241 A 1 ATOM 1969 C CB . LEU A 1 241 ? 2.059 -19.641 15.652 1.00 96.28 241 A 1 ATOM 1970 C CG . LEU A 1 241 ? 2.859 -18.336 15.766 1.00 94.99 241 A 1 ATOM 1971 C CD1 . LEU A 1 241 ? 1.872 -17.173 15.617 1.00 93.34 241 A 1 ATOM 1972 C CD2 . LEU A 1 241 ? 3.567 -18.193 17.115 1.00 93.03 241 A 1 ATOM 1973 N N . GLN A 1 242 ? 1.252 -22.674 15.053 1.00 96.93 242 A 1 ATOM 1974 C CA . GLN A 1 242 ? 0.326 -23.793 15.202 1.00 97.12 242 A 1 ATOM 1975 C C . GLN A 1 242 ? 1.009 -25.022 15.813 1.00 97.48 242 A 1 ATOM 1976 O O . GLN A 1 242 ? 0.425 -25.684 16.671 1.00 97.10 242 A 1 ATOM 1977 C CB . GLN A 1 242 ? -0.290 -24.110 13.838 1.00 96.65 242 A 1 ATOM 1978 C CG . GLN A 1 242 ? -1.398 -25.163 13.944 1.00 92.96 242 A 1 ATOM 1979 C CD . GLN A 1 242 ? -2.092 -25.440 12.613 1.00 91.24 242 A 1 ATOM 1980 O OE1 . GLN A 1 242 ? -1.770 -24.928 11.555 1.00 84.75 242 A 1 ATOM 1981 N NE2 . GLN A 1 242 ? -3.110 -26.268 12.612 1.00 80.80 242 A 1 ATOM 1982 N N . GLU A 1 243 ? 2.246 -25.307 15.388 1.00 96.71 243 A 1 ATOM 1983 C CA . GLU A 1 243 ? 3.016 -26.478 15.819 1.00 96.73 243 A 1 ATOM 1984 C C . GLU A 1 243 ? 3.695 -26.283 17.180 1.00 97.19 243 A 1 ATOM 1985 O O . GLU A 1 243 ? 3.643 -27.165 18.033 1.00 96.28 243 A 1 ATOM 1986 C CB . GLU A 1 243 ? 4.070 -26.794 14.752 1.00 96.33 243 A 1 ATOM 1987 C CG . GLU A 1 243 ? 3.441 -27.319 13.452 1.00 91.88 243 A 1 ATOM 1988 C CD . GLU A 1 243 ? 4.454 -27.493 12.312 1.00 91.26 243 A 1 ATOM 1989 O OE1 . GLU A 1 243 ? 3.985 -27.778 11.189 1.00 82.83 243 A 1 ATOM 1990 O OE2 . GLU A 1 243 ? 5.674 -27.347 12.553 1.00 85.51 243 A 1 ATOM 1991 N N . CYS A 1 244 ? 4.336 -25.128 17.378 1.00 97.19 244 A 1 ATOM 1992 C CA . CYS A 1 244 ? 5.246 -24.900 18.501 1.00 96.91 244 A 1 ATOM 1993 C C . CYS A 1 244 ? 4.654 -24.021 19.612 1.00 97.13 244 A 1 ATOM 1994 O O . CYS A 1 244 ? 5.119 -24.076 20.747 1.00 96.01 244 A 1 ATOM 1995 C CB . CYS A 1 244 ? 6.541 -24.286 17.955 1.00 96.49 244 A 1 ATOM 1996 S SG . CYS A 1 244 ? 7.336 -25.408 16.759 1.00 93.71 244 A 1 ATOM 1997 N N . GLU A 1 245 ? 3.648 -23.191 19.299 1.00 96.91 245 A 1 ATOM 1998 C CA . GLU A 1 245 ? 3.098 -22.173 20.206 1.00 96.36 245 A 1 ATOM 1999 C C . GLU A 1 245 ? 1.558 -22.105 20.081 1.00 96.94 245 A 1 ATOM 2000 O O . GLU A 1 245 ? 0.981 -21.048 19.785 1.00 95.88 245 A 1 ATOM 2001 C CB . GLU A 1 245 ? 3.767 -20.821 19.892 1.00 95.36 245 A 1 ATOM 2002 C CG . GLU A 1 245 ? 5.281 -20.769 20.214 1.00 92.20 245 A 1 ATOM 2003 C CD . GLU A 1 245 ? 5.580 -20.380 21.668 1.00 89.93 245 A 1 ATOM 2004 O OE1 . GLU A 1 245 ? 6.739 -19.977 21.919 1.00 80.38 245 A 1 ATOM 2005 O OE2 . GLU A 1 245 ? 4.650 -20.182 22.480 1.00 81.36 245 A 1 ATOM 2006 N N . PRO A 1 246 ? 0.835 -23.228 20.293 1.00 97.19 246 A 1 ATOM 2007 C CA . PRO A 1 246 ? -0.598 -23.348 20.001 1.00 96.93 246 A 1 ATOM 2008 C C . PRO A 1 246 ? -1.468 -22.337 20.761 1.00 96.85 246 A 1 ATOM 2009 O O . PRO A 1 246 ? -2.488 -21.881 20.239 1.00 95.96 246 A 1 ATOM 2010 C CB . PRO A 1 246 ? -0.959 -24.797 20.355 1.00 96.60 246 A 1 ATOM 2011 C CG . PRO A 1 246 ? 0.130 -25.226 21.340 1.00 94.88 246 A 1 ATOM 2012 C CD . PRO A 1 246 ? 1.352 -24.486 20.824 1.00 97.14 246 A 1 ATOM 2013 N N . ASP A 1 247 ? -1.052 -21.913 21.956 1.00 96.47 247 A 1 ATOM 2014 C CA . ASP A 1 247 ? -1.773 -20.886 22.718 1.00 95.67 247 A 1 ATOM 2015 C C . ASP A 1 247 ? -1.684 -19.501 22.060 1.00 95.30 247 A 1 ATOM 2016 O O . ASP A 1 247 ? -2.677 -18.766 22.036 1.00 93.83 247 A 1 ATOM 2017 C CB . ASP A 1 247 ? -1.251 -20.837 24.155 1.00 95.23 247 A 1 ATOM 2018 C CG . ASP A 1 247 ? -1.699 -22.052 24.977 1.00 90.21 247 A 1 ATOM 2019 O OD1 . ASP A 1 247 ? -2.853 -22.516 24.755 1.00 84.82 247 A 1 ATOM 2020 O OD2 . ASP A 1 247 ? -0.916 -22.458 25.853 1.00 85.87 247 A 1 ATOM 2021 N N . LYS A 1 248 ? -0.531 -19.158 21.460 1.00 95.58 248 A 1 ATOM 2022 C CA . LYS A 1 248 ? -0.370 -17.922 20.672 1.00 94.44 248 A 1 ATOM 2023 C C . LYS A 1 248 ? -1.109 -18.021 19.340 1.00 94.93 248 A 1 ATOM 2024 O O . LYS A 1 248 ? -1.666 -17.021 18.890 1.00 93.87 248 A 1 ATOM 2025 C CB . LYS A 1 248 ? 1.115 -17.608 20.425 1.00 93.46 248 A 1 ATOM 2026 C CG . LYS A 1 248 ? 1.889 -17.270 21.707 1.00 90.24 248 A 1 ATOM 2027 C CD . LYS A 1 248 ? 3.363 -16.977 21.381 1.00 87.00 248 A 1 ATOM 2028 C CE . LYS A 1 248 ? 4.191 -16.872 22.671 1.00 82.93 248 A 1 ATOM 2029 N NZ . LYS A 1 248 ? 5.560 -17.410 22.486 1.00 75.78 248 A 1 ATOM 2030 N N . TYR A 1 249 ? -1.146 -19.219 18.735 1.00 95.88 249 A 1 ATOM 2031 C CA . TYR A 1 249 ? -1.860 -19.463 17.484 1.00 96.12 249 A 1 ATOM 2032 C C . TYR A 1 249 ? -3.382 -19.329 17.619 1.00 96.25 249 A 1 ATOM 2033 O O . TYR A 1 249 ? -4.047 -18.890 16.686 1.00 95.73 249 A 1 ATOM 2034 C CB . TYR A 1 249 ? -1.502 -20.847 16.947 1.00 95.88 249 A 1 ATOM 2035 C CG . TYR A 1 249 ? -2.189 -21.162 15.632 1.00 95.91 249 A 1 ATOM 2036 C CD1 . TYR A 1 249 ? -3.241 -22.101 15.577 1.00 94.12 249 A 1 ATOM 2037 C CD2 . TYR A 1 249 ? -1.796 -20.482 14.463 1.00 94.67 249 A 1 ATOM 2038 C CE1 . TYR A 1 249 ? -3.883 -22.370 14.355 1.00 93.44 249 A 1 ATOM 2039 C CE2 . TYR A 1 249 ? -2.440 -20.745 13.242 1.00 93.60 249 A 1 ATOM 2040 C CZ . TYR A 1 249 ? -3.481 -21.694 13.185 1.00 94.10 249 A 1 ATOM 2041 O OH . TYR A 1 249 ? -4.092 -21.958 12.002 1.00 92.81 249 A 1 ATOM 2042 N N . ARG A 1 250 ? -3.944 -19.645 18.783 1.00 96.84 250 A 1 ATOM 2043 C CA . ARG A 1 250 ? -5.403 -19.713 19.007 1.00 96.17 250 A 1 ATOM 2044 C C . ARG A 1 250 ? -6.162 -18.474 18.511 1.00 96.06 250 A 1 ATOM 2045 O O . ARG A 1 250 ? -7.244 -18.613 17.946 1.00 94.76 250 A 1 ATOM 2046 C CB . ARG A 1 250 ? -5.662 -19.971 20.496 1.00 95.48 250 A 1 ATOM 2047 C CG . ARG A 1 250 ? -7.128 -20.328 20.781 1.00 83.54 250 A 1 ATOM 2048 C CD . ARG A 1 250 ? -7.392 -20.595 22.274 1.00 80.92 250 A 1 ATOM 2049 N NE . ARG A 1 250 ? -6.637 -21.761 22.769 1.00 71.20 250 A 1 ATOM 2050 C CZ . ARG A 1 250 ? -6.526 -22.158 24.027 1.00 62.61 250 A 1 ATOM 2051 N NH1 . ARG A 1 250 ? -7.197 -21.596 24.986 1.00 57.07 250 A 1 ATOM 2052 N NH2 . ARG A 1 250 ? -5.703 -23.129 24.345 1.00 54.82 250 A 1 ATOM 2053 N N . ARG A 1 251 ? -5.590 -17.271 18.664 1.00 95.48 251 A 1 ATOM 2054 C CA . ARG A 1 251 ? -6.203 -16.020 18.172 1.00 94.63 251 A 1 ATOM 2055 C C . ARG A 1 251 ? -6.284 -15.932 16.644 1.00 95.59 251 A 1 ATOM 2056 O O . ARG A 1 251 ? -7.139 -15.222 16.132 1.00 93.99 251 A 1 ATOM 2057 C CB . ARG A 1 251 ? -5.491 -14.810 18.792 1.00 91.23 251 A 1 ATOM 2058 C CG . ARG A 1 251 ? -4.058 -14.608 18.283 1.00 85.15 251 A 1 ATOM 2059 C CD . ARG A 1 251 ? -3.370 -13.456 19.020 1.00 85.70 251 A 1 ATOM 2060 N NE . ARG A 1 251 ? -1.940 -13.393 18.673 1.00 82.61 251 A 1 ATOM 2061 C CZ . ARG A 1 251 ? -1.092 -12.443 19.014 1.00 82.10 251 A 1 ATOM 2062 N NH1 . ARG A 1 251 ? -1.445 -11.401 19.700 1.00 73.39 251 A 1 ATOM 2063 N NH2 . ARG A 1 251 ? 0.156 -12.513 18.671 1.00 73.36 251 A 1 ATOM 2064 N N . PHE A 1 252 ? -5.424 -16.658 15.927 1.00 95.76 252 A 1 ATOM 2065 C CA . PHE A 1 252 ? -5.373 -16.693 14.460 1.00 95.55 252 A 1 ATOM 2066 C C . PHE A 1 252 ? -6.079 -17.914 13.861 1.00 96.04 252 A 1 ATOM 2067 O O . PHE A 1 252 ? -6.388 -17.912 12.676 1.00 94.95 252 A 1 ATOM 2068 C CB . PHE A 1 252 ? -3.909 -16.646 14.001 1.00 94.84 252 A 1 ATOM 2069 C CG . PHE A 1 252 ? -3.106 -15.495 14.573 1.00 94.83 252 A 1 ATOM 2070 C CD1 . PHE A 1 252 ? -3.546 -14.174 14.397 1.00 92.88 252 A 1 ATOM 2071 C CD2 . PHE A 1 252 ? -1.912 -15.750 15.276 1.00 93.43 252 A 1 ATOM 2072 C CE1 . PHE A 1 252 ? -2.796 -13.109 14.921 1.00 92.00 252 A 1 ATOM 2073 C CE2 . PHE A 1 252 ? -1.163 -14.683 15.793 1.00 92.26 252 A 1 ATOM 2074 C CZ . PHE A 1 252 ? -1.604 -13.362 15.617 1.00 92.16 252 A 1 ATOM 2075 N N . SER A 1 253 ? -6.375 -18.929 14.661 1.00 96.00 253 A 1 ATOM 2076 C CA . SER A 1 253 ? -7.036 -20.153 14.209 1.00 96.05 253 A 1 ATOM 2077 C C . SER A 1 253 ? -8.332 -19.846 13.449 1.00 96.30 253 A 1 ATOM 2078 O O . SER A 1 253 ? -9.124 -19.003 13.875 1.00 95.23 253 A 1 ATOM 2079 C CB . SER A 1 253 ? -7.332 -21.061 15.401 1.00 94.86 253 A 1 ATOM 2080 O OG . SER A 1 253 ? -7.906 -22.274 14.957 1.00 87.27 253 A 1 ATOM 2081 N N . GLY A 1 254 ? -8.543 -20.525 12.315 1.00 95.74 254 A 1 ATOM 2082 C CA . GLY A 1 254 ? -9.704 -20.301 11.452 1.00 95.89 254 A 1 ATOM 2083 C C . GLY A 1 254 ? -9.611 -19.060 10.555 1.00 96.73 254 A 1 ATOM 2084 O O . GLY A 1 254 ? -10.638 -18.614 10.055 1.00 95.15 254 A 1 ATOM 2085 N N . TYR A 1 255 ? -8.404 -18.499 10.341 1.00 97.00 255 A 1 ATOM 2086 C CA . TYR A 1 255 ? -8.235 -17.430 9.353 1.00 97.22 255 A 1 ATOM 2087 C C . TYR A 1 255 ? -8.612 -17.907 7.941 1.00 97.64 255 A 1 ATOM 2088 O O . TYR A 1 255 ? -8.501 -19.084 7.594 1.00 97.21 255 A 1 ATOM 2089 C CB . TYR A 1 255 ? -6.810 -16.849 9.393 1.00 96.66 255 A 1 ATOM 2090 C CG . TYR A 1 255 ? -5.706 -17.751 8.863 1.00 96.40 255 A 1 ATOM 2091 C CD1 . TYR A 1 255 ? -4.841 -18.405 9.763 1.00 94.39 255 A 1 ATOM 2092 C CD2 . TYR A 1 255 ? -5.525 -17.940 7.478 1.00 94.55 255 A 1 ATOM 2093 C CE1 . TYR A 1 255 ? -3.822 -19.248 9.285 1.00 92.82 255 A 1 ATOM 2094 C CE2 . TYR A 1 255 ? -4.512 -18.790 6.995 1.00 92.97 255 A 1 ATOM 2095 C CZ . TYR A 1 255 ? -3.661 -19.448 7.898 1.00 92.99 255 A 1 ATOM 2096 O OH . TYR A 1 255 ? -2.688 -20.283 7.433 1.00 91.02 255 A 1 ATOM 2097 N N . ASN A 1 256 ? -9.046 -16.969 7.107 1.00 97.86 256 A 1 ATOM 2098 C CA . ASN A 1 256 ? -9.314 -17.177 5.692 1.00 97.96 256 A 1 ATOM 2099 C C . ASN A 1 256 ? -8.162 -16.612 4.859 1.00 98.07 256 A 1 ATOM 2100 O O . ASN A 1 256 ? -7.506 -15.655 5.265 1.00 97.61 256 A 1 ATOM 2101 C CB . ASN A 1 256 ? -10.641 -16.513 5.326 1.00 97.79 256 A 1 ATOM 2102 C CG . ASN A 1 256 ? -11.831 -17.142 6.021 1.00 96.65 256 A 1 ATOM 2103 O OD1 . ASN A 1 256 ? -12.430 -18.069 5.510 1.00 88.47 256 A 1 ATOM 2104 N ND2 . ASN A 1 256 ? -12.219 -16.649 7.175 1.00 88.05 256 A 1 ATOM 2105 N N . ILE A 1 257 ? -7.957 -17.164 3.653 1.00 97.85 257 A 1 ATOM 2106 C CA . ILE A 1 257 ? -6.935 -16.696 2.714 1.00 97.82 257 A 1 ATOM 2107 C C . ILE A 1 257 ? -7.514 -16.531 1.310 1.00 98.03 257 A 1 ATOM 2108 O O . ILE A 1 257 ? -8.289 -17.355 0.828 1.00 97.40 257 A 1 ATOM 2109 C CB . ILE A 1 257 ? -5.680 -17.592 2.775 1.00 96.70 257 A 1 ATOM 2110 C CG1 . ILE A 1 257 ? -4.545 -16.985 1.923 1.00 89.93 257 A 1 ATOM 2111 C CG2 . ILE A 1 257 ? -5.978 -19.047 2.362 1.00 89.23 257 A 1 ATOM 2112 C CD1 . ILE A 1 257 ? -3.189 -17.655 2.161 1.00 85.25 257 A 1 ATOM 2113 N N . VAL A 1 258 ? -7.125 -15.451 0.643 1.00 97.85 258 A 1 ATOM 2114 C CA . VAL A 1 258 ? -7.316 -15.231 -0.792 1.00 97.79 258 A 1 ATOM 2115 C C . VAL A 1 258 ? -5.941 -15.056 -1.413 1.00 97.65 258 A 1 ATOM 2116 O O . VAL A 1 258 ? -5.236 -14.110 -1.069 1.00 97.11 258 A 1 ATOM 2117 C CB . VAL A 1 258 ? -8.199 -14.003 -1.064 1.00 97.73 258 A 1 ATOM 2118 C CG1 . VAL A 1 258 ? -8.331 -13.742 -2.569 1.00 96.57 258 A 1 ATOM 2119 C CG2 . VAL A 1 258 ? -9.612 -14.178 -0.492 1.00 96.49 258 A 1 ATOM 2120 N N . SER A 1 259 ? -5.590 -15.932 -2.357 1.00 97.10 259 A 1 ATOM 2121 C CA . SER A 1 259 ? -4.323 -15.882 -3.086 1.00 96.83 259 A 1 ATOM 2122 C C . SER A 1 259 ? -4.547 -15.441 -4.532 1.00 97.03 259 A 1 ATOM 2123 O O . SER A 1 259 ? -5.512 -15.856 -5.176 1.00 96.46 259 A 1 ATOM 2124 C CB . SER A 1 259 ? -3.616 -17.240 -3.038 1.00 95.85 259 A 1 ATOM 2125 O OG . SER A 1 259 ? -3.406 -17.638 -1.699 1.00 92.45 259 A 1 ATOM 2126 N N . LEU A 1 260 ? -3.666 -14.590 -5.041 1.00 95.20 260 A 1 ATOM 2127 C CA . LEU A 1 260 ? -3.636 -14.151 -6.434 1.00 95.07 260 A 1 ATOM 2128 C C . LEU A 1 260 ? -2.247 -14.421 -7.017 1.00 94.60 260 A 1 ATOM 2129 O O . LEU A 1 260 ? -1.245 -13.984 -6.453 1.00 93.55 260 A 1 ATOM 2130 C CB . LEU A 1 260 ? -3.979 -12.655 -6.543 1.00 95.31 260 A 1 ATOM 2131 C CG . LEU A 1 260 ? -5.388 -12.253 -6.061 1.00 94.71 260 A 1 ATOM 2132 C CD1 . LEU A 1 260 ? -5.565 -10.741 -6.229 1.00 92.18 260 A 1 ATOM 2133 C CD2 . LEU A 1 260 ? -6.507 -12.934 -6.852 1.00 92.78 260 A 1 ATOM 2134 N N . ASP A 1 261 ? -2.204 -15.085 -8.178 1.00 93.61 261 A 1 ATOM 2135 C CA . ASP A 1 261 ? -0.951 -15.310 -8.891 1.00 92.46 261 A 1 ATOM 2136 C C . ASP A 1 261 ? -0.400 -13.989 -9.436 1.00 91.38 261 A 1 ATOM 2137 O O . ASP A 1 261 ? -1.099 -13.206 -10.091 1.00 88.33 261 A 1 ATOM 2138 C CB . ASP A 1 261 ? -1.135 -16.333 -10.021 1.00 91.29 261 A 1 ATOM 2139 C CG . ASP A 1 261 ? -1.592 -17.703 -9.511 1.00 89.28 261 A 1 ATOM 2140 O OD1 . ASP A 1 261 ? -1.103 -18.135 -8.441 1.00 84.11 261 A 1 ATOM 2141 O OD2 . ASP A 1 261 ? -2.469 -18.282 -10.186 1.00 85.10 261 A 1 ATOM 2142 N N . ALA A 1 262 ? 0.877 -13.750 -9.183 1.00 90.28 262 A 1 ATOM 2143 C CA . ALA A 1 262 ? 1.620 -12.597 -9.645 1.00 88.17 262 A 1 ATOM 2144 C C . ALA A 1 262 ? 2.891 -13.052 -10.368 1.00 88.01 262 A 1 ATOM 2145 O O . ALA A 1 262 ? 3.550 -14.020 -9.991 1.00 84.98 262 A 1 ATOM 2146 C CB . ALA A 1 262 ? 1.892 -11.680 -8.451 1.00 85.82 262 A 1 ATOM 2147 N N . LYS A 1 263 ? 3.236 -12.338 -11.441 1.00 84.94 263 A 1 ATOM 2148 C CA . LYS A 1 263 ? 4.441 -12.609 -12.232 1.00 82.04 263 A 1 ATOM 2149 C C . LYS A 1 263 ? 5.378 -11.416 -12.161 1.00 80.67 263 A 1 ATOM 2150 O O . LYS A 1 263 ? 4.986 -10.284 -12.445 1.00 76.08 263 A 1 ATOM 2151 C CB . LYS A 1 263 ? 4.097 -12.997 -13.678 1.00 78.85 263 A 1 ATOM 2152 C CG . LYS A 1 263 ? 3.193 -14.238 -13.741 1.00 72.84 263 A 1 ATOM 2153 C CD . LYS A 1 263 ? 3.133 -14.877 -15.129 1.00 70.11 263 A 1 ATOM 2154 C CE . LYS A 1 263 ? 2.123 -16.028 -15.081 1.00 63.79 263 A 1 ATOM 2155 N NZ . LYS A 1 263 ? 2.466 -17.148 -15.989 1.00 55.11 263 A 1 ATOM 2156 N N . MET A 1 264 ? 6.636 -11.678 -11.834 1.00 77.90 264 A 1 ATOM 2157 C CA . MET A 1 264 ? 7.724 -10.714 -11.960 1.00 75.52 264 A 1 ATOM 2158 C C . MET A 1 264 ? 8.517 -11.000 -13.241 1.00 75.04 264 A 1 ATOM 2159 O O . MET A 1 264 ? 8.526 -12.124 -13.758 1.00 68.46 264 A 1 ATOM 2160 C CB . MET A 1 264 ? 8.576 -10.711 -10.676 1.00 71.31 264 A 1 ATOM 2161 C CG . MET A 1 264 ? 9.201 -9.333 -10.421 1.00 64.84 264 A 1 ATOM 2162 S SD . MET A 1 264 ? 10.015 -9.143 -8.804 1.00 62.81 264 A 1 ATOM 2163 C CE . MET A 1 264 ? 11.489 -10.163 -9.059 1.00 57.09 264 A 1 ATOM 2164 N N . GLY A 1 265 ? 9.173 -9.993 -13.807 1.00 73.13 265 A 1 ATOM 2165 C CA . GLY A 1 265 ? 10.019 -10.184 -14.991 1.00 73.15 265 A 1 ATOM 2166 C C . GLY A 1 265 ? 11.015 -11.350 -14.817 1.00 75.81 265 A 1 ATOM 2167 O O . GLY A 1 265 ? 11.501 -11.588 -13.720 1.00 71.65 265 A 1 ATOM 2168 N N . LYS A 1 266 ? 11.341 -12.035 -15.921 1.00 74.06 266 A 1 ATOM 2169 C CA . LYS A 1 266 ? 12.212 -13.237 -15.979 1.00 74.92 266 A 1 ATOM 2170 C C . LYS A 1 266 ? 11.602 -14.549 -15.435 1.00 76.92 266 A 1 ATOM 2171 O O . LYS A 1 266 ? 12.350 -15.439 -15.039 1.00 70.57 266 A 1 ATOM 2172 C CB . LYS A 1 266 ? 13.619 -12.980 -15.391 1.00 69.46 266 A 1 ATOM 2173 C CG . LYS A 1 266 ? 14.361 -11.764 -15.944 1.00 62.72 266 A 1 ATOM 2174 C CD . LYS A 1 266 ? 15.743 -11.692 -15.285 1.00 59.86 266 A 1 ATOM 2175 C CE . LYS A 1 266 ? 16.578 -10.550 -15.868 1.00 53.30 266 A 1 ATOM 2176 N NZ . LYS A 1 266 ? 17.942 -10.531 -15.276 1.00 45.86 266 A 1 ATOM 2177 N N . GLY A 1 267 ? 10.278 -14.704 -15.470 1.00 77.63 267 A 1 ATOM 2178 C CA . GLY A 1 267 ? 9.639 -16.002 -15.186 1.00 78.74 267 A 1 ATOM 2179 C C . GLY A 1 267 ? 9.561 -16.383 -13.705 1.00 81.81 267 A 1 ATOM 2180 O O . GLY A 1 267 ? 9.314 -17.538 -13.395 1.00 77.75 267 A 1 ATOM 2181 N N . ILE A 1 268 ? 9.778 -15.428 -12.801 1.00 81.12 268 A 1 ATOM 2182 C CA . ILE A 1 268 ? 9.574 -15.641 -11.364 1.00 82.07 268 A 1 ATOM 2183 C C . ILE A 1 268 ? 8.078 -15.487 -11.073 1.00 84.46 268 A 1 ATOM 2184 O O . ILE A 1 268 ? 7.537 -14.384 -11.189 1.00 81.68 268 A 1 ATOM 2185 C CB . ILE A 1 268 ? 10.447 -14.688 -10.517 1.00 78.04 268 A 1 ATOM 2186 C CG1 . ILE A 1 268 ? 11.946 -14.880 -10.850 1.00 72.69 268 A 1 ATOM 2187 C CG2 . ILE A 1 268 ? 10.188 -14.928 -9.019 1.00 73.15 268 A 1 ATOM 2188 C CD1 . ILE A 1 268 ? 12.879 -13.867 -10.174 1.00 67.55 268 A 1 ATOM 2189 N N . GLU A 1 269 ? 7.434 -16.596 -10.714 1.00 85.90 269 A 1 ATOM 2190 C CA . GLU A 1 269 ? 6.043 -16.638 -10.266 1.00 86.62 269 A 1 ATOM 2191 C C . GLU A 1 269 ? 6.004 -16.629 -8.736 1.00 86.95 269 A 1 ATOM 2192 O O . GLU A 1 269 ? 6.831 -17.256 -8.072 1.00 83.83 269 A 1 ATOM 2193 C CB . GLU A 1 269 ? 5.306 -17.844 -10.875 1.00 83.85 269 A 1 ATOM 2194 C CG . GLU A 1 269 ? 5.309 -17.769 -12.416 1.00 75.41 269 A 1 ATOM 2195 C CD . GLU A 1 269 ? 4.418 -18.796 -13.124 1.00 72.94 269 A 1 ATOM 2196 O OE1 . GLU A 1 269 ? 4.055 -18.508 -14.302 1.00 66.06 269 A 1 ATOM 2197 O OE2 . GLU A 1 269 ? 4.091 -19.833 -12.517 1.00 67.39 269 A 1 ATOM 2198 N N . TYR A 1 270 ? 5.066 -15.889 -8.179 1.00 89.25 270 A 1 ATOM 2199 C CA . TYR A 1 270 ? 4.796 -15.851 -6.746 1.00 89.46 270 A 1 ATOM 2200 C C . TYR A 1 270 ? 3.310 -15.573 -6.532 1.00 91.08 270 A 1 ATOM 2201 O O . TYR A 1 270 ? 2.608 -15.154 -7.450 1.00 90.62 270 A 1 ATOM 2202 C CB . TYR A 1 270 ? 5.689 -14.809 -6.053 1.00 86.94 270 A 1 ATOM 2203 C CG . TYR A 1 270 ? 5.405 -13.357 -6.389 1.00 84.79 270 A 1 ATOM 2204 C CD1 . TYR A 1 270 ? 5.878 -12.803 -7.596 1.00 82.51 270 A 1 ATOM 2205 C CD2 . TYR A 1 270 ? 4.668 -12.561 -5.495 1.00 83.02 270 A 1 ATOM 2206 C CE1 . TYR A 1 270 ? 5.611 -11.458 -7.911 1.00 78.93 270 A 1 ATOM 2207 C CE2 . TYR A 1 270 ? 4.398 -11.213 -5.805 1.00 79.76 270 A 1 ATOM 2208 C CZ . TYR A 1 270 ? 4.865 -10.661 -7.018 1.00 78.88 270 A 1 ATOM 2209 O OH . TYR A 1 270 ? 4.591 -9.370 -7.326 1.00 75.20 270 A 1 ATOM 2210 N N . GLN A 1 271 ? 2.823 -15.801 -5.321 1.00 93.13 271 A 1 ATOM 2211 C CA . GLN A 1 271 ? 1.445 -15.489 -4.959 1.00 93.52 271 A 1 ATOM 2212 C C . GLN A 1 271 ? 1.415 -14.337 -3.965 1.00 93.68 271 A 1 ATOM 2213 O O . GLN A 1 271 ? 2.132 -14.355 -2.964 1.00 92.29 271 A 1 ATOM 2214 C CB . GLN A 1 271 ? 0.733 -16.732 -4.414 1.00 92.13 271 A 1 ATOM 2215 C CG . GLN A 1 271 ? 0.552 -17.788 -5.513 1.00 83.72 271 A 1 ATOM 2216 C CD . GLN A 1 271 ? -0.232 -19.004 -5.053 1.00 83.13 271 A 1 ATOM 2217 O OE1 . GLN A 1 271 ? -0.231 -19.389 -3.892 1.00 76.70 271 A 1 ATOM 2218 N NE2 . GLN A 1 271 ? -0.924 -19.662 -5.955 1.00 71.93 271 A 1 ATOM 2219 N N . ASP A 1 272 ? 0.584 -13.348 -4.246 1.00 94.82 272 A 1 ATOM 2220 C CA . ASP A 1 272 ? 0.175 -12.362 -3.255 1.00 94.87 272 A 1 ATOM 2221 C C . ASP A 1 272 ? -1.031 -12.911 -2.487 1.00 96.00 272 A 1 ATOM 2222 O O . ASP A 1 272 ? -1.961 -13.463 -3.079 1.00 95.80 272 A 1 ATOM 2223 C CB . ASP A 1 272 ? -0.161 -11.022 -3.923 1.00 93.27 272 A 1 ATOM 2224 C CG . ASP A 1 272 ? 1.047 -10.165 -4.325 1.00 90.06 272 A 1 ATOM 2225 O OD1 . ASP A 1 272 ? 2.086 -10.197 -3.624 1.00 87.05 272 A 1 ATOM 2226 O OD2 . ASP A 1 272 ? 0.905 -9.387 -5.299 1.00 85.62 272 A 1 ATOM 2227 N N . ASN A 1 273 ? -1.027 -12.733 -1.175 1.00 96.65 273 A 1 ATOM 2228 C CA . ASN A 1 273 ? -2.008 -13.287 -0.254 1.00 96.70 273 A 1 ATOM 2229 C C . ASN A 1 273 ? -2.703 -12.176 0.536 1.00 97.27 273 A 1 ATOM 2230 O O . ASN A 1 273 ? -2.060 -11.246 1.022 1.00 97.02 273 A 1 ATOM 2231 C CB . ASN A 1 273 ? -1.306 -14.291 0.679 1.00 95.92 273 A 1 ATOM 2232 C CG . ASN A 1 273 ? -0.725 -15.479 -0.071 1.00 94.61 273 A 1 ATOM 2233 O OD1 . ASN A 1 273 ? -1.358 -16.055 -0.938 1.00 89.74 273 A 1 ATOM 2234 N ND2 . ASN A 1 273 ? 0.480 -15.883 0.241 1.00 89.12 273 A 1 ATOM 2235 N N . MET A 1 274 ? -4.009 -12.303 0.710 1.00 97.33 274 A 1 ATOM 2236 C CA . MET A 1 274 ? -4.802 -11.546 1.672 1.00 97.78 274 A 1 ATOM 2237 C C . MET A 1 274 ? -5.348 -12.522 2.712 1.00 97.89 274 A 1 ATOM 2238 O O . MET A 1 274 ? -6.272 -13.282 2.433 1.00 97.65 274 A 1 ATOM 2239 C CB . MET A 1 274 ? -5.911 -10.771 0.945 1.00 97.82 274 A 1 ATOM 2240 C CG . MET A 1 274 ? -6.706 -9.870 1.898 1.00 97.21 274 A 1 ATOM 2241 S SD . MET A 1 274 ? -8.098 -8.992 1.119 1.00 96.95 274 A 1 ATOM 2242 C CE . MET A 1 274 ? -9.255 -10.373 0.947 1.00 92.88 274 A 1 ATOM 2243 N N . ILE A 1 275 ? -4.763 -12.493 3.903 1.00 98.08 275 A 1 ATOM 2244 C CA . ILE A 1 275 ? -5.127 -13.319 5.057 1.00 98.03 275 A 1 ATOM 2245 C C . ILE A 1 275 ? -6.045 -12.484 5.947 1.00 98.29 275 A 1 ATOM 2246 O O . ILE A 1 275 ? -5.741 -11.328 6.223 1.00 98.22 275 A 1 ATOM 2247 C CB . ILE A 1 275 ? -3.858 -13.772 5.813 1.00 97.62 275 A 1 ATOM 2248 C CG1 . ILE A 1 275 ? -2.845 -14.491 4.886 1.00 96.71 275 A 1 ATOM 2249 C CG2 . ILE A 1 275 ? -4.246 -14.688 6.984 1.00 96.81 275 A 1 ATOM 2250 C CD1 . ILE A 1 275 ? -1.436 -14.571 5.484 1.00 94.48 275 A 1 ATOM 2251 N N . TYR A 1 276 ? -7.158 -13.033 6.402 1.00 98.26 276 A 1 ATOM 2252 C CA . TYR A 1 276 ? -8.090 -12.261 7.225 1.00 98.42 276 A 1 ATOM 2253 C C . TYR A 1 276 ? -8.880 -13.108 8.217 1.00 98.36 276 A 1 ATOM 2254 O O . TYR A 1 276 ? -9.150 -14.283 7.987 1.00 98.15 276 A 1 ATOM 2255 C CB . TYR A 1 276 ? -9.028 -11.442 6.327 1.00 98.47 276 A 1 ATOM 2256 C CG . TYR A 1 276 ? -10.015 -12.267 5.525 1.00 98.52 276 A 1 ATOM 2257 C CD1 . TYR A 1 276 ? -9.637 -12.826 4.285 1.00 98.06 276 A 1 ATOM 2258 C CD2 . TYR A 1 276 ? -11.316 -12.483 6.019 1.00 98.14 276 A 1 ATOM 2259 C CE1 . TYR A 1 276 ? -10.556 -13.591 3.543 1.00 97.84 276 A 1 ATOM 2260 C CE2 . TYR A 1 276 ? -12.237 -13.250 5.279 1.00 97.87 276 A 1 ATOM 2261 C CZ . TYR A 1 276 ? -11.858 -13.801 4.041 1.00 97.92 276 A 1 ATOM 2262 O OH . TYR A 1 276 ? -12.754 -14.535 3.326 1.00 97.14 276 A 1 ATOM 2263 N N . LYS A 1 277 ? -9.286 -12.462 9.310 1.00 98.19 277 A 1 ATOM 2264 C CA . LYS A 1 277 ? -10.213 -13.008 10.304 1.00 98.08 277 A 1 ATOM 2265 C C . LYS A 1 277 ? -11.005 -11.850 10.910 1.00 98.15 277 A 1 ATOM 2266 O O . LYS A 1 277 ? -10.401 -10.882 11.370 1.00 97.68 277 A 1 ATOM 2267 C CB . LYS A 1 277 ? -9.421 -13.809 11.347 1.00 97.63 277 A 1 ATOM 2268 C CG . LYS A 1 277 ? -10.362 -14.475 12.356 1.00 96.78 277 A 1 ATOM 2269 C CD . LYS A 1 277 ? -9.608 -15.377 13.331 1.00 95.40 277 A 1 ATOM 2270 C CE . LYS A 1 277 ? -10.630 -15.933 14.328 1.00 92.39 277 A 1 ATOM 2271 N NZ . LYS A 1 277 ? -10.000 -16.808 15.337 1.00 89.10 277 A 1 ATOM 2272 N N . ILE A 1 278 ? -12.327 -11.924 10.849 1.00 97.29 278 A 1 ATOM 2273 C CA . ILE A 1 278 ? -13.217 -10.834 11.297 1.00 96.56 278 A 1 ATOM 2274 C C . ILE A 1 278 ? -13.834 -11.124 12.672 1.00 95.55 278 A 1 ATOM 2275 O O . ILE A 1 278 ? -14.019 -10.192 13.450 1.00 92.16 278 A 1 ATOM 2276 C CB . ILE A 1 278 ? -14.280 -10.539 10.217 1.00 96.08 278 A 1 ATOM 2277 C CG1 . ILE A 1 278 ? -13.650 -10.130 8.857 1.00 94.28 278 A 1 ATOM 2278 C CG2 . ILE A 1 278 ? -15.279 -9.459 10.666 1.00 94.30 278 A 1 ATOM 2279 C CD1 . ILE A 1 278 ? -12.781 -8.853 8.891 1.00 88.46 278 A 1 ATOM 2280 N N . ASP A 1 279 ? -14.105 -12.384 12.967 1.00 94.64 279 A 1 ATOM 2281 C CA . ASP A 1 279 ? -14.672 -12.896 14.217 1.00 93.12 279 A 1 ATOM 2282 C C . ASP A 1 279 ? -13.605 -13.337 15.245 1.00 91.57 279 A 1 ATOM 2283 O O . ASP A 1 279 ? -12.504 -13.781 14.857 1.00 84.79 279 A 1 ATOM 2284 C CB . ASP A 1 279 ? -15.704 -14.000 13.873 1.00 87.15 279 A 1 ATOM 2285 C CG . ASP A 1 279 ? -15.164 -15.210 13.072 1.00 82.14 279 A 1 ATOM 2286 O OD1 . ASP A 1 279 ? -14.229 -15.055 12.248 1.00 75.53 279 A 1 ATOM 2287 O OD2 . ASP A 1 279 ? -15.747 -16.307 13.229 1.00 78.52 279 A 1 ATOM 2288 O OXT . ASP A 1 279 ? -13.937 -13.219 16.453 1.00 72.71 279 A 1 #