# 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_7euu # _entry.id 7euu # loop_ _atom_type.symbol C CU 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" Cu 63.546 CU . "COPPER (II) ION" "[Cu+2]" ? NON-POLYMER "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" "C29 H28 O10" 536.527 JD9 . 2,6,11-trimethoxy-4,7,9-tris(oxidanyl)-1,12-bis[(2R)-2-oxidanylpropyl]perylene-3,10-dione C[C@H](CC1=C(C(=O)c2c(cc(c3c2c1c4c5c3c(cc(c5C(=O)C(=C4C[C@@H](C)O)OC)O)OC)O)O)OC)O ? non-polymer "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" "C4 H5 N O5" 147.086 OGA . N-OXALYLGLYCINE C(C(=O)O)NC(=O)C(=O)O ? NON-POLYMER "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 # loop_ _entity.id _entity.pdbx_description _entity.type 1 . polymer 2 . polymer 3 . non-polymer 4 . non-polymer 5 . non-polymer 6 . non-polymer 7 . non-polymer 8 . non-polymer # loop_ _entity_poly.entity_id _entity_poly.pdbx_strand_id _entity_poly.type 1 A polypeptide(L) 2 B 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 THR 2 1 n SER 3 1 n THR 4 1 n THR 5 1 n THR 6 1 n THR 7 1 n THR 8 1 n GLU 9 1 n THR 10 1 n LEU 11 1 n GLN 12 1 n GLU 13 1 n ALA 14 1 n VAL 15 1 n PRO 16 1 n PHE 17 1 n VAL 18 1 n ALA 19 1 n PRO 20 1 n PRO 21 1 n SER 22 1 n PRO 23 1 n PRO 24 1 n GLU 25 1 n ASP 26 1 n VAL 27 1 n ASN 28 1 n ASN 29 1 n LYS 30 1 n GLU 31 1 n LEU 32 1 n PRO 33 1 n GLU 34 1 n LYS 35 1 n PRO 36 1 n TYR 37 1 n TYR 38 1 n ASP 39 1 n VAL 40 1 n GLU 41 1 n PHE 42 1 n ASN 43 1 n TYR 44 1 n ARG 45 1 n LEU 46 1 n ASP 47 1 n PRO 48 1 n ARG 49 1 n ASP 50 1 n GLY 51 1 n GLY 52 1 n ASP 53 1 n GLU 54 1 n VAL 55 1 n ILE 56 1 n TRP 57 1 n GLY 58 1 n GLY 59 1 n THR 60 1 n VAL 61 1 n GLY 62 1 n LEU 63 1 n MET 64 1 n ARG 65 1 n ARG 66 1 n LYS 67 1 n TYR 68 1 n GLU 69 1 n THR 70 1 n ARG 71 1 n THR 72 1 n VAL 73 1 n ARG 74 1 n ILE 75 1 n ASN 76 1 n ASN 77 1 n GLU 78 1 n ARG 79 1 n GLY 80 1 n ASN 81 1 n GLU 82 1 n HIS 83 1 n ASN 84 1 n PHE 85 1 n ASN 86 1 n LEU 87 1 n ASP 88 1 n THR 89 1 n HIS 90 1 n GLY 91 1 n PHE 92 1 n ALA 93 1 n TRP 94 1 n VAL 95 1 n LYS 96 1 n HIS 97 1 n LYS 98 1 n THR 99 1 n SER 100 1 n VAL 101 1 n THR 102 1 n GLU 103 1 n PHE 104 1 n ALA 105 1 n ASP 106 1 n TYR 107 1 n LEU 108 1 n ALA 109 1 n ILE 110 1 n ARG 111 1 n GLN 112 1 n GLY 113 1 n PRO 114 1 n TYR 115 1 n TYR 116 1 n GLY 117 1 n GLU 118 1 n VAL 119 1 n ALA 120 1 n GLU 121 1 n MET 122 1 n LEU 123 1 n LYS 124 1 n ARG 125 1 n VAL 126 1 n THR 127 1 n GLY 128 1 n ALA 129 1 n THR 130 1 n LYS 131 1 n VAL 132 1 n HIS 133 1 n VAL 134 1 n ILE 135 1 n GLY 136 1 n HIS 137 1 n LEU 138 1 n HIS 139 1 n ARG 140 1 n SER 141 1 n LEU 142 1 n ASN 143 1 n TYR 144 1 n ASN 145 1 n ASP 146 1 n THR 147 1 n THR 148 1 n GLU 149 1 n GLU 150 1 n GLU 151 1 n LYS 152 1 n ASN 153 1 n ALA 154 1 n PRO 155 1 n ASP 156 1 n MET 157 1 n THR 158 1 n MET 159 1 n THR 160 1 n LYS 161 1 n GLY 162 1 n GLN 163 1 n THR 164 1 n PRO 165 1 n GLY 166 1 n ARG 167 1 n PHE 168 1 n VAL 169 1 n HIS 170 1 n VAL 171 1 n ASP 172 1 n GLN 173 1 n SER 174 1 n TYR 175 1 n GLN 176 1 n GLY 177 1 n ALA 178 1 n VAL 179 1 n ARG 180 1 n ARG 181 1 n LEU 182 1 n TYR 183 1 n LEU 184 1 n ASP 185 1 n LEU 186 1 n PRO 187 1 n GLN 188 1 n GLU 189 1 n GLU 190 1 n ALA 191 1 n ARG 192 1 n ARG 193 1 n LEU 194 1 n GLU 195 1 n LYS 196 1 n THR 197 1 n ARG 198 1 n TRP 199 1 n ALA 200 1 n ILE 201 1 n ILE 202 1 n ASN 203 1 n VAL 204 1 n TRP 205 1 n ARG 206 1 n PRO 207 1 n VAL 208 1 n ARG 209 1 n LYS 210 1 n VAL 211 1 n THR 212 1 n ASN 213 1 n GLU 214 1 n PRO 215 1 n LEU 216 1 n ALA 217 1 n VAL 218 1 n CYS 219 1 n ASP 220 1 n ALA 221 1 n ARG 222 1 n SER 223 1 n VAL 224 1 n ARG 225 1 n GLU 226 1 n ASP 227 1 n GLU 228 1 n LEU 229 1 n PHE 230 1 n ASN 231 1 n THR 232 1 n LEU 233 1 n HIS 234 1 n LEU 235 1 n VAL 236 1 n PRO 237 1 n MET 238 1 n ARG 239 1 n TRP 240 1 n PRO 241 1 n ASP 242 1 n ALA 243 1 n ALA 244 1 n PRO 245 1 n GLN 246 1 n GLU 247 1 n ASN 248 1 n GLN 249 1 n MET 250 1 n TRP 251 1 n ALA 252 1 n VAL 253 1 n ALA 254 1 n PRO 255 1 n PRO 256 1 n LYS 257 1 n THR 258 1 n PRO 259 1 n THR 260 1 n GLN 261 1 n HIS 262 1 n LYS 263 1 n TRP 264 1 n HIS 265 1 n TYR 266 1 n VAL 267 1 n SER 268 1 n GLY 269 1 n MET 270 1 n THR 271 1 n GLU 272 1 n ASP 273 1 n GLU 274 1 n ALA 275 1 n LEU 276 1 n LEU 277 1 n ILE 278 1 n LYS 279 1 n MET 280 1 n PHE 281 1 n ASP 282 1 n SER 283 1 n LYS 284 1 n LYS 285 1 n ASP 286 1 n GLY 287 1 n THR 288 1 n ALA 289 1 n ARG 290 1 n ARG 291 1 n VAL 292 1 n PRO 293 1 n HIS 294 1 n SER 295 1 n SER 296 1 n PHE 297 1 n PRO 298 1 n THR 299 1 n PRO 300 1 n ASP 301 1 n ASP 302 1 n PHE 303 1 n GLY 304 1 n GLU 305 1 n PRO 306 1 n ARG 307 1 n ALA 308 1 n SER 309 1 n THR 310 1 n GLU 311 1 n THR 312 1 n ARG 313 1 n CYS 314 1 n PHE 315 1 n VAL 316 1 n PHE 317 1 n TRP 318 1 n GLU 319 1 n ASP 320 1 n GLN 321 1 n GLU 322 1 n ALA 323 1 n GLU 324 1 n ALA 325 1 n LEU 326 1 n GLU 327 1 n HIS 328 1 n HIS 329 1 n HIS 330 1 n HIS 331 1 n HIS 332 1 n HIS 333 2 n MET 1 2 n THR 2 2 n SER 3 2 n THR 4 2 n THR 5 2 n THR 6 2 n THR 7 2 n THR 8 2 n GLU 9 2 n THR 10 2 n LEU 11 2 n GLN 12 2 n GLU 13 2 n ALA 14 2 n VAL 15 2 n PRO 16 2 n PHE 17 2 n VAL 18 2 n ALA 19 2 n PRO 20 2 n PRO 21 2 n SER 22 2 n PRO 23 2 n PRO 24 2 n GLU 25 2 n ASP 26 2 n VAL 27 2 n ASN 28 2 n ASN 29 2 n LYS 30 2 n GLU 31 2 n LEU 32 2 n PRO 33 2 n GLU 34 2 n LYS 35 2 n PRO 36 2 n TYR 37 2 n TYR 38 2 n ASP 39 2 n VAL 40 2 n GLU 41 2 n PHE 42 2 n ASN 43 2 n TYR 44 2 n ARG 45 2 n LEU 46 2 n ASP 47 2 n PRO 48 2 n ARG 49 2 n ASP 50 2 n GLY 51 2 n GLY 52 2 n ASP 53 2 n GLU 54 2 n VAL 55 2 n ILE 56 2 n TRP 57 2 n GLY 58 2 n GLY 59 2 n THR 60 2 n VAL 61 2 n GLY 62 2 n LEU 63 2 n MET 64 2 n ARG 65 2 n ARG 66 2 n LYS 67 2 n TYR 68 2 n GLU 69 2 n THR 70 2 n ARG 71 2 n THR 72 2 n VAL 73 2 n ARG 74 2 n ILE 75 2 n ASN 76 2 n ASN 77 2 n GLU 78 2 n ARG 79 2 n GLY 80 2 n ASN 81 2 n GLU 82 2 n HIS 83 2 n ASN 84 2 n PHE 85 2 n ASN 86 2 n LEU 87 2 n ASP 88 2 n THR 89 2 n HIS 90 2 n GLY 91 2 n PHE 92 2 n ALA 93 2 n TRP 94 2 n VAL 95 2 n LYS 96 2 n HIS 97 2 n LYS 98 2 n THR 99 2 n SER 100 2 n VAL 101 2 n THR 102 2 n GLU 103 2 n PHE 104 2 n ALA 105 2 n ASP 106 2 n TYR 107 2 n LEU 108 2 n ALA 109 2 n ILE 110 2 n ARG 111 2 n GLN 112 2 n GLY 113 2 n PRO 114 2 n TYR 115 2 n TYR 116 2 n GLY 117 2 n GLU 118 2 n VAL 119 2 n ALA 120 2 n GLU 121 2 n MET 122 2 n LEU 123 2 n LYS 124 2 n ARG 125 2 n VAL 126 2 n THR 127 2 n GLY 128 2 n ALA 129 2 n THR 130 2 n LYS 131 2 n VAL 132 2 n HIS 133 2 n VAL 134 2 n ILE 135 2 n GLY 136 2 n HIS 137 2 n LEU 138 2 n HIS 139 2 n ARG 140 2 n SER 141 2 n LEU 142 2 n ASN 143 2 n TYR 144 2 n ASN 145 2 n ASP 146 2 n THR 147 2 n THR 148 2 n GLU 149 2 n GLU 150 2 n GLU 151 2 n LYS 152 2 n ASN 153 2 n ALA 154 2 n PRO 155 2 n ASP 156 2 n MET 157 2 n THR 158 2 n MET 159 2 n THR 160 2 n LYS 161 2 n GLY 162 2 n GLN 163 2 n THR 164 2 n PRO 165 2 n GLY 166 2 n ARG 167 2 n PHE 168 2 n VAL 169 2 n HIS 170 2 n VAL 171 2 n ASP 172 2 n GLN 173 2 n SER 174 2 n TYR 175 2 n GLN 176 2 n GLY 177 2 n ALA 178 2 n VAL 179 2 n ARG 180 2 n ARG 181 2 n LEU 182 2 n TYR 183 2 n LEU 184 2 n ASP 185 2 n LEU 186 2 n PRO 187 2 n GLN 188 2 n GLU 189 2 n GLU 190 2 n ALA 191 2 n ARG 192 2 n ARG 193 2 n LEU 194 2 n GLU 195 2 n LYS 196 2 n THR 197 2 n ARG 198 2 n TRP 199 2 n ALA 200 2 n ILE 201 2 n ILE 202 2 n ASN 203 2 n VAL 204 2 n TRP 205 2 n ARG 206 2 n PRO 207 2 n VAL 208 2 n ARG 209 2 n LYS 210 2 n VAL 211 2 n THR 212 2 n ASN 213 2 n GLU 214 2 n PRO 215 2 n LEU 216 2 n ALA 217 2 n VAL 218 2 n CYS 219 2 n ASP 220 2 n ALA 221 2 n ARG 222 2 n SER 223 2 n VAL 224 2 n ARG 225 2 n GLU 226 2 n ASP 227 2 n GLU 228 2 n LEU 229 2 n PHE 230 2 n ASN 231 2 n THR 232 2 n LEU 233 2 n HIS 234 2 n LEU 235 2 n VAL 236 2 n PRO 237 2 n MET 238 2 n ARG 239 2 n TRP 240 2 n PRO 241 2 n ASP 242 2 n ALA 243 2 n ALA 244 2 n PRO 245 2 n GLN 246 2 n GLU 247 2 n ASN 248 2 n GLN 249 2 n MET 250 2 n TRP 251 2 n ALA 252 2 n VAL 253 2 n ALA 254 2 n PRO 255 2 n PRO 256 2 n LYS 257 2 n THR 258 2 n PRO 259 2 n THR 260 2 n GLN 261 2 n HIS 262 2 n LYS 263 2 n TRP 264 2 n HIS 265 2 n TYR 266 2 n VAL 267 2 n SER 268 2 n GLY 269 2 n MET 270 2 n THR 271 2 n GLU 272 2 n ASP 273 2 n GLU 274 2 n ALA 275 2 n LEU 276 2 n LEU 277 2 n ILE 278 2 n LYS 279 2 n MET 280 2 n PHE 281 2 n ASP 282 2 n SER 283 2 n LYS 284 2 n LYS 285 2 n ASP 286 2 n GLY 287 2 n THR 288 2 n ALA 289 2 n ARG 290 2 n ARG 291 2 n VAL 292 2 n PRO 293 2 n HIS 294 2 n SER 295 2 n SER 296 2 n PHE 297 2 n PRO 298 2 n THR 299 2 n PRO 300 2 n ASP 301 2 n ASP 302 2 n PHE 303 2 n GLY 304 2 n GLU 305 2 n PRO 306 2 n ARG 307 2 n ALA 308 2 n SER 309 2 n THR 310 2 n GLU 311 2 n THR 312 2 n ARG 313 2 n CYS 314 2 n PHE 315 2 n VAL 316 2 n PHE 317 2 n TRP 318 2 n GLU 319 2 n ASP 320 2 n GLN 321 2 n GLU 322 2 n ALA 323 2 n GLU 324 2 n ALA 325 2 n LEU 326 2 n GLU 327 2 n HIS 328 2 n HIS 329 2 n HIS 330 2 n HIS 331 2 n HIS 332 2 n HIS 333 # _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 @ 2025-09-26 03:19:49)" _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 88.37 _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 34.27 1 1 A THR 2 2 30.08 1 2 A SER 3 2 34.66 1 3 A THR 4 2 35.94 1 4 A THR 5 2 36.98 1 5 A THR 6 2 37.07 1 6 A THR 7 2 33.81 1 7 A THR 8 2 32.68 1 8 A GLU 9 2 33.30 1 9 A THR 10 2 34.00 1 10 A LEU 11 2 40.70 1 11 A GLN 12 2 36.99 1 12 A GLU 13 2 38.94 1 13 A ALA 14 2 48.25 1 14 A VAL 15 2 45.36 1 15 A PRO 16 2 49.05 1 16 A PHE 17 2 46.08 1 17 A VAL 18 2 52.63 1 18 A ALA 19 2 55.08 1 19 A PRO 20 2 49.79 1 20 A PRO 21 2 51.78 1 21 A SER 22 2 46.47 1 22 A PRO 23 2 46.84 1 23 A PRO 24 2 49.15 1 24 A GLU 25 2 42.21 1 25 A ASP 26 2 41.39 1 26 A VAL 27 2 46.94 1 27 A ASN 28 2 47.66 1 28 A ASN 29 2 42.39 1 29 A LYS 30 2 53.31 1 30 A GLU 31 2 56.36 1 31 A LEU 32 2 65.83 1 32 A PRO 33 2 66.92 1 33 A GLU 34 2 69.44 1 34 A LYS 35 2 86.54 1 35 A PRO 36 2 94.13 1 36 A TYR 37 2 94.34 1 37 A TYR 38 2 95.73 1 38 A ASP 39 2 95.87 1 39 A VAL 40 2 94.45 1 40 A GLU 41 2 87.52 1 41 A PHE 42 2 97.04 1 42 A ASN 43 2 97.08 1 43 A TYR 44 2 98.25 1 44 A ARG 45 2 96.42 1 45 A LEU 46 2 97.42 1 46 A ASP 47 2 95.62 1 47 A PRO 48 2 96.87 1 48 A ARG 49 2 93.36 1 49 A ASP 50 2 95.92 1 50 A GLY 51 2 97.05 1 51 A GLY 52 2 97.52 1 52 A ASP 53 2 97.14 1 53 A GLU 54 2 95.19 1 54 A VAL 55 2 97.98 1 55 A ILE 56 2 97.85 1 56 A TRP 57 2 97.54 1 57 A GLY 58 2 97.67 1 58 A GLY 59 2 97.06 1 59 A THR 60 2 97.24 1 60 A VAL 61 2 95.98 1 61 A GLY 62 2 97.25 1 62 A LEU 63 2 95.82 1 63 A MET 64 2 88.51 1 64 A ARG 65 2 95.27 1 65 A ARG 66 2 95.40 1 66 A LYS 67 2 90.20 1 67 A TYR 68 2 97.25 1 68 A GLU 69 2 94.50 1 69 A THR 70 2 94.14 1 70 A ARG 71 2 94.64 1 71 A THR 72 2 95.56 1 72 A VAL 73 2 96.75 1 73 A ARG 74 2 93.59 1 74 A ILE 75 2 97.20 1 75 A ASN 76 2 94.02 1 76 A ASN 77 2 96.29 1 77 A GLU 78 2 96.26 1 78 A ARG 79 2 94.35 1 79 A GLY 80 2 94.64 1 80 A ASN 81 2 90.45 1 81 A GLU 82 2 94.01 1 82 A HIS 83 2 88.23 1 83 A ASN 84 2 93.37 1 84 A PHE 85 2 97.42 1 85 A ASN 86 2 95.23 1 86 A LEU 87 2 97.76 1 87 A ASP 88 2 94.48 1 88 A THR 89 2 97.37 1 89 A HIS 90 2 96.72 1 90 A GLY 91 2 98.53 1 91 A PHE 92 2 98.37 1 92 A ALA 93 2 98.30 1 93 A TRP 94 2 97.95 1 94 A VAL 95 2 96.73 1 95 A LYS 96 2 86.46 1 96 A HIS 97 2 94.01 1 97 A LYS 98 2 86.80 1 98 A THR 99 2 95.83 1 99 A SER 100 2 94.95 1 100 A VAL 101 2 95.89 1 101 A THR 102 2 91.81 1 102 A GLU 103 2 84.90 1 103 A PHE 104 2 96.53 1 104 A ALA 105 2 95.26 1 105 A ASP 106 2 94.47 1 106 A TYR 107 2 92.71 1 107 A LEU 108 2 92.02 1 108 A ALA 109 2 96.93 1 109 A ILE 110 2 96.92 1 110 A ARG 111 2 86.75 1 111 A GLN 112 2 90.52 1 112 A GLY 113 2 97.05 1 113 A PRO 114 2 97.16 1 114 A TYR 115 2 98.04 1 115 A TYR 116 2 97.85 1 116 A GLY 117 2 98.11 1 117 A GLU 118 2 96.02 1 118 A VAL 119 2 97.85 1 119 A ALA 120 2 98.19 1 120 A GLU 121 2 86.25 1 121 A MET 122 2 96.36 1 122 A LEU 123 2 97.45 1 123 A LYS 124 2 92.77 1 124 A ARG 125 2 83.55 1 125 A VAL 126 2 96.53 1 126 A THR 127 2 97.28 1 127 A GLY 128 2 97.55 1 128 A ALA 129 2 98.07 1 129 A THR 130 2 97.55 1 130 A LYS 131 2 93.96 1 131 A VAL 132 2 98.20 1 132 A HIS 133 2 94.06 1 133 A VAL 134 2 98.03 1 134 A ILE 135 2 97.32 1 135 A GLY 136 2 97.94 1 136 A HIS 137 2 97.06 1 137 A LEU 138 2 94.03 1 138 A HIS 139 2 94.36 1 139 A ARG 140 2 97.55 1 140 A SER 141 2 97.37 1 141 A LEU 142 2 96.95 1 142 A ASN 143 2 93.52 1 143 A TYR 144 2 95.14 1 144 A ASN 145 2 92.64 1 145 A ASP 146 2 93.99 1 146 A THR 147 2 96.17 1 147 A THR 148 2 92.84 1 148 A GLU 149 2 91.29 1 149 A GLU 150 2 89.42 1 150 A GLU 151 2 95.95 1 151 A LYS 152 2 91.06 1 152 A ASN 153 2 94.27 1 153 A ALA 154 2 95.98 1 154 A PRO 155 2 95.32 1 155 A ASP 156 2 95.62 1 156 A MET 157 2 93.87 1 157 A THR 158 2 94.44 1 158 A MET 159 2 94.54 1 159 A THR 160 2 95.21 1 160 A LYS 161 2 89.51 1 161 A GLY 162 2 96.59 1 162 A GLN 163 2 92.00 1 163 A THR 164 2 97.29 1 164 A PRO 165 2 97.78 1 165 A GLY 166 2 97.71 1 166 A ARG 167 2 92.98 1 167 A PHE 168 2 92.51 1 168 A VAL 169 2 98.37 1 169 A HIS 170 2 98.40 1 170 A VAL 171 2 98.28 1 171 A ASP 172 2 97.48 1 172 A GLN 173 2 91.94 1 173 A SER 174 2 97.66 1 174 A TYR 175 2 95.79 1 175 A GLN 176 2 93.21 1 176 A GLY 177 2 97.70 1 177 A ALA 178 2 97.84 1 178 A VAL 179 2 97.16 1 179 A ARG 180 2 94.03 1 180 A ARG 181 2 92.56 1 181 A LEU 182 2 97.51 1 182 A TYR 183 2 97.10 1 183 A LEU 184 2 96.73 1 184 A ASP 185 2 94.65 1 185 A LEU 186 2 96.82 1 186 A PRO 187 2 97.52 1 187 A GLN 188 2 91.48 1 188 A GLU 189 2 86.20 1 189 A GLU 190 2 89.84 1 190 A ALA 191 2 97.69 1 191 A ARG 192 2 87.76 1 192 A ARG 193 2 93.45 1 193 A LEU 194 2 97.43 1 194 A GLU 195 2 96.32 1 195 A LYS 196 2 91.28 1 196 A THR 197 2 95.48 1 197 A ARG 198 2 95.54 1 198 A TRP 199 2 97.92 1 199 A ALA 200 2 98.37 1 200 A ILE 201 2 98.40 1 201 A ILE 202 2 98.50 1 202 A ASN 203 2 96.15 1 203 A VAL 204 2 98.43 1 204 A TRP 205 2 98.47 1 205 A ARG 206 2 95.67 1 206 A PRO 207 2 97.97 1 207 A VAL 208 2 97.20 1 208 A ARG 209 2 90.08 1 209 A LYS 210 2 93.74 1 210 A VAL 211 2 97.25 1 211 A THR 212 2 95.94 1 212 A ASN 213 2 95.62 1 213 A GLU 214 2 93.13 1 214 A PRO 215 2 97.87 1 215 A LEU 216 2 98.33 1 216 A ALA 217 2 98.74 1 217 A VAL 218 2 98.47 1 218 A CYS 219 2 97.69 1 219 A ASP 220 2 97.73 1 220 A ALA 221 2 98.28 1 221 A ARG 222 2 95.46 1 222 A SER 223 2 97.78 1 223 A VAL 224 2 97.25 1 224 A ARG 225 2 94.46 1 225 A GLU 226 2 89.09 1 226 A ASP 227 2 95.60 1 227 A GLU 228 2 97.03 1 228 A LEU 229 2 97.55 1 229 A PHE 230 2 97.05 1 230 A ASN 231 2 96.03 1 231 A THR 232 2 96.80 1 232 A LEU 233 2 96.90 1 233 A HIS 234 2 95.25 1 234 A LEU 235 2 97.88 1 235 A VAL 236 2 97.16 1 236 A PRO 237 2 96.98 1 237 A MET 238 2 87.74 1 238 A ARG 239 2 82.34 1 239 A TRP 240 2 92.33 1 240 A PRO 241 2 93.36 1 241 A ASP 242 2 91.69 1 242 A ALA 243 2 95.15 1 243 A ALA 244 2 96.09 1 244 A PRO 245 2 97.09 1 245 A GLN 246 2 88.01 1 246 A GLU 247 2 94.93 1 247 A ASN 248 2 91.87 1 248 A GLN 249 2 95.40 1 249 A MET 250 2 95.79 1 250 A TRP 251 2 97.56 1 251 A ALA 252 2 98.25 1 252 A VAL 253 2 98.30 1 253 A ALA 254 2 98.09 1 254 A PRO 255 2 97.74 1 255 A PRO 256 2 97.95 1 256 A LYS 257 2 87.35 1 257 A THR 258 2 95.49 1 258 A PRO 259 2 95.02 1 259 A THR 260 2 94.40 1 260 A GLN 261 2 95.35 1 261 A HIS 262 2 97.50 1 262 A LYS 263 2 89.12 1 263 A TRP 264 2 98.60 1 264 A HIS 265 2 96.48 1 265 A TYR 266 2 97.58 1 266 A VAL 267 2 97.62 1 267 A SER 268 2 96.41 1 268 A GLY 269 2 96.75 1 269 A MET 270 2 97.10 1 270 A THR 271 2 95.82 1 271 A GLU 272 2 92.95 1 272 A ASP 273 2 93.94 1 273 A GLU 274 2 96.31 1 274 A ALA 275 2 98.20 1 275 A LEU 276 2 98.33 1 276 A LEU 277 2 97.85 1 277 A ILE 278 2 98.53 1 278 A LYS 279 2 96.41 1 279 A MET 280 2 97.12 1 280 A PHE 281 2 97.78 1 281 A ASP 282 2 97.34 1 282 A SER 283 2 96.93 1 283 A LYS 284 2 89.48 1 284 A LYS 285 2 89.44 1 285 A ASP 286 2 92.87 1 286 A GLY 287 2 95.65 1 287 A THR 288 2 94.87 1 288 A ALA 289 2 97.94 1 289 A ARG 290 2 96.06 1 290 A ARG 291 2 95.41 1 291 A VAL 292 2 98.41 1 292 A PRO 293 2 98.65 1 293 A HIS 294 2 98.66 1 294 A SER 295 2 98.59 1 295 A SER 296 2 97.69 1 296 A PHE 297 2 97.64 1 297 A PRO 298 2 95.80 1 298 A THR 299 2 94.71 1 299 A PRO 300 2 93.64 1 300 A ASP 301 2 93.53 1 301 A ASP 302 2 95.20 1 302 A PHE 303 2 93.37 1 303 A GLY 304 2 94.72 1 304 A GLU 305 2 89.14 1 305 A PRO 306 2 96.85 1 306 A ARG 307 2 96.88 1 307 A ALA 308 2 98.15 1 308 A SER 309 2 98.52 1 309 A THR 310 2 96.53 1 310 A GLU 311 2 97.23 1 311 A THR 312 2 97.97 1 312 A ARG 313 2 86.97 1 313 A CYS 314 2 98.60 1 314 A PHE 315 2 98.36 1 315 A VAL 316 2 98.30 1 316 A PHE 317 2 98.25 1 317 A TRP 318 2 97.80 1 318 A GLU 319 2 96.65 1 319 A ASP 320 2 95.29 1 320 A GLN 321 2 92.15 1 321 A GLU 322 2 82.67 1 322 A ALA 323 2 86.37 1 323 A GLU 324 2 70.56 1 324 A ALA 325 2 57.36 1 325 A LEU 326 2 50.58 1 326 A GLU 327 2 42.38 1 327 A HIS 328 2 40.61 1 328 A HIS 329 2 37.09 1 329 A HIS 330 2 40.21 1 330 A HIS 331 2 33.68 1 331 A HIS 332 2 35.36 1 332 A HIS 333 2 30.52 1 333 B MET 1 2 34.29 1 334 B THR 2 2 30.90 1 335 B SER 3 2 35.46 1 336 B THR 4 2 37.25 1 337 B THR 5 2 38.87 1 338 B THR 6 2 37.35 1 339 B THR 7 2 34.90 1 340 B THR 8 2 33.32 1 341 B GLU 9 2 34.31 1 342 B THR 10 2 33.98 1 343 B LEU 11 2 39.01 1 344 B GLN 12 2 36.06 1 345 B GLU 13 2 37.56 1 346 B ALA 14 2 46.65 1 347 B VAL 15 2 44.63 1 348 B PRO 16 2 46.98 1 349 B PHE 17 2 44.19 1 350 B VAL 18 2 51.48 1 351 B ALA 19 2 54.88 1 352 B PRO 20 2 49.83 1 353 B PRO 21 2 51.01 1 354 B SER 22 2 47.20 1 355 B PRO 23 2 47.67 1 356 B PRO 24 2 49.68 1 357 B GLU 25 2 42.85 1 358 B ASP 26 2 42.34 1 359 B VAL 27 2 47.57 1 360 B ASN 28 2 47.79 1 361 B ASN 29 2 43.33 1 362 B LYS 30 2 55.11 1 363 B GLU 31 2 57.14 1 364 B LEU 32 2 67.47 1 365 B PRO 33 2 67.46 1 366 B GLU 34 2 70.07 1 367 B LYS 35 2 87.32 1 368 B PRO 36 2 94.90 1 369 B TYR 37 2 94.99 1 370 B TYR 38 2 96.05 1 371 B ASP 39 2 96.20 1 372 B VAL 40 2 94.64 1 373 B GLU 41 2 87.89 1 374 B PHE 42 2 97.03 1 375 B ASN 43 2 97.26 1 376 B TYR 44 2 98.28 1 377 B ARG 45 2 96.53 1 378 B LEU 46 2 97.44 1 379 B ASP 47 2 95.61 1 380 B PRO 48 2 96.84 1 381 B ARG 49 2 93.12 1 382 B ASP 50 2 95.89 1 383 B GLY 51 2 97.01 1 384 B GLY 52 2 97.56 1 385 B ASP 53 2 97.14 1 386 B GLU 54 2 95.21 1 387 B VAL 55 2 97.98 1 388 B ILE 56 2 97.84 1 389 B TRP 57 2 97.59 1 390 B GLY 58 2 97.74 1 391 B GLY 59 2 97.21 1 392 B THR 60 2 97.35 1 393 B VAL 61 2 96.21 1 394 B GLY 62 2 97.36 1 395 B LEU 63 2 95.95 1 396 B MET 64 2 88.53 1 397 B ARG 65 2 95.52 1 398 B ARG 66 2 95.55 1 399 B LYS 67 2 90.48 1 400 B TYR 68 2 97.33 1 401 B GLU 69 2 94.75 1 402 B THR 70 2 94.32 1 403 B ARG 71 2 94.82 1 404 B THR 72 2 95.96 1 405 B VAL 73 2 96.92 1 406 B ARG 74 2 94.02 1 407 B ILE 75 2 97.29 1 408 B ASN 76 2 94.37 1 409 B ASN 77 2 96.54 1 410 B GLU 78 2 96.65 1 411 B ARG 79 2 94.66 1 412 B GLY 80 2 95.33 1 413 B ASN 81 2 91.05 1 414 B GLU 82 2 94.50 1 415 B HIS 83 2 88.65 1 416 B ASN 84 2 93.84 1 417 B PHE 85 2 97.68 1 418 B ASN 86 2 95.44 1 419 B LEU 87 2 97.82 1 420 B ASP 88 2 94.62 1 421 B THR 89 2 97.42 1 422 B HIS 90 2 96.83 1 423 B GLY 91 2 98.56 1 424 B PHE 92 2 98.43 1 425 B ALA 93 2 98.39 1 426 B TRP 94 2 98.12 1 427 B VAL 95 2 96.93 1 428 B LYS 96 2 87.02 1 429 B HIS 97 2 93.93 1 430 B LYS 98 2 87.26 1 431 B THR 99 2 96.06 1 432 B SER 100 2 95.30 1 433 B VAL 101 2 96.14 1 434 B THR 102 2 92.24 1 435 B GLU 103 2 85.24 1 436 B PHE 104 2 96.72 1 437 B ALA 105 2 95.57 1 438 B ASP 106 2 94.97 1 439 B TYR 107 2 92.80 1 440 B LEU 108 2 92.21 1 441 B ALA 109 2 97.18 1 442 B ILE 110 2 97.18 1 443 B ARG 111 2 86.87 1 444 B GLN 112 2 90.83 1 445 B GLY 113 2 97.19 1 446 B PRO 114 2 97.36 1 447 B TYR 115 2 98.06 1 448 B TYR 116 2 97.86 1 449 B GLY 117 2 98.18 1 450 B GLU 118 2 96.23 1 451 B VAL 119 2 97.96 1 452 B ALA 120 2 98.25 1 453 B GLU 121 2 86.69 1 454 B MET 122 2 96.61 1 455 B LEU 123 2 97.57 1 456 B LYS 124 2 93.00 1 457 B ARG 125 2 83.81 1 458 B VAL 126 2 96.73 1 459 B THR 127 2 97.42 1 460 B GLY 128 2 97.69 1 461 B ALA 129 2 98.13 1 462 B THR 130 2 97.67 1 463 B LYS 131 2 94.13 1 464 B VAL 132 2 98.25 1 465 B HIS 133 2 94.00 1 466 B VAL 134 2 98.11 1 467 B ILE 135 2 97.38 1 468 B GLY 136 2 97.98 1 469 B HIS 137 2 97.27 1 470 B LEU 138 2 94.21 1 471 B HIS 139 2 94.42 1 472 B ARG 140 2 97.66 1 473 B SER 141 2 97.44 1 474 B LEU 142 2 97.04 1 475 B ASN 143 2 93.62 1 476 B TYR 144 2 95.38 1 477 B ASN 145 2 93.05 1 478 B ASP 146 2 94.32 1 479 B THR 147 2 96.29 1 480 B THR 148 2 93.18 1 481 B GLU 149 2 91.75 1 482 B GLU 150 2 89.70 1 483 B GLU 151 2 96.18 1 484 B LYS 152 2 91.40 1 485 B ASN 153 2 94.36 1 486 B ALA 154 2 96.18 1 487 B PRO 155 2 95.48 1 488 B ASP 156 2 95.81 1 489 B MET 157 2 93.99 1 490 B THR 158 2 94.52 1 491 B MET 159 2 94.60 1 492 B THR 160 2 95.26 1 493 B LYS 161 2 89.49 1 494 B GLY 162 2 96.70 1 495 B GLN 163 2 92.21 1 496 B THR 164 2 97.42 1 497 B PRO 165 2 97.95 1 498 B GLY 166 2 97.85 1 499 B ARG 167 2 93.70 1 500 B PHE 168 2 92.84 1 501 B VAL 169 2 98.41 1 502 B HIS 170 2 98.41 1 503 B VAL 171 2 98.26 1 504 B ASP 172 2 97.54 1 505 B GLN 173 2 92.10 1 506 B SER 174 2 97.67 1 507 B TYR 175 2 96.01 1 508 B GLN 176 2 93.36 1 509 B GLY 177 2 97.69 1 510 B ALA 178 2 97.89 1 511 B VAL 179 2 97.24 1 512 B ARG 180 2 93.92 1 513 B ARG 181 2 92.55 1 514 B LEU 182 2 97.55 1 515 B TYR 183 2 97.15 1 516 B LEU 184 2 96.71 1 517 B ASP 185 2 94.74 1 518 B LEU 186 2 96.87 1 519 B PRO 187 2 97.53 1 520 B GLN 188 2 91.79 1 521 B GLU 189 2 86.10 1 522 B GLU 190 2 89.78 1 523 B ALA 191 2 97.76 1 524 B ARG 192 2 87.69 1 525 B ARG 193 2 93.72 1 526 B LEU 194 2 97.45 1 527 B GLU 195 2 96.35 1 528 B LYS 196 2 91.43 1 529 B THR 197 2 95.65 1 530 B ARG 198 2 95.77 1 531 B TRP 199 2 97.97 1 532 B ALA 200 2 98.44 1 533 B ILE 201 2 98.44 1 534 B ILE 202 2 98.54 1 535 B ASN 203 2 96.26 1 536 B VAL 204 2 98.48 1 537 B TRP 205 2 98.50 1 538 B ARG 206 2 95.81 1 539 B PRO 207 2 98.07 1 540 B VAL 208 2 97.33 1 541 B ARG 209 2 90.13 1 542 B LYS 210 2 93.86 1 543 B VAL 211 2 97.40 1 544 B THR 212 2 96.22 1 545 B ASN 213 2 95.76 1 546 B GLU 214 2 93.36 1 547 B PRO 215 2 97.98 1 548 B LEU 216 2 98.36 1 549 B ALA 217 2 98.76 1 550 B VAL 218 2 98.51 1 551 B CYS 219 2 97.67 1 552 B ASP 220 2 97.81 1 553 B ALA 221 2 98.30 1 554 B ARG 222 2 95.60 1 555 B SER 223 2 97.82 1 556 B VAL 224 2 97.30 1 557 B ARG 225 2 94.09 1 558 B GLU 226 2 89.46 1 559 B ASP 227 2 95.41 1 560 B GLU 228 2 97.10 1 561 B LEU 229 2 97.56 1 562 B PHE 230 2 97.03 1 563 B ASN 231 2 95.98 1 564 B THR 232 2 96.90 1 565 B LEU 233 2 96.78 1 566 B HIS 234 2 95.30 1 567 B LEU 235 2 97.85 1 568 B VAL 236 2 97.17 1 569 B PRO 237 2 96.97 1 570 B MET 238 2 87.73 1 571 B ARG 239 2 82.13 1 572 B TRP 240 2 92.48 1 573 B PRO 241 2 93.05 1 574 B ASP 242 2 91.36 1 575 B ALA 243 2 94.97 1 576 B ALA 244 2 95.95 1 577 B PRO 245 2 97.02 1 578 B GLN 246 2 88.03 1 579 B GLU 247 2 94.82 1 580 B ASN 248 2 91.94 1 581 B GLN 249 2 95.38 1 582 B MET 250 2 95.79 1 583 B TRP 251 2 97.55 1 584 B ALA 252 2 98.23 1 585 B VAL 253 2 98.31 1 586 B ALA 254 2 98.05 1 587 B PRO 255 2 97.81 1 588 B PRO 256 2 98.02 1 589 B LYS 257 2 87.72 1 590 B THR 258 2 95.71 1 591 B PRO 259 2 95.45 1 592 B THR 260 2 94.80 1 593 B GLN 261 2 95.29 1 594 B HIS 262 2 97.50 1 595 B LYS 263 2 89.43 1 596 B TRP 264 2 98.63 1 597 B HIS 265 2 96.61 1 598 B TYR 266 2 97.70 1 599 B VAL 267 2 97.75 1 600 B SER 268 2 96.63 1 601 B GLY 269 2 96.91 1 602 B MET 270 2 97.20 1 603 B THR 271 2 96.12 1 604 B GLU 272 2 93.39 1 605 B ASP 273 2 94.41 1 606 B GLU 274 2 96.60 1 607 B ALA 275 2 98.31 1 608 B LEU 276 2 98.41 1 609 B LEU 277 2 97.96 1 610 B ILE 278 2 98.51 1 611 B LYS 279 2 96.53 1 612 B MET 280 2 97.33 1 613 B PHE 281 2 97.88 1 614 B ASP 282 2 97.40 1 615 B SER 283 2 97.12 1 616 B LYS 284 2 89.57 1 617 B LYS 285 2 89.65 1 618 B ASP 286 2 93.18 1 619 B GLY 287 2 95.70 1 620 B THR 288 2 94.99 1 621 B ALA 289 2 97.98 1 622 B ARG 290 2 96.26 1 623 B ARG 291 2 95.68 1 624 B VAL 292 2 98.40 1 625 B PRO 293 2 98.67 1 626 B HIS 294 2 98.66 1 627 B SER 295 2 98.62 1 628 B SER 296 2 97.83 1 629 B PHE 297 2 97.79 1 630 B PRO 298 2 96.08 1 631 B THR 299 2 95.06 1 632 B PRO 300 2 94.18 1 633 B ASP 301 2 94.08 1 634 B ASP 302 2 95.54 1 635 B PHE 303 2 93.61 1 636 B GLY 304 2 95.10 1 637 B GLU 305 2 89.15 1 638 B PRO 306 2 97.06 1 639 B ARG 307 2 96.94 1 640 B ALA 308 2 98.19 1 641 B SER 309 2 98.59 1 642 B THR 310 2 96.31 1 643 B GLU 311 2 97.38 1 644 B THR 312 2 98.07 1 645 B ARG 313 2 87.11 1 646 B CYS 314 2 98.63 1 647 B PHE 315 2 98.40 1 648 B VAL 316 2 98.38 1 649 B PHE 317 2 98.30 1 650 B TRP 318 2 97.84 1 651 B GLU 319 2 96.68 1 652 B ASP 320 2 95.43 1 653 B GLN 321 2 92.45 1 654 B GLU 322 2 82.74 1 655 B ALA 323 2 86.85 1 656 B GLU 324 2 70.82 1 657 B ALA 325 2 57.17 1 658 B LEU 326 2 50.50 1 659 B GLU 327 2 42.61 1 660 B HIS 328 2 40.08 1 661 B HIS 329 2 36.73 1 662 B HIS 330 2 39.86 1 663 B HIS 331 2 33.21 1 664 B HIS 332 2 34.88 1 665 B HIS 333 2 30.73 1 666 C CU . 2 97.93 1 667 D CU . 2 97.77 1 668 E OGA . 2 96.13 1 669 F OGA . 2 96.17 1 670 G JD9 . 2 67.10 1 671 H JD9 . 2 67.09 1 672 # _ma_software_group.group_id 1 _ma_software_group.ordinal_id 1 _ma_software_group.software_id 1 # loop_ _ma_target_entity.data_id _ma_target_entity.entity_id _ma_target_entity.origin 1 1 . 1 2 . 1 3 . 1 4 . 1 5 . 1 6 . 1 7 . 1 8 . # loop_ _ma_target_entity_instance.asym_id _ma_target_entity_instance.details _ma_target_entity_instance.entity_id A . 1 B . 2 C . 3 D . 4 E . 5 F . 6 G . 7 H . 8 # 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_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.pdb_ins_code _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.pdb_strand_id C 1 3 CU . 1 C D 1 4 CU . 1 D E 1 5 OGA . 1 E F 1 6 OGA . 1 F G 1 7 JD9 . 1 G H 1 8 JD9 . 1 H # 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 THR . 2 A 2 A 3 1 n SER . 3 A 3 A 4 1 n THR . 4 A 4 A 5 1 n THR . 5 A 5 A 6 1 n THR . 6 A 6 A 7 1 n THR . 7 A 7 A 8 1 n THR . 8 A 8 A 9 1 n GLU . 9 A 9 A 10 1 n THR . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n GLN . 12 A 12 A 13 1 n GLU . 13 A 13 A 14 1 n ALA . 14 A 14 A 15 1 n VAL . 15 A 15 A 16 1 n PRO . 16 A 16 A 17 1 n PHE . 17 A 17 A 18 1 n VAL . 18 A 18 A 19 1 n ALA . 19 A 19 A 20 1 n PRO . 20 A 20 A 21 1 n PRO . 21 A 21 A 22 1 n SER . 22 A 22 A 23 1 n PRO . 23 A 23 A 24 1 n PRO . 24 A 24 A 25 1 n GLU . 25 A 25 A 26 1 n ASP . 26 A 26 A 27 1 n VAL . 27 A 27 A 28 1 n ASN . 28 A 28 A 29 1 n ASN . 29 A 29 A 30 1 n LYS . 30 A 30 A 31 1 n GLU . 31 A 31 A 32 1 n LEU . 32 A 32 A 33 1 n PRO . 33 A 33 A 34 1 n GLU . 34 A 34 A 35 1 n LYS . 35 A 35 A 36 1 n PRO . 36 A 36 A 37 1 n TYR . 37 A 37 A 38 1 n TYR . 38 A 38 A 39 1 n ASP . 39 A 39 A 40 1 n VAL . 40 A 40 A 41 1 n GLU . 41 A 41 A 42 1 n PHE . 42 A 42 A 43 1 n ASN . 43 A 43 A 44 1 n TYR . 44 A 44 A 45 1 n ARG . 45 A 45 A 46 1 n LEU . 46 A 46 A 47 1 n ASP . 47 A 47 A 48 1 n PRO . 48 A 48 A 49 1 n ARG . 49 A 49 A 50 1 n ASP . 50 A 50 A 51 1 n GLY . 51 A 51 A 52 1 n GLY . 52 A 52 A 53 1 n ASP . 53 A 53 A 54 1 n GLU . 54 A 54 A 55 1 n VAL . 55 A 55 A 56 1 n ILE . 56 A 56 A 57 1 n TRP . 57 A 57 A 58 1 n GLY . 58 A 58 A 59 1 n GLY . 59 A 59 A 60 1 n THR . 60 A 60 A 61 1 n VAL . 61 A 61 A 62 1 n GLY . 62 A 62 A 63 1 n LEU . 63 A 63 A 64 1 n MET . 64 A 64 A 65 1 n ARG . 65 A 65 A 66 1 n ARG . 66 A 66 A 67 1 n LYS . 67 A 67 A 68 1 n TYR . 68 A 68 A 69 1 n GLU . 69 A 69 A 70 1 n THR . 70 A 70 A 71 1 n ARG . 71 A 71 A 72 1 n THR . 72 A 72 A 73 1 n VAL . 73 A 73 A 74 1 n ARG . 74 A 74 A 75 1 n ILE . 75 A 75 A 76 1 n ASN . 76 A 76 A 77 1 n ASN . 77 A 77 A 78 1 n GLU . 78 A 78 A 79 1 n ARG . 79 A 79 A 80 1 n GLY . 80 A 80 A 81 1 n ASN . 81 A 81 A 82 1 n GLU . 82 A 82 A 83 1 n HIS . 83 A 83 A 84 1 n ASN . 84 A 84 A 85 1 n PHE . 85 A 85 A 86 1 n ASN . 86 A 86 A 87 1 n LEU . 87 A 87 A 88 1 n ASP . 88 A 88 A 89 1 n THR . 89 A 89 A 90 1 n HIS . 90 A 90 A 91 1 n GLY . 91 A 91 A 92 1 n PHE . 92 A 92 A 93 1 n ALA . 93 A 93 A 94 1 n TRP . 94 A 94 A 95 1 n VAL . 95 A 95 A 96 1 n LYS . 96 A 96 A 97 1 n HIS . 97 A 97 A 98 1 n LYS . 98 A 98 A 99 1 n THR . 99 A 99 A 100 1 n SER . 100 A 100 A 101 1 n VAL . 101 A 101 A 102 1 n THR . 102 A 102 A 103 1 n GLU . 103 A 103 A 104 1 n PHE . 104 A 104 A 105 1 n ALA . 105 A 105 A 106 1 n ASP . 106 A 106 A 107 1 n TYR . 107 A 107 A 108 1 n LEU . 108 A 108 A 109 1 n ALA . 109 A 109 A 110 1 n ILE . 110 A 110 A 111 1 n ARG . 111 A 111 A 112 1 n GLN . 112 A 112 A 113 1 n GLY . 113 A 113 A 114 1 n PRO . 114 A 114 A 115 1 n TYR . 115 A 115 A 116 1 n TYR . 116 A 116 A 117 1 n GLY . 117 A 117 A 118 1 n GLU . 118 A 118 A 119 1 n VAL . 119 A 119 A 120 1 n ALA . 120 A 120 A 121 1 n GLU . 121 A 121 A 122 1 n MET . 122 A 122 A 123 1 n LEU . 123 A 123 A 124 1 n LYS . 124 A 124 A 125 1 n ARG . 125 A 125 A 126 1 n VAL . 126 A 126 A 127 1 n THR . 127 A 127 A 128 1 n GLY . 128 A 128 A 129 1 n ALA . 129 A 129 A 130 1 n THR . 130 A 130 A 131 1 n LYS . 131 A 131 A 132 1 n VAL . 132 A 132 A 133 1 n HIS . 133 A 133 A 134 1 n VAL . 134 A 134 A 135 1 n ILE . 135 A 135 A 136 1 n GLY . 136 A 136 A 137 1 n HIS . 137 A 137 A 138 1 n LEU . 138 A 138 A 139 1 n HIS . 139 A 139 A 140 1 n ARG . 140 A 140 A 141 1 n SER . 141 A 141 A 142 1 n LEU . 142 A 142 A 143 1 n ASN . 143 A 143 A 144 1 n TYR . 144 A 144 A 145 1 n ASN . 145 A 145 A 146 1 n ASP . 146 A 146 A 147 1 n THR . 147 A 147 A 148 1 n THR . 148 A 148 A 149 1 n GLU . 149 A 149 A 150 1 n GLU . 150 A 150 A 151 1 n GLU . 151 A 151 A 152 1 n LYS . 152 A 152 A 153 1 n ASN . 153 A 153 A 154 1 n ALA . 154 A 154 A 155 1 n PRO . 155 A 155 A 156 1 n ASP . 156 A 156 A 157 1 n MET . 157 A 157 A 158 1 n THR . 158 A 158 A 159 1 n MET . 159 A 159 A 160 1 n THR . 160 A 160 A 161 1 n LYS . 161 A 161 A 162 1 n GLY . 162 A 162 A 163 1 n GLN . 163 A 163 A 164 1 n THR . 164 A 164 A 165 1 n PRO . 165 A 165 A 166 1 n GLY . 166 A 166 A 167 1 n ARG . 167 A 167 A 168 1 n PHE . 168 A 168 A 169 1 n VAL . 169 A 169 A 170 1 n HIS . 170 A 170 A 171 1 n VAL . 171 A 171 A 172 1 n ASP . 172 A 172 A 173 1 n GLN . 173 A 173 A 174 1 n SER . 174 A 174 A 175 1 n TYR . 175 A 175 A 176 1 n GLN . 176 A 176 A 177 1 n GLY . 177 A 177 A 178 1 n ALA . 178 A 178 A 179 1 n VAL . 179 A 179 A 180 1 n ARG . 180 A 180 A 181 1 n ARG . 181 A 181 A 182 1 n LEU . 182 A 182 A 183 1 n TYR . 183 A 183 A 184 1 n LEU . 184 A 184 A 185 1 n ASP . 185 A 185 A 186 1 n LEU . 186 A 186 A 187 1 n PRO . 187 A 187 A 188 1 n GLN . 188 A 188 A 189 1 n GLU . 189 A 189 A 190 1 n GLU . 190 A 190 A 191 1 n ALA . 191 A 191 A 192 1 n ARG . 192 A 192 A 193 1 n ARG . 193 A 193 A 194 1 n LEU . 194 A 194 A 195 1 n GLU . 195 A 195 A 196 1 n LYS . 196 A 196 A 197 1 n THR . 197 A 197 A 198 1 n ARG . 198 A 198 A 199 1 n TRP . 199 A 199 A 200 1 n ALA . 200 A 200 A 201 1 n ILE . 201 A 201 A 202 1 n ILE . 202 A 202 A 203 1 n ASN . 203 A 203 A 204 1 n VAL . 204 A 204 A 205 1 n TRP . 205 A 205 A 206 1 n ARG . 206 A 206 A 207 1 n PRO . 207 A 207 A 208 1 n VAL . 208 A 208 A 209 1 n ARG . 209 A 209 A 210 1 n LYS . 210 A 210 A 211 1 n VAL . 211 A 211 A 212 1 n THR . 212 A 212 A 213 1 n ASN . 213 A 213 A 214 1 n GLU . 214 A 214 A 215 1 n PRO . 215 A 215 A 216 1 n LEU . 216 A 216 A 217 1 n ALA . 217 A 217 A 218 1 n VAL . 218 A 218 A 219 1 n CYS . 219 A 219 A 220 1 n ASP . 220 A 220 A 221 1 n ALA . 221 A 221 A 222 1 n ARG . 222 A 222 A 223 1 n SER . 223 A 223 A 224 1 n VAL . 224 A 224 A 225 1 n ARG . 225 A 225 A 226 1 n GLU . 226 A 226 A 227 1 n ASP . 227 A 227 A 228 1 n GLU . 228 A 228 A 229 1 n LEU . 229 A 229 A 230 1 n PHE . 230 A 230 A 231 1 n ASN . 231 A 231 A 232 1 n THR . 232 A 232 A 233 1 n LEU . 233 A 233 A 234 1 n HIS . 234 A 234 A 235 1 n LEU . 235 A 235 A 236 1 n VAL . 236 A 236 A 237 1 n PRO . 237 A 237 A 238 1 n MET . 238 A 238 A 239 1 n ARG . 239 A 239 A 240 1 n TRP . 240 A 240 A 241 1 n PRO . 241 A 241 A 242 1 n ASP . 242 A 242 A 243 1 n ALA . 243 A 243 A 244 1 n ALA . 244 A 244 A 245 1 n PRO . 245 A 245 A 246 1 n GLN . 246 A 246 A 247 1 n GLU . 247 A 247 A 248 1 n ASN . 248 A 248 A 249 1 n GLN . 249 A 249 A 250 1 n MET . 250 A 250 A 251 1 n TRP . 251 A 251 A 252 1 n ALA . 252 A 252 A 253 1 n VAL . 253 A 253 A 254 1 n ALA . 254 A 254 A 255 1 n PRO . 255 A 255 A 256 1 n PRO . 256 A 256 A 257 1 n LYS . 257 A 257 A 258 1 n THR . 258 A 258 A 259 1 n PRO . 259 A 259 A 260 1 n THR . 260 A 260 A 261 1 n GLN . 261 A 261 A 262 1 n HIS . 262 A 262 A 263 1 n LYS . 263 A 263 A 264 1 n TRP . 264 A 264 A 265 1 n HIS . 265 A 265 A 266 1 n TYR . 266 A 266 A 267 1 n VAL . 267 A 267 A 268 1 n SER . 268 A 268 A 269 1 n GLY . 269 A 269 A 270 1 n MET . 270 A 270 A 271 1 n THR . 271 A 271 A 272 1 n GLU . 272 A 272 A 273 1 n ASP . 273 A 273 A 274 1 n GLU . 274 A 274 A 275 1 n ALA . 275 A 275 A 276 1 n LEU . 276 A 276 A 277 1 n LEU . 277 A 277 A 278 1 n ILE . 278 A 278 A 279 1 n LYS . 279 A 279 A 280 1 n MET . 280 A 280 A 281 1 n PHE . 281 A 281 A 282 1 n ASP . 282 A 282 A 283 1 n SER . 283 A 283 A 284 1 n LYS . 284 A 284 A 285 1 n LYS . 285 A 285 A 286 1 n ASP . 286 A 286 A 287 1 n GLY . 287 A 287 A 288 1 n THR . 288 A 288 A 289 1 n ALA . 289 A 289 A 290 1 n ARG . 290 A 290 A 291 1 n ARG . 291 A 291 A 292 1 n VAL . 292 A 292 A 293 1 n PRO . 293 A 293 A 294 1 n HIS . 294 A 294 A 295 1 n SER . 295 A 295 A 296 1 n SER . 296 A 296 A 297 1 n PHE . 297 A 297 A 298 1 n PRO . 298 A 298 A 299 1 n THR . 299 A 299 A 300 1 n PRO . 300 A 300 A 301 1 n ASP . 301 A 301 A 302 1 n ASP . 302 A 302 A 303 1 n PHE . 303 A 303 A 304 1 n GLY . 304 A 304 A 305 1 n GLU . 305 A 305 A 306 1 n PRO . 306 A 306 A 307 1 n ARG . 307 A 307 A 308 1 n ALA . 308 A 308 A 309 1 n SER . 309 A 309 A 310 1 n THR . 310 A 310 A 311 1 n GLU . 311 A 311 A 312 1 n THR . 312 A 312 A 313 1 n ARG . 313 A 313 A 314 1 n CYS . 314 A 314 A 315 1 n PHE . 315 A 315 A 316 1 n VAL . 316 A 316 A 317 1 n PHE . 317 A 317 A 318 1 n TRP . 318 A 318 A 319 1 n GLU . 319 A 319 A 320 1 n ASP . 320 A 320 A 321 1 n GLN . 321 A 321 A 322 1 n GLU . 322 A 322 A 323 1 n ALA . 323 A 323 A 324 1 n GLU . 324 A 324 A 325 1 n ALA . 325 A 325 A 326 1 n LEU . 326 A 326 A 327 1 n GLU . 327 A 327 A 328 1 n HIS . 328 A 328 A 329 1 n HIS . 329 A 329 A 330 1 n HIS . 330 A 330 A 331 1 n HIS . 331 A 331 A 332 1 n HIS . 332 A 332 A 333 1 n HIS . 333 A 333 B 1 2 n MET . 1 B 1 B 2 2 n THR . 2 B 2 B 3 2 n SER . 3 B 3 B 4 2 n THR . 4 B 4 B 5 2 n THR . 5 B 5 B 6 2 n THR . 6 B 6 B 7 2 n THR . 7 B 7 B 8 2 n THR . 8 B 8 B 9 2 n GLU . 9 B 9 B 10 2 n THR . 10 B 10 B 11 2 n LEU . 11 B 11 B 12 2 n GLN . 12 B 12 B 13 2 n GLU . 13 B 13 B 14 2 n ALA . 14 B 14 B 15 2 n VAL . 15 B 15 B 16 2 n PRO . 16 B 16 B 17 2 n PHE . 17 B 17 B 18 2 n VAL . 18 B 18 B 19 2 n ALA . 19 B 19 B 20 2 n PRO . 20 B 20 B 21 2 n PRO . 21 B 21 B 22 2 n SER . 22 B 22 B 23 2 n PRO . 23 B 23 B 24 2 n PRO . 24 B 24 B 25 2 n GLU . 25 B 25 B 26 2 n ASP . 26 B 26 B 27 2 n VAL . 27 B 27 B 28 2 n ASN . 28 B 28 B 29 2 n ASN . 29 B 29 B 30 2 n LYS . 30 B 30 B 31 2 n GLU . 31 B 31 B 32 2 n LEU . 32 B 32 B 33 2 n PRO . 33 B 33 B 34 2 n GLU . 34 B 34 B 35 2 n LYS . 35 B 35 B 36 2 n PRO . 36 B 36 B 37 2 n TYR . 37 B 37 B 38 2 n TYR . 38 B 38 B 39 2 n ASP . 39 B 39 B 40 2 n VAL . 40 B 40 B 41 2 n GLU . 41 B 41 B 42 2 n PHE . 42 B 42 B 43 2 n ASN . 43 B 43 B 44 2 n TYR . 44 B 44 B 45 2 n ARG . 45 B 45 B 46 2 n LEU . 46 B 46 B 47 2 n ASP . 47 B 47 B 48 2 n PRO . 48 B 48 B 49 2 n ARG . 49 B 49 B 50 2 n ASP . 50 B 50 B 51 2 n GLY . 51 B 51 B 52 2 n GLY . 52 B 52 B 53 2 n ASP . 53 B 53 B 54 2 n GLU . 54 B 54 B 55 2 n VAL . 55 B 55 B 56 2 n ILE . 56 B 56 B 57 2 n TRP . 57 B 57 B 58 2 n GLY . 58 B 58 B 59 2 n GLY . 59 B 59 B 60 2 n THR . 60 B 60 B 61 2 n VAL . 61 B 61 B 62 2 n GLY . 62 B 62 B 63 2 n LEU . 63 B 63 B 64 2 n MET . 64 B 64 B 65 2 n ARG . 65 B 65 B 66 2 n ARG . 66 B 66 B 67 2 n LYS . 67 B 67 B 68 2 n TYR . 68 B 68 B 69 2 n GLU . 69 B 69 B 70 2 n THR . 70 B 70 B 71 2 n ARG . 71 B 71 B 72 2 n THR . 72 B 72 B 73 2 n VAL . 73 B 73 B 74 2 n ARG . 74 B 74 B 75 2 n ILE . 75 B 75 B 76 2 n ASN . 76 B 76 B 77 2 n ASN . 77 B 77 B 78 2 n GLU . 78 B 78 B 79 2 n ARG . 79 B 79 B 80 2 n GLY . 80 B 80 B 81 2 n ASN . 81 B 81 B 82 2 n GLU . 82 B 82 B 83 2 n HIS . 83 B 83 B 84 2 n ASN . 84 B 84 B 85 2 n PHE . 85 B 85 B 86 2 n ASN . 86 B 86 B 87 2 n LEU . 87 B 87 B 88 2 n ASP . 88 B 88 B 89 2 n THR . 89 B 89 B 90 2 n HIS . 90 B 90 B 91 2 n GLY . 91 B 91 B 92 2 n PHE . 92 B 92 B 93 2 n ALA . 93 B 93 B 94 2 n TRP . 94 B 94 B 95 2 n VAL . 95 B 95 B 96 2 n LYS . 96 B 96 B 97 2 n HIS . 97 B 97 B 98 2 n LYS . 98 B 98 B 99 2 n THR . 99 B 99 B 100 2 n SER . 100 B 100 B 101 2 n VAL . 101 B 101 B 102 2 n THR . 102 B 102 B 103 2 n GLU . 103 B 103 B 104 2 n PHE . 104 B 104 B 105 2 n ALA . 105 B 105 B 106 2 n ASP . 106 B 106 B 107 2 n TYR . 107 B 107 B 108 2 n LEU . 108 B 108 B 109 2 n ALA . 109 B 109 B 110 2 n ILE . 110 B 110 B 111 2 n ARG . 111 B 111 B 112 2 n GLN . 112 B 112 B 113 2 n GLY . 113 B 113 B 114 2 n PRO . 114 B 114 B 115 2 n TYR . 115 B 115 B 116 2 n TYR . 116 B 116 B 117 2 n GLY . 117 B 117 B 118 2 n GLU . 118 B 118 B 119 2 n VAL . 119 B 119 B 120 2 n ALA . 120 B 120 B 121 2 n GLU . 121 B 121 B 122 2 n MET . 122 B 122 B 123 2 n LEU . 123 B 123 B 124 2 n LYS . 124 B 124 B 125 2 n ARG . 125 B 125 B 126 2 n VAL . 126 B 126 B 127 2 n THR . 127 B 127 B 128 2 n GLY . 128 B 128 B 129 2 n ALA . 129 B 129 B 130 2 n THR . 130 B 130 B 131 2 n LYS . 131 B 131 B 132 2 n VAL . 132 B 132 B 133 2 n HIS . 133 B 133 B 134 2 n VAL . 134 B 134 B 135 2 n ILE . 135 B 135 B 136 2 n GLY . 136 B 136 B 137 2 n HIS . 137 B 137 B 138 2 n LEU . 138 B 138 B 139 2 n HIS . 139 B 139 B 140 2 n ARG . 140 B 140 B 141 2 n SER . 141 B 141 B 142 2 n LEU . 142 B 142 B 143 2 n ASN . 143 B 143 B 144 2 n TYR . 144 B 144 B 145 2 n ASN . 145 B 145 B 146 2 n ASP . 146 B 146 B 147 2 n THR . 147 B 147 B 148 2 n THR . 148 B 148 B 149 2 n GLU . 149 B 149 B 150 2 n GLU . 150 B 150 B 151 2 n GLU . 151 B 151 B 152 2 n LYS . 152 B 152 B 153 2 n ASN . 153 B 153 B 154 2 n ALA . 154 B 154 B 155 2 n PRO . 155 B 155 B 156 2 n ASP . 156 B 156 B 157 2 n MET . 157 B 157 B 158 2 n THR . 158 B 158 B 159 2 n MET . 159 B 159 B 160 2 n THR . 160 B 160 B 161 2 n LYS . 161 B 161 B 162 2 n GLY . 162 B 162 B 163 2 n GLN . 163 B 163 B 164 2 n THR . 164 B 164 B 165 2 n PRO . 165 B 165 B 166 2 n GLY . 166 B 166 B 167 2 n ARG . 167 B 167 B 168 2 n PHE . 168 B 168 B 169 2 n VAL . 169 B 169 B 170 2 n HIS . 170 B 170 B 171 2 n VAL . 171 B 171 B 172 2 n ASP . 172 B 172 B 173 2 n GLN . 173 B 173 B 174 2 n SER . 174 B 174 B 175 2 n TYR . 175 B 175 B 176 2 n GLN . 176 B 176 B 177 2 n GLY . 177 B 177 B 178 2 n ALA . 178 B 178 B 179 2 n VAL . 179 B 179 B 180 2 n ARG . 180 B 180 B 181 2 n ARG . 181 B 181 B 182 2 n LEU . 182 B 182 B 183 2 n TYR . 183 B 183 B 184 2 n LEU . 184 B 184 B 185 2 n ASP . 185 B 185 B 186 2 n LEU . 186 B 186 B 187 2 n PRO . 187 B 187 B 188 2 n GLN . 188 B 188 B 189 2 n GLU . 189 B 189 B 190 2 n GLU . 190 B 190 B 191 2 n ALA . 191 B 191 B 192 2 n ARG . 192 B 192 B 193 2 n ARG . 193 B 193 B 194 2 n LEU . 194 B 194 B 195 2 n GLU . 195 B 195 B 196 2 n LYS . 196 B 196 B 197 2 n THR . 197 B 197 B 198 2 n ARG . 198 B 198 B 199 2 n TRP . 199 B 199 B 200 2 n ALA . 200 B 200 B 201 2 n ILE . 201 B 201 B 202 2 n ILE . 202 B 202 B 203 2 n ASN . 203 B 203 B 204 2 n VAL . 204 B 204 B 205 2 n TRP . 205 B 205 B 206 2 n ARG . 206 B 206 B 207 2 n PRO . 207 B 207 B 208 2 n VAL . 208 B 208 B 209 2 n ARG . 209 B 209 B 210 2 n LYS . 210 B 210 B 211 2 n VAL . 211 B 211 B 212 2 n THR . 212 B 212 B 213 2 n ASN . 213 B 213 B 214 2 n GLU . 214 B 214 B 215 2 n PRO . 215 B 215 B 216 2 n LEU . 216 B 216 B 217 2 n ALA . 217 B 217 B 218 2 n VAL . 218 B 218 B 219 2 n CYS . 219 B 219 B 220 2 n ASP . 220 B 220 B 221 2 n ALA . 221 B 221 B 222 2 n ARG . 222 B 222 B 223 2 n SER . 223 B 223 B 224 2 n VAL . 224 B 224 B 225 2 n ARG . 225 B 225 B 226 2 n GLU . 226 B 226 B 227 2 n ASP . 227 B 227 B 228 2 n GLU . 228 B 228 B 229 2 n LEU . 229 B 229 B 230 2 n PHE . 230 B 230 B 231 2 n ASN . 231 B 231 B 232 2 n THR . 232 B 232 B 233 2 n LEU . 233 B 233 B 234 2 n HIS . 234 B 234 B 235 2 n LEU . 235 B 235 B 236 2 n VAL . 236 B 236 B 237 2 n PRO . 237 B 237 B 238 2 n MET . 238 B 238 B 239 2 n ARG . 239 B 239 B 240 2 n TRP . 240 B 240 B 241 2 n PRO . 241 B 241 B 242 2 n ASP . 242 B 242 B 243 2 n ALA . 243 B 243 B 244 2 n ALA . 244 B 244 B 245 2 n PRO . 245 B 245 B 246 2 n GLN . 246 B 246 B 247 2 n GLU . 247 B 247 B 248 2 n ASN . 248 B 248 B 249 2 n GLN . 249 B 249 B 250 2 n MET . 250 B 250 B 251 2 n TRP . 251 B 251 B 252 2 n ALA . 252 B 252 B 253 2 n VAL . 253 B 253 B 254 2 n ALA . 254 B 254 B 255 2 n PRO . 255 B 255 B 256 2 n PRO . 256 B 256 B 257 2 n LYS . 257 B 257 B 258 2 n THR . 258 B 258 B 259 2 n PRO . 259 B 259 B 260 2 n THR . 260 B 260 B 261 2 n GLN . 261 B 261 B 262 2 n HIS . 262 B 262 B 263 2 n LYS . 263 B 263 B 264 2 n TRP . 264 B 264 B 265 2 n HIS . 265 B 265 B 266 2 n TYR . 266 B 266 B 267 2 n VAL . 267 B 267 B 268 2 n SER . 268 B 268 B 269 2 n GLY . 269 B 269 B 270 2 n MET . 270 B 270 B 271 2 n THR . 271 B 271 B 272 2 n GLU . 272 B 272 B 273 2 n ASP . 273 B 273 B 274 2 n GLU . 274 B 274 B 275 2 n ALA . 275 B 275 B 276 2 n LEU . 276 B 276 B 277 2 n LEU . 277 B 277 B 278 2 n ILE . 278 B 278 B 279 2 n LYS . 279 B 279 B 280 2 n MET . 280 B 280 B 281 2 n PHE . 281 B 281 B 282 2 n ASP . 282 B 282 B 283 2 n SER . 283 B 283 B 284 2 n LYS . 284 B 284 B 285 2 n LYS . 285 B 285 B 286 2 n ASP . 286 B 286 B 287 2 n GLY . 287 B 287 B 288 2 n THR . 288 B 288 B 289 2 n ALA . 289 B 289 B 290 2 n ARG . 290 B 290 B 291 2 n ARG . 291 B 291 B 292 2 n VAL . 292 B 292 B 293 2 n PRO . 293 B 293 B 294 2 n HIS . 294 B 294 B 295 2 n SER . 295 B 295 B 296 2 n SER . 296 B 296 B 297 2 n PHE . 297 B 297 B 298 2 n PRO . 298 B 298 B 299 2 n THR . 299 B 299 B 300 2 n PRO . 300 B 300 B 301 2 n ASP . 301 B 301 B 302 2 n ASP . 302 B 302 B 303 2 n PHE . 303 B 303 B 304 2 n GLY . 304 B 304 B 305 2 n GLU . 305 B 305 B 306 2 n PRO . 306 B 306 B 307 2 n ARG . 307 B 307 B 308 2 n ALA . 308 B 308 B 309 2 n SER . 309 B 309 B 310 2 n THR . 310 B 310 B 311 2 n GLU . 311 B 311 B 312 2 n THR . 312 B 312 B 313 2 n ARG . 313 B 313 B 314 2 n CYS . 314 B 314 B 315 2 n PHE . 315 B 315 B 316 2 n VAL . 316 B 316 B 317 2 n PHE . 317 B 317 B 318 2 n TRP . 318 B 318 B 319 2 n GLU . 319 B 319 B 320 2 n ASP . 320 B 320 B 321 2 n GLN . 321 B 321 B 322 2 n GLU . 322 B 322 B 323 2 n ALA . 323 B 323 B 324 2 n GLU . 324 B 324 B 325 2 n ALA . 325 B 325 B 326 2 n LEU . 326 B 326 B 327 2 n GLU . 327 B 327 B 328 2 n HIS . 328 B 328 B 329 2 n HIS . 329 B 329 B 330 2 n HIS . 330 B 330 B 331 2 n HIS . 331 B 331 B 332 2 n HIS . 332 B 332 B 333 2 n HIS . 333 B 333 # _software.classification other _software.date ? _software.description "Structure prediction" _software.name AlphaFold _software.pdbx_ordinal 1 _software.type package _software.version "AlphaFold-beta-20231127 (e807fd846049899dfdec5ca44da98c95d67dbcda1ded4e3a9b5f8a9fca437aa0)" # loop_ _struct_asym.entity_id _struct_asym.id 1 A 2 B 3 C 4 D 5 E 6 F 7 G 8 H # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.auth_seq_id _atom_site.auth_asym_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . MET A 1 1 ? -5.640 -45.375 10.902 1.00 31.91 1 A 1 ATOM 2 C CA . MET A 1 1 ? -4.613 -44.498 10.302 1.00 37.44 1 A 1 ATOM 3 C C . MET A 1 1 ? -5.183 -43.930 9.008 1.00 39.28 1 A 1 ATOM 4 O O . MET A 1 1 ? -4.937 -44.475 7.943 1.00 37.93 1 A 1 ATOM 5 C CB . MET A 1 1 ? -3.316 -45.283 10.039 1.00 37.20 1 A 1 ATOM 6 C CG . MET A 1 1 ? -2.602 -45.722 11.323 1.00 34.49 1 A 1 ATOM 7 S SD . MET A 1 1 ? -1.194 -46.814 10.982 1.00 30.17 1 A 1 ATOM 8 C CE . MET A 1 1 ? -0.612 -47.158 12.661 1.00 25.76 1 A 1 ATOM 9 N N . THR A 1 2 ? -6.059 -42.931 9.099 1.00 31.95 2 A 1 ATOM 10 C CA . THR A 1 2 ? -6.703 -42.321 7.931 1.00 32.03 2 A 1 ATOM 11 C C . THR A 1 2 ? -5.687 -41.397 7.267 1.00 32.73 2 A 1 ATOM 12 O O . THR A 1 2 ? -5.335 -40.363 7.825 1.00 31.02 2 A 1 ATOM 13 C CB . THR A 1 2 ? -7.972 -41.560 8.344 1.00 29.82 2 A 1 ATOM 14 O OG1 . THR A 1 2 ? -7.785 -40.943 9.597 1.00 26.35 2 A 1 ATOM 15 C CG2 . THR A 1 2 ? -9.156 -42.523 8.511 1.00 26.65 2 A 1 ATOM 16 N N . SER A 1 3 ? -5.182 -41.820 6.104 1.00 34.08 3 A 1 ATOM 17 C CA . SER A 1 3 ? -4.278 -41.029 5.276 1.00 35.69 3 A 1 ATOM 18 C C . SER A 1 3 ? -5.064 -39.837 4.722 1.00 36.33 3 A 1 ATOM 19 O O . SER A 1 3 ? -5.758 -39.965 3.717 1.00 35.38 3 A 1 ATOM 20 C CB . SER A 1 3 ? -3.721 -41.907 4.153 1.00 35.27 3 A 1 ATOM 21 O OG . SER A 1 3 ? -2.890 -41.163 3.297 1.00 31.22 3 A 1 ATOM 22 N N . THR A 1 4 ? -5.002 -38.690 5.399 1.00 37.47 4 A 1 ATOM 23 C CA . THR A 1 4 ? -5.467 -37.419 4.854 1.00 37.75 4 A 1 ATOM 24 C C . THR A 1 4 ? -4.506 -37.035 3.735 1.00 37.51 4 A 1 ATOM 25 O O . THR A 1 4 ? -3.460 -36.439 3.977 1.00 36.29 4 A 1 ATOM 26 C CB . THR A 1 4 ? -5.542 -36.326 5.937 1.00 36.42 4 A 1 ATOM 27 O OG1 . THR A 1 4 ? -4.523 -36.489 6.895 1.00 32.71 4 A 1 ATOM 28 C CG2 . THR A 1 4 ? -6.869 -36.394 6.692 1.00 33.46 4 A 1 ATOM 29 N N . THR A 1 5 ? -4.840 -37.436 2.518 1.00 38.11 5 A 1 ATOM 30 C CA . THR A 1 5 ? -4.176 -36.990 1.297 1.00 38.79 5 A 1 ATOM 31 C C . THR A 1 5 ? -4.435 -35.492 1.155 1.00 38.33 5 A 1 ATOM 32 O O . THR A 1 5 ? -5.455 -35.079 0.612 1.00 36.98 5 A 1 ATOM 33 C CB . THR A 1 5 ? -4.696 -37.755 0.064 1.00 37.94 5 A 1 ATOM 34 O OG1 . THR A 1 5 ? -6.064 -38.055 0.188 1.00 34.10 5 A 1 ATOM 35 C CG2 . THR A 1 5 ? -3.970 -39.092 -0.110 1.00 34.58 5 A 1 ATOM 36 N N . THR A 1 6 ? -3.530 -34.685 1.689 1.00 38.60 6 A 1 ATOM 37 C CA . THR A 1 6 ? -3.430 -33.266 1.369 1.00 39.10 6 A 1 ATOM 38 C C . THR A 1 6 ? -3.073 -33.174 -0.108 1.00 38.56 6 A 1 ATOM 39 O O . THR A 1 6 ? -1.916 -33.332 -0.485 1.00 37.21 6 A 1 ATOM 40 C CB . THR A 1 6 ? -2.371 -32.563 2.241 1.00 38.27 6 A 1 ATOM 41 O OG1 . THR A 1 6 ? -1.350 -33.455 2.622 1.00 33.77 6 A 1 ATOM 42 C CG2 . THR A 1 6 ? -2.990 -32.029 3.535 1.00 33.96 6 A 1 ATOM 43 N N . THR A 1 7 ? -4.082 -32.985 -0.945 1.00 34.92 7 A 1 ATOM 44 C CA . THR A 1 7 ? -3.901 -32.647 -2.351 1.00 35.52 7 A 1 ATOM 45 C C . THR A 1 7 ? -3.220 -31.283 -2.394 1.00 34.86 7 A 1 ATOM 46 O O . THR A 1 7 ? -3.855 -30.252 -2.200 1.00 33.97 7 A 1 ATOM 47 C CB . THR A 1 7 ? -5.247 -32.619 -3.098 1.00 34.35 7 A 1 ATOM 48 O OG1 . THR A 1 7 ? -6.274 -32.132 -2.264 1.00 30.85 7 A 1 ATOM 49 C CG2 . THR A 1 7 ? -5.667 -34.025 -3.531 1.00 32.22 7 A 1 ATOM 50 N N . THR A 1 8 ? -1.911 -31.298 -2.588 1.00 34.04 8 A 1 ATOM 51 C CA . THR A 1 8 ? -1.138 -30.131 -2.990 1.00 34.14 8 A 1 ATOM 52 C C . THR A 1 8 ? -1.641 -29.722 -4.372 1.00 33.56 8 A 1 ATOM 53 O O . THR A 1 8 ? -1.173 -30.252 -5.377 1.00 32.54 8 A 1 ATOM 54 C CB . THR A 1 8 ? 0.369 -30.455 -3.029 1.00 33.53 8 A 1 ATOM 55 O OG1 . THR A 1 8 ? 0.590 -31.801 -3.386 1.00 29.96 8 A 1 ATOM 56 C CG2 . THR A 1 8 ? 1.027 -30.250 -1.662 1.00 30.96 8 A 1 ATOM 57 N N . GLU A 1 9 ? -2.646 -28.839 -4.412 1.00 35.15 9 A 1 ATOM 58 C CA . GLU A 1 9 ? -3.031 -28.174 -5.654 1.00 35.62 9 A 1 ATOM 59 C C . GLU A 1 9 ? -1.798 -27.406 -6.138 1.00 34.60 9 A 1 ATOM 60 O O . GLU A 1 9 ? -1.332 -26.457 -5.508 1.00 33.71 9 A 1 ATOM 61 C CB . GLU A 1 9 ? -4.259 -27.267 -5.463 1.00 35.59 9 A 1 ATOM 62 C CG . GLU A 1 9 ? -5.568 -28.082 -5.377 1.00 33.67 9 A 1 ATOM 63 C CD . GLU A 1 9 ? -6.851 -27.224 -5.317 1.00 31.09 9 A 1 ATOM 64 O OE1 . GLU A 1 9 ? -7.929 -27.780 -5.628 1.00 27.56 9 A 1 ATOM 65 O OE2 . GLU A 1 9 ? -6.785 -26.032 -4.949 1.00 32.71 9 A 1 ATOM 66 N N . THR A 1 10 ? -1.197 -27.911 -7.203 1.00 35.54 10 A 1 ATOM 67 C CA . THR A 1 10 ? -0.026 -27.311 -7.822 1.00 35.60 10 A 1 ATOM 68 C C . THR A 1 10 ? -0.438 -25.959 -8.387 1.00 35.06 10 A 1 ATOM 69 O O . THR A 1 10 ? -1.191 -25.894 -9.353 1.00 34.21 10 A 1 ATOM 70 C CB . THR A 1 10 ? 0.559 -28.212 -8.927 1.00 34.54 10 A 1 ATOM 71 O OG1 . THR A 1 10 ? -0.412 -29.070 -9.478 1.00 31.12 10 A 1 ATOM 72 C CG2 . THR A 1 10 ? 1.663 -29.117 -8.373 1.00 31.91 10 A 1 ATOM 73 N N . LEU A 1 11 ? 0.080 -24.892 -7.776 1.00 43.30 11 A 1 ATOM 74 C CA . LEU A 1 11 ? -0.007 -23.530 -8.291 1.00 42.34 11 A 1 ATOM 75 C C . LEU A 1 11 ? 0.607 -23.506 -9.694 1.00 42.72 11 A 1 ATOM 76 O O . LEU A 1 11 ? 1.830 -23.531 -9.846 1.00 42.77 11 A 1 ATOM 77 C CB . LEU A 1 11 ? 0.751 -22.596 -7.334 1.00 41.52 11 A 1 ATOM 78 C CG . LEU A 1 11 ? 0.089 -22.442 -5.951 1.00 37.91 11 A 1 ATOM 79 C CD1 . LEU A 1 11 ? 1.064 -21.788 -4.976 1.00 36.76 11 A 1 ATOM 80 C CD2 . LEU A 1 11 ? -1.184 -21.607 -6.040 1.00 38.27 11 A 1 ATOM 81 N N . GLN A 1 12 ? -0.249 -23.524 -10.705 1.00 39.07 12 A 1 ATOM 82 C CA . GLN A 1 12 ? 0.207 -23.423 -12.081 1.00 39.30 12 A 1 ATOM 83 C C . GLN A 1 12 ? 0.662 -21.981 -12.335 1.00 39.13 12 A 1 ATOM 84 O O . GLN A 1 12 ? 0.011 -21.021 -11.923 1.00 38.60 12 A 1 ATOM 85 C CB . GLN A 1 12 ? -0.877 -23.904 -13.059 1.00 39.84 12 A 1 ATOM 86 C CG . GLN A 1 12 ? -1.079 -25.435 -12.971 1.00 37.63 12 A 1 ATOM 87 C CD . GLN A 1 12 ? -2.014 -25.998 -14.046 1.00 33.98 12 A 1 ATOM 88 O OE1 . GLN A 1 12 ? -2.707 -25.296 -14.756 1.00 32.90 12 A 1 ATOM 89 N NE2 . GLN A 1 12 ? -2.056 -27.298 -14.217 1.00 32.43 12 A 1 ATOM 90 N N . GLU A 1 13 ? 1.807 -21.832 -13.006 1.00 41.33 13 A 1 ATOM 91 C CA . GLU A 1 13 ? 2.092 -20.588 -13.726 1.00 42.51 13 A 1 ATOM 92 C C . GLU A 1 13 ? 0.906 -20.299 -14.648 1.00 42.26 13 A 1 ATOM 93 O O . GLU A 1 13 ? 0.243 -21.238 -15.100 1.00 42.33 13 A 1 ATOM 94 C CB . GLU A 1 13 ? 3.389 -20.703 -14.542 1.00 42.44 13 A 1 ATOM 95 C CG . GLU A 1 13 ? 4.640 -20.701 -13.653 1.00 38.60 13 A 1 ATOM 96 C CD . GLU A 1 13 ? 5.962 -20.727 -14.435 1.00 34.85 13 A 1 ATOM 97 O OE1 . GLU A 1 13 ? 6.986 -20.325 -13.831 1.00 30.74 13 A 1 ATOM 98 O OE2 . GLU A 1 13 ? 5.968 -21.156 -15.609 1.00 35.37 13 A 1 ATOM 99 N N . ALA A 1 14 ? 0.625 -19.022 -14.905 1.00 49.46 14 A 1 ATOM 100 C CA . ALA A 1 14 ? -0.419 -18.644 -15.852 1.00 48.05 14 A 1 ATOM 101 C C . ALA A 1 14 ? -0.080 -19.259 -17.217 1.00 48.87 14 A 1 ATOM 102 O O . ALA A 1 14 ? 0.673 -18.688 -18.001 1.00 48.34 14 A 1 ATOM 103 C CB . ALA A 1 14 ? -0.530 -17.116 -15.898 1.00 46.54 14 A 1 ATOM 104 N N . VAL A 1 15 ? -0.566 -20.476 -17.452 1.00 46.89 15 A 1 ATOM 105 C CA . VAL A 1 15 ? -0.331 -21.188 -18.704 1.00 47.18 15 A 1 ATOM 106 C C . VAL A 1 15 ? -1.018 -20.354 -19.775 1.00 46.77 15 A 1 ATOM 107 O O . VAL A 1 15 ? -2.208 -20.066 -19.631 1.00 45.82 15 A 1 ATOM 108 C CB . VAL A 1 15 ? -0.867 -22.633 -18.672 1.00 46.77 15 A 1 ATOM 109 C CG1 . VAL A 1 15 ? -0.513 -23.373 -19.965 1.00 40.90 15 A 1 ATOM 110 C CG2 . VAL A 1 15 ? -0.264 -23.436 -17.511 1.00 43.22 15 A 1 ATOM 111 N N . PRO A 1 16 ? -0.291 -19.912 -20.821 1.00 47.43 16 A 1 ATOM 112 C CA . PRO A 1 16 ? -0.935 -19.281 -21.954 1.00 48.56 16 A 1 ATOM 113 C C . PRO A 1 16 ? -1.983 -20.270 -22.453 1.00 49.98 16 A 1 ATOM 114 O O . PRO A 1 16 ? -1.643 -21.374 -22.879 1.00 49.57 16 A 1 ATOM 115 C CB . PRO A 1 16 ? 0.160 -18.999 -22.993 1.00 47.86 16 A 1 ATOM 116 C CG . PRO A 1 16 ? 1.478 -19.364 -22.317 1.00 47.57 16 A 1 ATOM 117 C CD . PRO A 1 16 ? 1.107 -20.171 -21.079 1.00 52.39 16 A 1 ATOM 118 N N . PHE A 1 17 ? -3.257 -19.914 -22.332 1.00 52.24 17 A 1 ATOM 119 C CA . PHE A 1 17 ? -4.317 -20.754 -22.870 1.00 51.39 17 A 1 ATOM 120 C C . PHE A 1 17 ? -4.105 -20.778 -24.381 1.00 51.99 17 A 1 ATOM 121 O O . PHE A 1 17 ? -4.352 -19.783 -25.057 1.00 50.16 17 A 1 ATOM 122 C CB . PHE A 1 17 ? -5.695 -20.225 -22.438 1.00 48.91 17 A 1 ATOM 123 C CG . PHE A 1 17 ? -6.602 -21.297 -21.870 1.00 46.41 17 A 1 ATOM 124 C CD1 . PHE A 1 17 ? -7.428 -22.052 -22.717 1.00 42.51 17 A 1 ATOM 125 C CD2 . PHE A 1 17 ? -6.623 -21.532 -20.480 1.00 42.75 17 A 1 ATOM 126 C CE1 . PHE A 1 17 ? -8.282 -23.035 -22.178 1.00 39.28 17 A 1 ATOM 127 C CE2 . PHE A 1 17 ? -7.471 -22.508 -19.939 1.00 40.57 17 A 1 ATOM 128 C CZ . PHE A 1 17 ? -8.306 -23.262 -20.784 1.00 40.64 17 A 1 ATOM 129 N N . VAL A 1 18 ? -3.553 -21.866 -24.887 1.00 52.78 18 A 1 ATOM 130 C CA . VAL A 1 18 ? -3.323 -22.034 -26.320 1.00 55.37 18 A 1 ATOM 131 C C . VAL A 1 18 ? -4.701 -22.189 -26.938 1.00 54.71 18 A 1 ATOM 132 O O . VAL A 1 18 ? -5.253 -23.284 -26.974 1.00 53.73 18 A 1 ATOM 133 C CB . VAL A 1 18 ? -2.388 -23.220 -26.635 1.00 54.35 18 A 1 ATOM 134 C CG1 . VAL A 1 18 ? -2.083 -23.291 -28.135 1.00 48.12 18 A 1 ATOM 135 C CG2 . VAL A 1 18 ? -1.044 -23.097 -25.898 1.00 49.36 18 A 1 ATOM 136 N N . ALA A 1 19 ? -5.284 -21.057 -27.349 1.00 54.41 19 A 1 ATOM 137 C CA . ALA A 1 19 ? -6.454 -21.108 -28.205 1.00 55.48 19 A 1 ATOM 138 C C . ALA A 1 19 ? -6.096 -22.000 -29.403 1.00 55.83 19 A 1 ATOM 139 O O . ALA A 1 19 ? -4.964 -21.941 -29.894 1.00 55.53 19 A 1 ATOM 140 C CB . ALA A 1 19 ? -6.858 -19.686 -28.630 1.00 54.14 19 A 1 ATOM 141 N N . PRO A 1 20 ? -7.004 -22.873 -29.853 1.00 48.86 20 A 1 ATOM 142 C CA . PRO A 1 20 ? -6.760 -23.652 -31.054 1.00 49.89 20 A 1 ATOM 143 C C . PRO A 1 20 ? -6.389 -22.696 -32.193 1.00 51.15 20 A 1 ATOM 144 O O . PRO A 1 20 ? -6.888 -21.566 -32.214 1.00 50.68 20 A 1 ATOM 145 C CB . PRO A 1 20 ? -8.050 -24.436 -31.315 1.00 48.55 20 A 1 ATOM 146 C CG . PRO A 1 20 ? -9.119 -23.623 -30.586 1.00 47.86 20 A 1 ATOM 147 C CD . PRO A 1 20 ? -8.374 -23.009 -29.406 1.00 51.56 20 A 1 ATOM 148 N N . PRO A 1 21 ? -5.501 -23.104 -33.123 1.00 49.94 21 A 1 ATOM 149 C CA . PRO A 1 21 ? -5.014 -22.220 -34.176 1.00 51.96 21 A 1 ATOM 150 C C . PRO A 1 21 ? -6.199 -21.580 -34.893 1.00 53.30 21 A 1 ATOM 151 O O . PRO A 1 21 ? -7.127 -22.290 -35.310 1.00 52.28 21 A 1 ATOM 152 C CB . PRO A 1 21 ? -4.158 -23.097 -35.098 1.00 50.91 21 A 1 ATOM 153 C CG . PRO A 1 21 ? -4.629 -24.519 -34.790 1.00 50.27 21 A 1 ATOM 154 C CD . PRO A 1 21 ? -5.020 -24.454 -33.319 1.00 53.80 21 A 1 ATOM 155 N N . SER A 1 22 ? -6.166 -20.241 -35.000 1.00 46.51 22 A 1 ATOM 156 C CA . SER A 1 22 ? -7.224 -19.480 -35.659 1.00 47.91 22 A 1 ATOM 157 C C . SER A 1 22 ? -7.507 -20.096 -37.032 1.00 48.61 22 A 1 ATOM 158 O O . SER A 1 22 ? -6.569 -20.364 -37.782 1.00 47.24 22 A 1 ATOM 159 C CB . SER A 1 22 ? -6.809 -18.013 -35.835 1.00 46.16 22 A 1 ATOM 160 O OG . SER A 1 22 ? -6.475 -17.452 -34.573 1.00 42.41 22 A 1 ATOM 161 N N . PRO A 1 23 ? -8.775 -20.345 -37.379 1.00 45.65 23 A 1 ATOM 162 C CA . PRO A 1 23 ? -9.091 -20.811 -38.722 1.00 46.97 23 A 1 ATOM 163 C C . PRO A 1 23 ? -8.607 -19.778 -39.757 1.00 47.94 23 A 1 ATOM 164 O O . PRO A 1 23 ? -8.498 -18.594 -39.433 1.00 47.33 23 A 1 ATOM 165 C CB . PRO A 1 23 ? -10.609 -21.018 -38.762 1.00 45.69 23 A 1 ATOM 166 C CG . PRO A 1 23 ? -11.102 -20.793 -37.337 1.00 45.32 23 A 1 ATOM 167 C CD . PRO A 1 23 ? -9.964 -20.084 -36.613 1.00 48.97 23 A 1 ATOM 168 N N . PRO A 1 24 ? -8.309 -20.182 -41.004 1.00 48.55 24 A 1 ATOM 169 C CA . PRO A 1 24 ? -7.783 -19.278 -42.029 1.00 49.19 24 A 1 ATOM 170 C C . PRO A 1 24 ? -8.739 -18.114 -42.355 1.00 50.25 24 A 1 ATOM 171 O O . PRO A 1 24 ? -9.932 -18.185 -42.060 1.00 48.98 24 A 1 ATOM 172 C CB . PRO A 1 24 ? -7.487 -20.169 -43.244 1.00 47.54 24 A 1 ATOM 173 C CG . PRO A 1 24 ? -8.379 -21.394 -43.031 1.00 47.40 24 A 1 ATOM 174 C CD . PRO A 1 24 ? -8.447 -21.529 -41.518 1.00 52.15 24 A 1 ATOM 175 N N . GLU A 1 25 ? -8.201 -17.061 -43.013 1.00 47.53 25 A 1 ATOM 176 C CA . GLU A 1 25 ? -8.774 -15.709 -43.215 1.00 47.83 25 A 1 ATOM 177 C C . GLU A 1 25 ? -10.275 -15.615 -43.560 1.00 47.87 25 A 1 ATOM 178 O O . GLU A 1 25 ? -10.938 -14.664 -43.145 1.00 45.69 25 A 1 ATOM 179 C CB . GLU A 1 25 ? -8.031 -15.020 -44.379 1.00 45.38 25 A 1 ATOM 180 C CG . GLU A 1 25 ? -6.582 -14.615 -44.065 1.00 40.93 25 A 1 ATOM 181 C CD . GLU A 1 25 ? -5.894 -13.908 -45.251 1.00 36.39 25 A 1 ATOM 182 O OE1 . GLU A 1 25 ? -4.937 -13.143 -44.993 1.00 32.42 25 A 1 ATOM 183 O OE2 . GLU A 1 25 ? -6.310 -14.153 -46.407 1.00 35.87 25 A 1 ATOM 184 N N . ASP A 1 26 ? -10.825 -16.556 -44.329 1.00 46.19 26 A 1 ATOM 185 C CA . ASP A 1 26 ? -12.180 -16.441 -44.911 1.00 46.11 26 A 1 ATOM 186 C C . ASP A 1 26 ? -13.318 -16.537 -43.866 1.00 46.34 26 A 1 ATOM 187 O O . ASP A 1 26 ? -14.507 -16.568 -44.173 1.00 44.24 26 A 1 ATOM 188 C CB . ASP A 1 26 ? -12.304 -17.486 -46.038 1.00 43.21 26 A 1 ATOM 189 C CG . ASP A 1 26 ? -13.297 -17.123 -47.153 1.00 36.21 26 A 1 ATOM 190 O OD1 . ASP A 1 26 ? -13.729 -15.954 -47.226 1.00 34.53 26 A 1 ATOM 191 O OD2 . ASP A 1 26 ? -13.599 -18.030 -47.961 1.00 34.28 26 A 1 ATOM 192 N N . VAL A 1 27 ? -12.950 -16.580 -42.591 1.00 49.77 27 A 1 ATOM 193 C CA . VAL A 1 27 ? -13.850 -16.841 -41.465 1.00 49.04 27 A 1 ATOM 194 C C . VAL A 1 27 ? -14.563 -15.578 -40.967 1.00 48.70 27 A 1 ATOM 195 O O . VAL A 1 27 ? -15.407 -15.672 -40.076 1.00 46.13 27 A 1 ATOM 196 C CB . VAL A 1 27 ? -13.106 -17.577 -40.330 1.00 46.89 27 A 1 ATOM 197 C CG1 . VAL A 1 27 ? -14.074 -18.336 -39.447 1.00 44.23 27 A 1 ATOM 198 C CG2 . VAL A 1 27 ? -12.116 -18.632 -40.856 1.00 43.82 27 A 1 ATOM 199 N N . ASN A 1 28 ? -14.295 -14.403 -41.548 1.00 51.71 28 A 1 ATOM 200 C CA . ASN A 1 28 ? -14.949 -13.142 -41.159 1.00 51.55 28 A 1 ATOM 201 C C . ASN A 1 28 ? -16.486 -13.185 -41.255 1.00 51.39 28 A 1 ATOM 202 O O . ASN A 1 28 ? -17.167 -12.445 -40.547 1.00 48.22 28 A 1 ATOM 203 C CB . ASN A 1 28 ? -14.385 -11.997 -42.021 1.00 48.78 28 A 1 ATOM 204 C CG . ASN A 1 28 ? -13.055 -11.465 -41.511 1.00 45.43 28 A 1 ATOM 205 O OD1 . ASN A 1 28 ? -12.683 -11.644 -40.370 1.00 42.78 28 A 1 ATOM 206 N ND2 . ASN A 1 28 ? -12.314 -10.762 -42.339 1.00 41.41 28 A 1 ATOM 207 N N . ASN A 1 29 ? -17.039 -14.059 -42.098 1.00 48.46 29 A 1 ATOM 208 C CA . ASN A 1 29 ? -18.484 -14.261 -42.234 1.00 47.14 29 A 1 ATOM 209 C C . ASN A 1 29 ? -19.052 -15.363 -41.328 1.00 47.92 29 A 1 ATOM 210 O O . ASN A 1 29 ? -20.242 -15.665 -41.435 1.00 45.15 29 A 1 ATOM 211 C CB . ASN A 1 29 ? -18.828 -14.505 -43.712 1.00 42.86 29 A 1 ATOM 212 C CG . ASN A 1 29 ? -19.093 -13.231 -44.497 1.00 37.49 29 A 1 ATOM 213 O OD1 . ASN A 1 29 ? -19.359 -12.167 -43.977 1.00 35.69 29 A 1 ATOM 214 N ND2 . ASN A 1 29 ? -19.072 -13.321 -45.805 1.00 34.40 29 A 1 ATOM 215 N N . LYS A 1 30 ? -18.259 -15.988 -40.448 1.00 59.57 30 A 1 ATOM 216 C CA . LYS A 1 30 ? -18.849 -16.904 -39.470 1.00 60.90 30 A 1 ATOM 217 C C . LYS A 1 30 ? -19.612 -16.089 -38.435 1.00 61.83 30 A 1 ATOM 218 O O . LYS A 1 30 ? -19.053 -15.235 -37.746 1.00 57.62 30 A 1 ATOM 219 C CB . LYS A 1 30 ? -17.822 -17.840 -38.826 1.00 56.86 30 A 1 ATOM 220 C CG . LYS A 1 30 ? -17.522 -19.037 -39.738 1.00 52.79 30 A 1 ATOM 221 C CD . LYS A 1 30 ? -16.618 -20.032 -39.008 1.00 48.58 30 A 1 ATOM 222 C CE . LYS A 1 30 ? -16.253 -21.201 -39.923 1.00 43.18 30 A 1 ATOM 223 N NZ . LYS A 1 30 ? -15.208 -22.040 -39.293 1.00 38.47 30 A 1 ATOM 224 N N . GLU A 1 31 ? -20.894 -16.396 -38.302 1.00 65.98 31 A 1 ATOM 225 C CA . GLU A 1 31 ? -21.677 -15.997 -37.140 1.00 66.09 31 A 1 ATOM 226 C C . GLU A 1 31 ? -21.011 -16.593 -35.892 1.00 67.76 31 A 1 ATOM 227 O O . GLU A 1 31 ? -20.777 -17.801 -35.809 1.00 62.83 31 A 1 ATOM 228 C CB . GLU A 1 31 ? -23.134 -16.458 -37.282 1.00 59.23 31 A 1 ATOM 229 C CG . GLU A 1 31 ? -23.888 -15.650 -38.357 1.00 52.45 31 A 1 ATOM 230 C CD . GLU A 1 31 ? -25.368 -16.043 -38.510 1.00 47.07 31 A 1 ATOM 231 O OE1 . GLU A 1 31 ? -26.127 -15.207 -39.050 1.00 41.93 31 A 1 ATOM 232 O OE2 . GLU A 1 31 ? -25.728 -17.178 -38.130 1.00 43.94 31 A 1 ATOM 233 N N . LEU A 1 32 ? -20.674 -15.717 -34.926 1.00 69.22 32 A 1 ATOM 234 C CA . LEU A 1 32 ? -20.273 -16.163 -33.596 1.00 69.79 32 A 1 ATOM 235 C C . LEU A 1 32 ? -21.403 -17.024 -33.036 1.00 71.03 32 A 1 ATOM 236 O O . LEU A 1 32 ? -22.539 -16.544 -32.981 1.00 67.79 32 A 1 ATOM 237 C CB . LEU A 1 32 ? -20.029 -14.946 -32.689 1.00 66.02 32 A 1 ATOM 238 C CG . LEU A 1 32 ? -18.582 -14.439 -32.749 1.00 62.60 32 A 1 ATOM 239 C CD1 . LEU A 1 32 ? -18.527 -12.964 -32.372 1.00 59.98 32 A 1 ATOM 240 C CD2 . LEU A 1 32 ? -17.696 -15.217 -31.768 1.00 60.17 32 A 1 ATOM 241 N N . PRO A 1 33 ? -21.132 -18.267 -32.616 1.00 70.53 33 A 1 ATOM 242 C CA . PRO A 1 33 ? -22.161 -19.068 -31.987 1.00 69.60 33 A 1 ATOM 243 C C . PRO A 1 33 ? -22.617 -18.359 -30.709 1.00 73.35 33 A 1 ATOM 244 O O . PRO A 1 33 ? -21.826 -18.143 -29.789 1.00 69.30 33 A 1 ATOM 245 C CB . PRO A 1 33 ? -21.521 -20.439 -31.744 1.00 61.94 33 A 1 ATOM 246 C CG . PRO A 1 33 ? -20.024 -20.155 -31.706 1.00 60.11 33 A 1 ATOM 247 C CD . PRO A 1 33 ? -19.856 -18.957 -32.638 1.00 63.58 33 A 1 ATOM 248 N N . GLU A 1 34 ? -23.898 -18.000 -30.634 1.00 79.30 34 A 1 ATOM 249 C CA . GLU A 1 34 ? -24.506 -17.414 -29.438 1.00 81.35 34 A 1 ATOM 250 C C . GLU A 1 34 ? -24.698 -18.495 -28.366 1.00 85.79 34 A 1 ATOM 251 O O . GLU A 1 34 ? -25.806 -18.934 -28.066 1.00 81.69 34 A 1 ATOM 252 C CB . GLU A 1 34 ? -25.812 -16.681 -29.767 1.00 72.08 34 A 1 ATOM 253 C CG . GLU A 1 34 ? -25.603 -15.400 -30.591 1.00 63.03 34 A 1 ATOM 254 C CD . GLU A 1 34 ? -26.823 -14.471 -30.553 1.00 57.30 34 A 1 ATOM 255 O OE1 . GLU A 1 34 ? -26.624 -13.258 -30.777 1.00 51.11 34 A 1 ATOM 256 O OE2 . GLU A 1 34 ? -27.939 -14.953 -30.257 1.00 53.30 34 A 1 ATOM 257 N N . LYS A 1 35 ? -23.590 -18.953 -27.775 1.00 89.71 35 A 1 ATOM 258 C CA . LYS A 1 35 ? -23.654 -19.834 -26.613 1.00 92.57 35 A 1 ATOM 259 C C . LYS A 1 35 ? -24.203 -19.047 -25.422 1.00 94.73 35 A 1 ATOM 260 O O . LYS A 1 35 ? -23.789 -17.911 -25.205 1.00 93.82 35 A 1 ATOM 261 C CB . LYS A 1 35 ? -22.290 -20.456 -26.313 1.00 89.84 35 A 1 ATOM 262 C CG . LYS A 1 35 ? -21.909 -21.506 -27.369 1.00 86.89 35 A 1 ATOM 263 C CD . LYS A 1 35 ? -20.569 -22.157 -27.028 1.00 83.21 35 A 1 ATOM 264 C CE . LYS A 1 35 ? -20.187 -23.171 -28.107 1.00 77.58 35 A 1 ATOM 265 N NZ . LYS A 1 35 ? -18.772 -23.588 -27.977 1.00 70.50 35 A 1 ATOM 266 N N . PRO A 1 36 ? -25.111 -19.647 -24.620 1.00 95.11 36 A 1 ATOM 267 C CA . PRO A 1 36 ? -25.734 -18.949 -23.494 1.00 95.35 36 A 1 ATOM 268 C C . PRO A 1 36 ? -24.757 -18.668 -22.346 1.00 96.34 36 A 1 ATOM 269 O O . PRO A 1 36 ? -24.979 -17.765 -21.544 1.00 95.41 36 A 1 ATOM 270 C CB . PRO A 1 36 ? -26.885 -19.858 -23.059 1.00 93.51 36 A 1 ATOM 271 C CG . PRO A 1 36 ? -26.424 -21.257 -23.478 1.00 89.87 36 A 1 ATOM 272 C CD . PRO A 1 36 ? -25.653 -20.988 -24.766 1.00 93.32 36 A 1 ATOM 273 N N . TYR A 1 37 ? -23.682 -19.446 -22.249 1.00 96.53 37 A 1 ATOM 274 C CA . TYR A 1 37 ? -22.595 -19.248 -21.296 1.00 96.88 37 A 1 ATOM 275 C C . TYR A 1 37 ? -21.332 -19.989 -21.751 1.00 97.00 37 A 1 ATOM 276 O O . TYR A 1 37 ? -21.396 -20.920 -22.560 1.00 96.18 37 A 1 ATOM 277 C CB . TYR A 1 37 ? -23.010 -19.720 -19.893 1.00 96.26 37 A 1 ATOM 278 C CG . TYR A 1 37 ? -23.326 -21.200 -19.779 1.00 95.91 37 A 1 ATOM 279 C CD1 . TYR A 1 37 ? -24.651 -21.661 -19.904 1.00 93.26 37 A 1 ATOM 280 C CD2 . TYR A 1 37 ? -22.295 -22.135 -19.555 1.00 93.08 37 A 1 ATOM 281 C CE1 . TYR A 1 37 ? -24.944 -23.029 -19.818 1.00 91.95 37 A 1 ATOM 282 C CE2 . TYR A 1 37 ? -22.573 -23.510 -19.473 1.00 91.77 37 A 1 ATOM 283 C CZ . TYR A 1 37 ? -23.901 -23.951 -19.604 1.00 92.43 37 A 1 ATOM 284 O OH . TYR A 1 37 ? -24.175 -25.292 -19.522 1.00 90.85 37 A 1 ATOM 285 N N . TYR A 1 38 ? -20.194 -19.612 -21.157 1.00 97.23 38 A 1 ATOM 286 C CA . TYR A 1 38 ? -18.972 -20.411 -21.110 1.00 97.14 38 A 1 ATOM 287 C C . TYR A 1 38 ? -18.607 -20.716 -19.655 1.00 97.35 38 A 1 ATOM 288 O O . TYR A 1 38 ? -18.796 -19.875 -18.777 1.00 96.85 38 A 1 ATOM 289 C CB . TYR A 1 38 ? -17.831 -19.678 -21.819 1.00 96.64 38 A 1 ATOM 290 C CG . TYR A 1 38 ? -18.008 -19.566 -23.319 1.00 96.41 38 A 1 ATOM 291 C CD1 . TYR A 1 38 ? -17.722 -20.670 -24.142 1.00 95.01 38 A 1 ATOM 292 C CD2 . TYR A 1 38 ? -18.456 -18.366 -23.903 1.00 95.28 38 A 1 ATOM 293 C CE1 . TYR A 1 38 ? -17.878 -20.583 -25.536 1.00 94.13 38 A 1 ATOM 294 C CE2 . TYR A 1 38 ? -18.621 -18.266 -25.297 1.00 94.36 38 A 1 ATOM 295 C CZ . TYR A 1 38 ? -18.332 -19.380 -26.109 1.00 94.82 38 A 1 ATOM 296 O OH . TYR A 1 38 ? -18.496 -19.286 -27.466 1.00 93.58 38 A 1 ATOM 297 N N . ASP A 1 39 ? -18.060 -21.899 -19.396 1.00 97.35 39 A 1 ATOM 298 C CA . ASP A 1 39 ? -17.335 -22.198 -18.163 1.00 97.22 39 A 1 ATOM 299 C C . ASP A 1 39 ? -15.835 -22.047 -18.472 1.00 96.94 39 A 1 ATOM 300 O O . ASP A 1 39 ? -15.307 -22.746 -19.335 1.00 95.72 39 A 1 ATOM 301 C CB . ASP A 1 39 ? -17.719 -23.592 -17.627 1.00 96.77 39 A 1 ATOM 302 C CG . ASP A 1 39 ? -19.171 -23.688 -17.113 1.00 96.08 39 A 1 ATOM 303 O OD1 . ASP A 1 39 ? -19.713 -22.704 -16.559 1.00 93.51 39 A 1 ATOM 304 O OD2 . ASP A 1 39 ? -19.811 -24.760 -17.220 1.00 93.37 39 A 1 ATOM 305 N N . VAL A 1 40 ? -15.175 -21.083 -17.820 1.00 97.43 40 A 1 ATOM 306 C CA . VAL A 1 40 ? -13.818 -20.621 -18.157 1.00 97.10 40 A 1 ATOM 307 C C . VAL A 1 40 ? -12.956 -20.599 -16.902 1.00 97.71 40 A 1 ATOM 308 O O . VAL A 1 40 ? -13.442 -20.300 -15.815 1.00 97.22 40 A 1 ATOM 309 C CB . VAL A 1 40 ? -13.854 -19.220 -18.805 1.00 95.03 40 A 1 ATOM 310 C CG1 . VAL A 1 40 ? -12.473 -18.764 -19.286 1.00 88.12 40 A 1 ATOM 311 C CG2 . VAL A 1 40 ? -14.787 -19.182 -20.021 1.00 88.54 40 A 1 ATOM 312 N N . GLU A 1 41 ? -11.671 -20.885 -17.047 1.00 97.57 41 A 1 ATOM 313 C CA . GLU A 1 41 ? -10.704 -20.738 -15.963 1.00 97.38 41 A 1 ATOM 314 C C . GLU A 1 41 ? -10.261 -19.270 -15.857 1.00 97.61 41 A 1 ATOM 315 O O . GLU A 1 41 ? -9.696 -18.705 -16.793 1.00 96.80 41 A 1 ATOM 316 C CB . GLU A 1 41 ? -9.544 -21.713 -16.191 1.00 96.31 41 A 1 ATOM 317 C CG . GLU A 1 41 ? -8.658 -21.818 -14.944 1.00 84.30 41 A 1 ATOM 318 C CD . GLU A 1 41 ? -7.573 -22.892 -15.058 1.00 77.30 41 A 1 ATOM 319 O OE1 . GLU A 1 41 ? -7.124 -23.350 -13.983 1.00 70.30 41 A 1 ATOM 320 O OE2 . GLU A 1 41 ? -7.194 -23.251 -16.191 1.00 70.08 41 A 1 ATOM 321 N N . PHE A 1 42 ? -10.544 -18.628 -14.712 1.00 97.83 42 A 1 ATOM 322 C CA . PHE A 1 42 ? -10.145 -17.256 -14.417 1.00 98.10 42 A 1 ATOM 323 C C . PHE A 1 42 ? -8.979 -17.199 -13.439 1.00 98.08 42 A 1 ATOM 324 O O . PHE A 1 42 ? -8.884 -17.992 -12.508 1.00 97.50 42 A 1 ATOM 325 C CB . PHE A 1 42 ? -11.341 -16.444 -13.907 1.00 97.94 42 A 1 ATOM 326 C CG . PHE A 1 42 ? -12.159 -15.694 -14.943 1.00 97.89 42 A 1 ATOM 327 C CD1 . PHE A 1 42 ? -11.899 -15.787 -16.323 1.00 96.57 42 A 1 ATOM 328 C CD2 . PHE A 1 42 ? -13.173 -14.822 -14.498 1.00 96.33 42 A 1 ATOM 329 C CE1 . PHE A 1 42 ? -12.631 -15.013 -17.244 1.00 95.31 42 A 1 ATOM 330 C CE2 . PHE A 1 42 ? -13.908 -14.051 -15.414 1.00 95.43 42 A 1 ATOM 331 C CZ . PHE A 1 42 ? -13.634 -14.143 -16.786 1.00 96.51 42 A 1 ATOM 332 N N . ASN A 1 43 ? -8.137 -16.179 -13.626 1.00 98.29 43 A 1 ATOM 333 C CA . ASN A 1 43 ? -6.997 -15.868 -12.782 1.00 98.25 43 A 1 ATOM 334 C C . ASN A 1 43 ? -7.427 -14.961 -11.619 1.00 98.41 43 A 1 ATOM 335 O O . ASN A 1 43 ? -7.652 -13.761 -11.800 1.00 98.18 43 A 1 ATOM 336 C CB . ASN A 1 43 ? -5.923 -15.212 -13.659 1.00 97.88 43 A 1 ATOM 337 C CG . ASN A 1 43 ? -5.331 -16.155 -14.697 1.00 97.29 43 A 1 ATOM 338 O OD1 . ASN A 1 43 ? -5.092 -17.320 -14.453 1.00 94.35 43 A 1 ATOM 339 N ND2 . ASN A 1 43 ? -5.050 -15.662 -15.882 1.00 93.99 43 A 1 ATOM 340 N N . TYR A 1 44 ? -7.512 -15.526 -10.413 1.00 98.17 44 A 1 ATOM 341 C CA . TYR A 1 44 ? -7.794 -14.813 -9.168 1.00 98.24 44 A 1 ATOM 342 C C . TYR A 1 44 ? -6.509 -14.526 -8.380 1.00 98.16 44 A 1 ATOM 343 O O . TYR A 1 44 ? -5.418 -14.985 -8.730 1.00 97.89 44 A 1 ATOM 344 C CB . TYR A 1 44 ? -8.810 -15.610 -8.352 1.00 98.23 44 A 1 ATOM 345 C CG . TYR A 1 44 ? -10.229 -15.512 -8.875 1.00 98.47 44 A 1 ATOM 346 C CD1 . TYR A 1 44 ? -11.083 -14.495 -8.408 1.00 98.28 44 A 1 ATOM 347 C CD2 . TYR A 1 44 ? -10.712 -16.434 -9.824 1.00 98.26 44 A 1 ATOM 348 C CE1 . TYR A 1 44 ? -12.408 -14.405 -8.867 1.00 98.19 44 A 1 ATOM 349 C CE2 . TYR A 1 44 ? -12.038 -16.350 -10.295 1.00 98.24 44 A 1 ATOM 350 C CZ . TYR A 1 44 ? -12.884 -15.336 -9.810 1.00 98.50 44 A 1 ATOM 351 O OH . TYR A 1 44 ? -14.179 -15.258 -10.250 1.00 98.37 44 A 1 ATOM 352 N N . ARG A 1 45 ? -6.629 -13.768 -7.290 1.00 98.28 45 A 1 ATOM 353 C CA . ARG A 1 45 ? -5.516 -13.471 -6.389 1.00 98.29 45 A 1 ATOM 354 C C . ARG A 1 45 ? -4.962 -14.756 -5.784 1.00 98.28 45 A 1 ATOM 355 O O . ARG A 1 45 ? -5.700 -15.519 -5.164 1.00 97.95 45 A 1 ATOM 356 C CB . ARG A 1 45 ? -5.984 -12.512 -5.286 1.00 98.05 45 A 1 ATOM 357 C CG . ARG A 1 45 ? -4.851 -12.111 -4.330 1.00 97.56 45 A 1 ATOM 358 C CD . ARG A 1 45 ? -5.367 -11.170 -3.239 1.00 96.57 45 A 1 ATOM 359 N NE . ARG A 1 45 ? -4.316 -10.788 -2.283 1.00 95.62 45 A 1 ATOM 360 C CZ . ARG A 1 45 ? -3.990 -11.406 -1.148 1.00 95.10 45 A 1 ATOM 361 N NH1 . ARG A 1 45 ? -4.559 -12.511 -0.759 1.00 92.12 45 A 1 ATOM 362 N NH2 . ARG A 1 45 ? -3.080 -10.903 -0.374 1.00 92.85 45 A 1 ATOM 363 N N . LEU A 1 46 ? -3.652 -14.934 -5.897 1.00 98.09 46 A 1 ATOM 364 C CA . LEU A 1 46 ? -2.880 -15.891 -5.110 1.00 97.93 46 A 1 ATOM 365 C C . LEU A 1 46 ? -2.456 -15.218 -3.799 1.00 97.85 46 A 1 ATOM 366 O O . LEU A 1 46 ? -1.941 -14.098 -3.829 1.00 97.43 46 A 1 ATOM 367 C CB . LEU A 1 46 ? -1.682 -16.343 -5.959 1.00 97.74 46 A 1 ATOM 368 C CG . LEU A 1 46 ? -0.759 -17.354 -5.263 1.00 97.29 46 A 1 ATOM 369 C CD1 . LEU A 1 46 ? -1.498 -18.634 -4.884 1.00 96.57 46 A 1 ATOM 370 C CD2 . LEU A 1 46 ? 0.394 -17.713 -6.200 1.00 96.44 46 A 1 ATOM 371 N N . ASP A 1 47 ? -2.659 -15.883 -2.655 1.00 97.91 47 A 1 ATOM 372 C CA . ASP A 1 47 ? -2.214 -15.333 -1.375 1.00 97.60 47 A 1 ATOM 373 C C . ASP A 1 47 ? -0.680 -15.137 -1.382 1.00 97.64 47 A 1 ATOM 374 O O . ASP A 1 47 ? 0.048 -16.037 -1.819 1.00 97.18 47 A 1 ATOM 375 C CB . ASP A 1 47 ? -2.662 -16.228 -0.203 1.00 96.93 47 A 1 ATOM 376 C CG . ASP A 1 47 ? -2.509 -15.483 1.132 1.00 95.05 47 A 1 ATOM 377 O OD1 . ASP A 1 47 ? -1.359 -15.224 1.540 1.00 92.15 47 A 1 ATOM 378 O OD2 . ASP A 1 47 ? -3.539 -15.067 1.704 1.00 90.47 47 A 1 ATOM 379 N N . PRO A 1 48 ? -0.149 -14.000 -0.891 1.00 97.47 48 A 1 ATOM 380 C CA . PRO A 1 48 ? 1.298 -13.799 -0.786 1.00 97.21 48 A 1 ATOM 381 C C . PRO A 1 48 ? 2.036 -14.910 -0.026 1.00 97.10 48 A 1 ATOM 382 O O . PRO A 1 48 ? 3.165 -15.243 -0.386 1.00 96.50 48 A 1 ATOM 383 C CB . PRO A 1 48 ? 1.454 -12.446 -0.093 1.00 96.74 48 A 1 ATOM 384 C CG . PRO A 1 48 ? 0.211 -11.689 -0.549 1.00 95.88 48 A 1 ATOM 385 C CD . PRO A 1 48 ? -0.856 -12.778 -0.572 1.00 97.19 48 A 1 ATOM 386 N N . ARG A 1 49 ? 1.403 -15.546 0.966 1.00 97.08 49 A 1 ATOM 387 C CA . ARG A 1 49 ? 1.954 -16.711 1.693 1.00 96.94 49 A 1 ATOM 388 C C . ARG A 1 49 ? 2.157 -17.941 0.797 1.00 96.82 49 A 1 ATOM 389 O O . ARG A 1 49 ? 2.991 -18.789 1.102 1.00 95.62 49 A 1 ATOM 390 C CB . ARG A 1 49 ? 1.023 -17.087 2.852 1.00 96.34 49 A 1 ATOM 391 C CG . ARG A 1 49 ? 1.011 -16.041 3.964 1.00 95.12 49 A 1 ATOM 392 C CD . ARG A 1 49 ? 0.064 -16.498 5.082 1.00 93.38 49 A 1 ATOM 393 N NE . ARG A 1 49 ? 0.070 -15.562 6.213 1.00 91.75 49 A 1 ATOM 394 C CZ . ARG A 1 49 ? -0.552 -14.395 6.279 1.00 90.64 49 A 1 ATOM 395 N NH1 . ARG A 1 49 ? -1.309 -13.943 5.308 1.00 85.67 49 A 1 ATOM 396 N NH2 . ARG A 1 49 ? -0.403 -13.666 7.339 1.00 87.61 49 A 1 ATOM 397 N N . ASP A 1 50 ? 1.414 -18.016 -0.309 1.00 97.26 50 A 1 ATOM 398 C CA . ASP A 1 50 ? 1.500 -19.093 -1.298 1.00 97.06 50 A 1 ATOM 399 C C . ASP A 1 50 ? 2.356 -18.705 -2.519 1.00 97.11 50 A 1 ATOM 400 O O . ASP A 1 50 ? 2.507 -19.486 -3.461 1.00 96.13 50 A 1 ATOM 401 C CB . ASP A 1 50 ? 0.080 -19.543 -1.671 1.00 96.74 50 A 1 ATOM 402 C CG . ASP A 1 50 ? -0.702 -20.083 -0.460 1.00 95.86 50 A 1 ATOM 403 O OD1 . ASP A 1 50 ? -0.058 -20.659 0.451 1.00 93.78 50 A 1 ATOM 404 O OD2 . ASP A 1 50 ? -1.939 -19.956 -0.452 1.00 93.45 50 A 1 ATOM 405 N N . GLY A 1 51 ? 2.970 -17.519 -2.493 1.00 97.14 51 A 1 ATOM 406 C CA . GLY A 1 51 ? 3.846 -17.004 -3.552 1.00 96.95 51 A 1 ATOM 407 C C . GLY A 1 51 ? 3.196 -15.968 -4.469 1.00 97.46 51 A 1 ATOM 408 O O . GLY A 1 51 ? 3.762 -15.661 -5.519 1.00 96.63 51 A 1 ATOM 409 N N . GLY A 1 52 ? 2.037 -15.436 -4.094 1.00 97.31 52 A 1 ATOM 410 C CA . GLY A 1 52 ? 1.419 -14.292 -4.756 1.00 97.60 52 A 1 ATOM 411 C C . GLY A 1 52 ? 2.176 -12.982 -4.520 1.00 97.80 52 A 1 ATOM 412 O O . GLY A 1 52 ? 3.166 -12.918 -3.786 1.00 97.36 52 A 1 ATOM 413 N N . ASP A 1 53 ? 1.706 -11.921 -5.161 1.00 97.87 53 A 1 ATOM 414 C CA . ASP A 1 53 ? 2.296 -10.586 -5.102 1.00 97.98 53 A 1 ATOM 415 C C . ASP A 1 53 ? 1.391 -9.584 -4.360 1.00 98.21 53 A 1 ATOM 416 O O . ASP A 1 53 ? 0.196 -9.796 -4.168 1.00 97.82 53 A 1 ATOM 417 C CB . ASP A 1 53 ? 2.651 -10.120 -6.529 1.00 97.51 53 A 1 ATOM 418 C CG . ASP A 1 53 ? 1.463 -10.187 -7.492 1.00 97.21 53 A 1 ATOM 419 O OD1 . ASP A 1 53 ? 0.403 -9.592 -7.203 1.00 95.43 53 A 1 ATOM 420 O OD2 . ASP A 1 53 ? 1.558 -10.857 -8.542 1.00 95.08 53 A 1 ATOM 421 N N . GLU A 1 54 ? 1.997 -8.469 -3.943 1.00 97.94 54 A 1 ATOM 422 C CA . GLU A 1 54 ? 1.314 -7.285 -3.400 1.00 97.96 54 A 1 ATOM 423 C C . GLU A 1 54 ? 1.581 -6.036 -4.260 1.00 98.18 54 A 1 ATOM 424 O O . GLU A 1 54 ? 0.886 -5.029 -4.137 1.00 97.58 54 A 1 ATOM 425 C CB . GLU A 1 54 ? 1.749 -7.047 -1.945 1.00 97.46 54 A 1 ATOM 426 C CG . GLU A 1 54 ? 1.355 -8.195 -0.998 1.00 95.52 54 A 1 ATOM 427 C CD . GLU A 1 54 ? 1.736 -7.946 0.473 1.00 94.52 54 A 1 ATOM 428 O OE1 . GLU A 1 54 ? 1.178 -8.647 1.347 1.00 87.83 54 A 1 ATOM 429 O OE2 . GLU A 1 54 ? 2.587 -7.071 0.752 1.00 89.74 54 A 1 ATOM 430 N N . VAL A 1 55 ? 2.575 -6.115 -5.152 1.00 98.34 55 A 1 ATOM 431 C CA . VAL A 1 55 ? 2.964 -5.065 -6.099 1.00 98.38 55 A 1 ATOM 432 C C . VAL A 1 55 ? 3.112 -5.682 -7.486 1.00 98.37 55 A 1 ATOM 433 O O . VAL A 1 55 ? 3.831 -6.661 -7.663 1.00 98.01 55 A 1 ATOM 434 C CB . VAL A 1 55 ? 4.279 -4.380 -5.683 1.00 98.17 55 A 1 ATOM 435 C CG1 . VAL A 1 55 ? 4.620 -3.215 -6.618 1.00 97.27 55 A 1 ATOM 436 C CG2 . VAL A 1 55 ? 4.211 -3.822 -4.258 1.00 97.35 55 A 1 ATOM 437 N N . ILE A 1 56 ? 2.459 -5.094 -8.482 1.00 98.63 56 A 1 ATOM 438 C CA . ILE A 1 56 ? 2.563 -5.512 -9.883 1.00 98.60 56 A 1 ATOM 439 C C . ILE A 1 56 ? 3.044 -4.358 -10.764 1.00 98.63 56 A 1 ATOM 440 O O . ILE A 1 56 ? 2.762 -3.187 -10.508 1.00 98.40 56 A 1 ATOM 441 C CB . ILE A 1 56 ? 1.251 -6.146 -10.398 1.00 98.34 56 A 1 ATOM 442 C CG1 . ILE A 1 56 ? 0.072 -5.142 -10.427 1.00 97.39 56 A 1 ATOM 443 C CG2 . ILE A 1 56 ? 0.920 -7.392 -9.563 1.00 96.83 56 A 1 ATOM 444 C CD1 . ILE A 1 56 ? -1.203 -5.703 -11.076 1.00 95.98 56 A 1 ATOM 445 N N . TRP A 1 57 ? 3.759 -4.702 -11.845 1.00 98.43 57 A 1 ATOM 446 C CA . TRP A 1 57 ? 4.414 -3.751 -12.741 1.00 98.34 57 A 1 ATOM 447 C C . TRP A 1 57 ? 3.688 -3.698 -14.089 1.00 98.17 57 A 1 ATOM 448 O O . TRP A 1 57 ? 3.970 -4.482 -14.999 1.00 97.50 57 A 1 ATOM 449 C CB . TRP A 1 57 ? 5.889 -4.127 -12.850 1.00 98.17 57 A 1 ATOM 450 C CG . TRP A 1 57 ? 6.633 -4.010 -11.548 1.00 98.11 57 A 1 ATOM 451 C CD1 . TRP A 1 57 ? 6.781 -4.991 -10.628 1.00 97.41 57 A 1 ATOM 452 C CD2 . TRP A 1 57 ? 7.232 -2.809 -10.965 1.00 97.94 57 A 1 ATOM 453 N NE1 . TRP A 1 57 ? 7.437 -4.490 -9.510 1.00 97.06 57 A 1 ATOM 454 C CE2 . TRP A 1 57 ? 7.718 -3.148 -9.669 1.00 97.40 57 A 1 ATOM 455 C CE3 . TRP A 1 57 ? 7.384 -1.477 -11.401 1.00 97.24 57 A 1 ATOM 456 C CZ2 . TRP A 1 57 ? 8.308 -2.190 -8.819 1.00 96.64 57 A 1 ATOM 457 C CZ3 . TRP A 1 57 ? 7.986 -0.523 -10.560 1.00 96.66 57 A 1 ATOM 458 C CH2 . TRP A 1 57 ? 8.429 -0.874 -9.277 1.00 96.48 57 A 1 ATOM 459 N N . GLY A 1 58 ? 2.730 -2.788 -14.201 1.00 98.10 58 A 1 ATOM 460 C CA . GLY A 1 58 ? 1.883 -2.638 -15.380 1.00 97.85 58 A 1 ATOM 461 C C . GLY A 1 58 ? 2.677 -2.255 -16.633 1.00 97.80 58 A 1 ATOM 462 O O . GLY A 1 58 ? 3.616 -1.467 -16.579 1.00 96.93 58 A 1 ATOM 463 N N . GLY A 1 59 ? 2.276 -2.814 -17.777 1.00 97.43 59 A 1 ATOM 464 C CA . GLY A 1 59 ? 2.959 -2.604 -19.057 1.00 97.11 59 A 1 ATOM 465 C C . GLY A 1 59 ? 4.312 -3.315 -19.183 1.00 97.34 59 A 1 ATOM 466 O O . GLY A 1 59 ? 4.979 -3.130 -20.197 1.00 96.36 59 A 1 ATOM 467 N N . THR A 1 60 ? 4.719 -4.123 -18.204 1.00 97.47 60 A 1 ATOM 468 C CA . THR A 1 60 ? 5.967 -4.902 -18.258 1.00 97.70 60 A 1 ATOM 469 C C . THR A 1 60 ? 5.724 -6.348 -18.694 1.00 97.64 60 A 1 ATOM 470 O O . THR A 1 60 ? 4.643 -6.903 -18.489 1.00 97.22 60 A 1 ATOM 471 C CB . THR A 1 60 ? 6.735 -4.883 -16.931 1.00 97.58 60 A 1 ATOM 472 O OG1 . THR A 1 60 ? 6.030 -5.569 -15.921 1.00 96.62 60 A 1 ATOM 473 C CG2 . THR A 1 60 ? 7.041 -3.470 -16.438 1.00 96.43 60 A 1 ATOM 474 N N . VAL A 1 61 ? 6.769 -6.983 -19.235 1.00 97.55 61 A 1 ATOM 475 C CA . VAL A 1 61 ? 6.757 -8.419 -19.575 1.00 97.39 61 A 1 ATOM 476 C C . VAL A 1 61 ? 6.525 -9.282 -18.328 1.00 97.27 61 A 1 ATOM 477 O O . VAL A 1 61 ? 5.778 -10.259 -18.385 1.00 96.26 61 A 1 ATOM 478 C CB . VAL A 1 61 ? 8.075 -8.806 -20.273 1.00 96.59 61 A 1 ATOM 479 C CG1 . VAL A 1 61 ? 8.168 -10.310 -20.544 1.00 93.22 61 A 1 ATOM 480 C CG2 . VAL A 1 61 ? 8.217 -8.085 -21.620 1.00 93.60 61 A 1 ATOM 481 N N . GLY A 1 62 ? 7.079 -8.900 -17.186 1.00 97.35 62 A 1 ATOM 482 C CA . GLY A 1 62 ? 6.899 -9.608 -15.912 1.00 97.23 62 A 1 ATOM 483 C C . GLY A 1 62 ? 5.436 -9.730 -15.465 1.00 97.48 62 A 1 ATOM 484 O O . GLY A 1 62 ? 5.071 -10.724 -14.841 1.00 96.95 62 A 1 ATOM 485 N N . LEU A 1 63 ? 4.565 -8.788 -15.845 1.00 97.54 63 A 1 ATOM 486 C CA . LEU A 1 63 ? 3.127 -8.883 -15.550 1.00 97.53 63 A 1 ATOM 487 C C . LEU A 1 63 ? 2.478 -10.117 -16.202 1.00 97.45 63 A 1 ATOM 488 O O . LEU A 1 63 ? 1.586 -10.720 -15.613 1.00 96.82 63 A 1 ATOM 489 C CB . LEU A 1 63 ? 2.423 -7.584 -15.982 1.00 97.27 63 A 1 ATOM 490 C CG . LEU A 1 63 ? 0.921 -7.534 -15.621 1.00 95.11 63 A 1 ATOM 491 C CD1 . LEU A 1 63 ? 0.677 -7.609 -14.112 1.00 92.74 63 A 1 ATOM 492 C CD2 . LEU A 1 63 ? 0.306 -6.234 -16.133 1.00 92.08 63 A 1 ATOM 493 N N . MET A 1 64 ? 2.962 -10.530 -17.381 1.00 96.81 64 A 1 ATOM 494 C CA . MET A 1 64 ? 2.480 -11.732 -18.081 1.00 96.03 64 A 1 ATOM 495 C C . MET A 1 64 ? 2.936 -13.033 -17.396 1.00 96.41 64 A 1 ATOM 496 O O . MET A 1 64 ? 2.376 -14.092 -17.642 1.00 94.84 64 A 1 ATOM 497 C CB . MET A 1 64 ? 2.951 -11.706 -19.544 1.00 94.41 64 A 1 ATOM 498 C CG . MET A 1 64 ? 2.619 -10.393 -20.268 1.00 86.66 64 A 1 ATOM 499 S SD . MET A 1 64 ? 0.860 -9.967 -20.350 1.00 76.73 64 A 1 ATOM 500 C CE . MET A 1 64 ? 0.441 -10.796 -21.895 1.00 66.22 64 A 1 ATOM 501 N N . ARG A 1 65 ? 3.926 -12.946 -16.498 1.00 97.13 65 A 1 ATOM 502 C CA . ARG A 1 65 ? 4.481 -14.051 -15.685 1.00 96.94 65 A 1 ATOM 503 C C . ARG A 1 65 ? 3.905 -14.101 -14.265 1.00 97.11 65 A 1 ATOM 504 O O . ARG A 1 65 ? 4.318 -14.944 -13.468 1.00 96.11 65 A 1 ATOM 505 C CB . ARG A 1 65 ? 6.013 -13.938 -15.659 1.00 96.23 65 A 1 ATOM 506 C CG . ARG A 1 65 ? 6.628 -13.977 -17.067 1.00 95.62 65 A 1 ATOM 507 C CD . ARG A 1 65 ? 8.136 -13.738 -17.002 1.00 94.51 65 A 1 ATOM 508 N NE . ARG A 1 65 ? 8.705 -13.700 -18.360 1.00 94.68 65 A 1 ATOM 509 C CZ . ARG A 1 65 ? 9.722 -12.975 -18.786 1.00 95.03 65 A 1 ATOM 510 N NH1 . ARG A 1 65 ? 10.427 -12.211 -18.008 1.00 92.26 65 A 1 ATOM 511 N NH2 . ARG A 1 65 ? 10.049 -13.005 -20.040 1.00 92.39 65 A 1 ATOM 512 N N . ARG A 1 66 ? 2.978 -13.205 -13.944 1.00 97.26 66 A 1 ATOM 513 C CA . ARG A 1 66 ? 2.329 -13.130 -12.631 1.00 97.42 66 A 1 ATOM 514 C C . ARG A 1 66 ? 1.665 -14.462 -12.283 1.00 97.50 66 A 1 ATOM 515 O O . ARG A 1 66 ? 1.042 -15.095 -13.137 1.00 96.87 66 A 1 ATOM 516 C CB . ARG A 1 66 ? 1.324 -11.973 -12.641 1.00 96.94 66 A 1 ATOM 517 C CG . ARG A 1 66 ? 0.711 -11.720 -11.262 1.00 95.53 66 A 1 ATOM 518 C CD . ARG A 1 66 ? -0.308 -10.586 -11.312 1.00 94.57 66 A 1 ATOM 519 N NE . ARG A 1 66 ? -0.771 -10.268 -9.962 1.00 94.74 66 A 1 ATOM 520 C CZ . ARG A 1 66 ? -1.892 -9.702 -9.586 1.00 95.17 66 A 1 ATOM 521 N NH1 . ARG A 1 66 ? -2.805 -9.337 -10.435 1.00 91.90 66 A 1 ATOM 522 N NH2 . ARG A 1 66 ? -2.093 -9.479 -8.321 1.00 91.51 66 A 1 ATOM 523 N N . LYS A 1 67 ? 1.766 -14.859 -11.013 1.00 97.89 67 A 1 ATOM 524 C CA . LYS A 1 67 ? 1.130 -16.070 -10.500 1.00 97.78 67 A 1 ATOM 525 C C . LYS A 1 67 ? -0.275 -15.763 -9.988 1.00 98.16 67 A 1 ATOM 526 O O . LYS A 1 67 ? -0.507 -14.730 -9.357 1.00 97.71 67 A 1 ATOM 527 C CB . LYS A 1 67 ? 1.993 -16.708 -9.410 1.00 96.88 67 A 1 ATOM 528 C CG . LYS A 1 67 ? 3.360 -17.154 -9.952 1.00 92.91 67 A 1 ATOM 529 C CD . LYS A 1 67 ? 4.167 -17.830 -8.846 1.00 85.78 67 A 1 ATOM 530 C CE . LYS A 1 67 ? 5.536 -18.243 -9.385 1.00 77.64 67 A 1 ATOM 531 N NZ . LYS A 1 67 ? 6.333 -18.920 -8.344 1.00 67.08 67 A 1 ATOM 532 N N . TYR A 1 68 ? -1.188 -16.699 -10.229 1.00 98.19 68 A 1 ATOM 533 C CA . TYR A 1 68 ? -2.587 -16.603 -9.814 1.00 98.19 68 A 1 ATOM 534 C C . TYR A 1 68 ? -3.024 -17.890 -9.126 1.00 98.15 68 A 1 ATOM 535 O O . TYR A 1 68 ? -2.398 -18.937 -9.279 1.00 97.61 68 A 1 ATOM 536 C CB . TYR A 1 68 ? -3.465 -16.315 -11.036 1.00 98.00 68 A 1 ATOM 537 C CG . TYR A 1 68 ? -3.109 -15.033 -11.759 1.00 97.91 68 A 1 ATOM 538 C CD1 . TYR A 1 68 ? -3.558 -13.793 -11.267 1.00 97.12 68 A 1 ATOM 539 C CD2 . TYR A 1 68 ? -2.302 -15.067 -12.915 1.00 97.13 68 A 1 ATOM 540 C CE1 . TYR A 1 68 ? -3.218 -12.599 -11.924 1.00 96.42 68 A 1 ATOM 541 C CE2 . TYR A 1 68 ? -1.953 -13.876 -13.581 1.00 96.47 68 A 1 ATOM 542 C CZ . TYR A 1 68 ? -2.417 -12.643 -13.083 1.00 96.52 68 A 1 ATOM 543 O OH . TYR A 1 68 ? -2.088 -11.480 -13.730 1.00 95.24 68 A 1 ATOM 544 N N . GLU A 1 69 ? -4.134 -17.809 -8.398 1.00 97.97 69 A 1 ATOM 545 C CA . GLU A 1 69 ? -4.931 -18.973 -8.064 1.00 97.89 69 A 1 ATOM 546 C C . GLU A 1 69 ? -6.084 -19.054 -9.067 1.00 98.02 69 A 1 ATOM 547 O O . GLU A 1 69 ? -6.895 -18.132 -9.171 1.00 97.55 69 A 1 ATOM 548 C CB . GLU A 1 69 ? -5.385 -18.908 -6.607 1.00 97.38 69 A 1 ATOM 549 C CG . GLU A 1 69 ? -6.008 -20.246 -6.202 1.00 93.82 69 A 1 ATOM 550 C CD . GLU A 1 69 ? -6.275 -20.390 -4.700 1.00 92.97 69 A 1 ATOM 551 O OE1 . GLU A 1 69 ? -6.903 -21.415 -4.349 1.00 86.93 69 A 1 ATOM 552 O OE2 . GLU A 1 69 ? -5.902 -19.507 -3.907 1.00 87.99 69 A 1 ATOM 553 N N . THR A 1 70 ? -6.143 -20.123 -9.854 1.00 97.91 70 A 1 ATOM 554 C CA . THR A 1 70 ? -7.149 -20.260 -10.905 1.00 97.75 70 A 1 ATOM 555 C C . THR A 1 70 ? -8.429 -20.899 -10.377 1.00 97.88 70 A 1 ATOM 556 O O . THR A 1 70 ? -8.421 -21.724 -9.457 1.00 97.10 70 A 1 ATOM 557 C CB . THR A 1 70 ? -6.617 -20.991 -12.144 1.00 96.47 70 A 1 ATOM 558 O OG1 . THR A 1 70 ? -6.250 -22.308 -11.826 1.00 86.94 70 A 1 ATOM 559 C CG2 . THR A 1 70 ? -5.401 -20.284 -12.744 1.00 84.93 70 A 1 ATOM 560 N N . ARG A 1 71 ? -9.576 -20.491 -10.946 1.00 97.90 71 A 1 ATOM 561 C CA . ARG A 1 71 ? -10.886 -21.091 -10.667 1.00 97.73 71 A 1 ATOM 562 C C . ARG A 1 71 ? -11.739 -21.113 -11.918 1.00 97.88 71 A 1 ATOM 563 O O . ARG A 1 71 ? -11.861 -20.102 -12.606 1.00 97.31 71 A 1 ATOM 564 C CB . ARG A 1 71 ? -11.631 -20.317 -9.566 1.00 97.26 71 A 1 ATOM 565 C CG . ARG A 1 71 ? -11.054 -20.482 -8.158 1.00 95.13 71 A 1 ATOM 566 C CD . ARG A 1 71 ? -11.219 -21.921 -7.627 1.00 94.22 71 A 1 ATOM 567 N NE . ARG A 1 71 ? -10.780 -22.029 -6.232 1.00 93.46 71 A 1 ATOM 568 C CZ . ARG A 1 71 ? -9.535 -22.208 -5.800 1.00 93.13 71 A 1 ATOM 569 N NH1 . ARG A 1 71 ? -8.527 -22.374 -6.602 1.00 88.29 71 A 1 ATOM 570 N NH2 . ARG A 1 71 ? -9.291 -22.211 -4.529 1.00 88.76 71 A 1 ATOM 571 N N . THR A 1 72 ? -12.418 -22.228 -12.154 1.00 97.47 72 A 1 ATOM 572 C CA . THR A 1 72 ? -13.476 -22.282 -13.162 1.00 97.51 72 A 1 ATOM 573 C C . THR A 1 72 ? -14.674 -21.466 -12.698 1.00 97.78 72 A 1 ATOM 574 O O . THR A 1 72 ? -15.184 -21.662 -11.591 1.00 97.25 72 A 1 ATOM 575 C CB . THR A 1 72 ? -13.902 -23.721 -13.465 1.00 96.68 72 A 1 ATOM 576 O OG1 . THR A 1 72 ? -12.780 -24.507 -13.758 1.00 91.54 72 A 1 ATOM 577 C CG2 . THR A 1 72 ? -14.832 -23.805 -14.677 1.00 90.70 72 A 1 ATOM 578 N N . VAL A 1 73 ? -15.153 -20.560 -13.559 1.00 97.74 73 A 1 ATOM 579 C CA . VAL A 1 73 ? -16.347 -19.737 -13.339 1.00 97.71 73 A 1 ATOM 580 C C . VAL A 1 73 ? -17.286 -19.832 -14.536 1.00 97.73 73 A 1 ATOM 581 O O . VAL A 1 73 ? -16.850 -20.015 -15.671 1.00 97.35 73 A 1 ATOM 582 C CB . VAL A 1 73 ? -15.998 -18.267 -13.045 1.00 97.17 73 A 1 ATOM 583 C CG1 . VAL A 1 73 ? -15.171 -18.139 -11.764 1.00 94.84 73 A 1 ATOM 584 C CG2 . VAL A 1 73 ? -15.249 -17.575 -14.191 1.00 94.74 73 A 1 ATOM 585 N N . ARG A 1 74 ? -18.596 -19.667 -14.289 1.00 97.66 74 A 1 ATOM 586 C CA . ARG A 1 74 ? -19.598 -19.542 -15.354 1.00 97.59 74 A 1 ATOM 587 C C . ARG A 1 74 ? -19.772 -18.080 -15.741 1.00 97.74 74 A 1 ATOM 588 O O . ARG A 1 74 ? -20.113 -17.264 -14.888 1.00 97.29 74 A 1 ATOM 589 C CB . ARG A 1 74 ? -20.907 -20.194 -14.926 1.00 97.06 74 A 1 ATOM 590 C CG . ARG A 1 74 ? -21.966 -20.090 -16.036 1.00 95.17 74 A 1 ATOM 591 C CD . ARG A 1 74 ? -23.063 -21.138 -15.865 1.00 92.91 74 A 1 ATOM 592 N NE . ARG A 1 74 ? -22.511 -22.472 -16.122 1.00 91.23 74 A 1 ATOM 593 C CZ . ARG A 1 74 ? -23.106 -23.644 -16.012 1.00 90.71 74 A 1 ATOM 594 N NH1 . ARG A 1 74 ? -24.358 -23.745 -15.658 1.00 84.79 74 A 1 ATOM 595 N NH2 . ARG A 1 74 ? -22.421 -24.721 -16.267 1.00 87.34 74 A 1 ATOM 596 N N . ILE A 1 75 ? -19.600 -17.784 -17.026 1.00 98.02 75 A 1 ATOM 597 C CA . ILE A 1 75 ? -19.796 -16.452 -17.606 1.00 98.06 75 A 1 ATOM 598 C C . ILE A 1 75 ? -21.019 -16.510 -18.516 1.00 97.94 75 A 1 ATOM 599 O O . ILE A 1 75 ? -20.996 -17.203 -19.535 1.00 97.65 75 A 1 ATOM 600 C CB . ILE A 1 75 ? -18.546 -15.980 -18.374 1.00 97.97 75 A 1 ATOM 601 C CG1 . ILE A 1 75 ? -17.258 -16.166 -17.538 1.00 96.82 75 A 1 ATOM 602 C CG2 . ILE A 1 75 ? -18.736 -14.505 -18.773 1.00 96.86 75 A 1 ATOM 603 C CD1 . ILE A 1 75 ? -15.986 -15.813 -18.307 1.00 94.26 75 A 1 ATOM 604 N N . ASN A 1 76 ? -22.104 -15.812 -18.154 1.00 97.94 76 A 1 ATOM 605 C CA . ASN A 1 76 ? -23.355 -15.834 -18.906 1.00 97.78 76 A 1 ATOM 606 C C . ASN A 1 76 ? -23.303 -14.824 -20.053 1.00 97.88 76 A 1 ATOM 607 O O . ASN A 1 76 ? -22.850 -13.694 -19.868 1.00 97.51 76 A 1 ATOM 608 C CB . ASN A 1 76 ? -24.541 -15.565 -17.972 1.00 97.35 76 A 1 ATOM 609 C CG . ASN A 1 76 ? -24.568 -16.497 -16.771 1.00 94.46 76 A 1 ATOM 610 O OD1 . ASN A 1 76 ? -24.889 -17.676 -16.846 1.00 85.71 76 A 1 ATOM 611 N ND2 . ASN A 1 76 ? -24.197 -15.993 -15.615 1.00 83.55 76 A 1 ATOM 612 N N . ASN A 1 77 ? -23.792 -15.218 -21.234 1.00 97.32 77 A 1 ATOM 613 C CA . ASN A 1 77 ? -23.927 -14.321 -22.372 1.00 97.25 77 A 1 ATOM 614 C C . ASN A 1 77 ? -25.251 -13.561 -22.280 1.00 97.19 77 A 1 ATOM 615 O O . ASN A 1 77 ? -26.321 -14.156 -22.388 1.00 96.65 77 A 1 ATOM 616 C CB . ASN A 1 77 ? -23.803 -15.128 -23.668 1.00 96.71 77 A 1 ATOM 617 C CG . ASN A 1 77 ? -23.832 -14.259 -24.915 1.00 96.48 77 A 1 ATOM 618 O OD1 . ASN A 1 77 ? -23.767 -13.041 -24.884 1.00 94.61 77 A 1 ATOM 619 N ND2 . ASN A 1 77 ? -23.900 -14.878 -26.070 1.00 94.08 77 A 1 ATOM 620 N N . GLU A 1 78 ? -25.174 -12.246 -22.119 1.00 97.20 78 A 1 ATOM 621 C CA . GLU A 1 78 ? -26.325 -11.361 -21.956 1.00 97.13 78 A 1 ATOM 622 C C . GLU A 1 78 ? -26.725 -10.647 -23.259 1.00 96.88 78 A 1 ATOM 623 O O . GLU A 1 78 ? -27.469 -9.664 -23.232 1.00 96.14 78 A 1 ATOM 624 C CB . GLU A 1 78 ? -26.058 -10.369 -20.815 1.00 97.22 78 A 1 ATOM 625 C CG . GLU A 1 78 ? -25.675 -11.035 -19.484 1.00 96.72 78 A 1 ATOM 626 C CD . GLU A 1 78 ? -26.715 -12.023 -18.931 1.00 97.14 78 A 1 ATOM 627 O OE1 . GLU A 1 78 ? -26.326 -12.857 -18.082 1.00 93.37 78 A 1 ATOM 628 O OE2 . GLU A 1 78 ? -27.907 -11.944 -19.314 1.00 94.58 78 A 1 ATOM 629 N N . ARG A 1 79 ? -26.256 -11.117 -24.420 1.00 96.75 79 A 1 ATOM 630 C CA . ARG A 1 79 ? -26.707 -10.592 -25.717 1.00 96.41 79 A 1 ATOM 631 C C . ARG A 1 79 ? -28.232 -10.704 -25.816 1.00 96.17 79 A 1 ATOM 632 O O . ARG A 1 79 ? -28.785 -11.789 -25.676 1.00 95.14 79 A 1 ATOM 633 C CB . ARG A 1 79 ? -25.983 -11.324 -26.859 1.00 95.81 79 A 1 ATOM 634 C CG . ARG A 1 79 ? -26.408 -10.889 -28.262 1.00 94.56 79 A 1 ATOM 635 C CD . ARG A 1 79 ? -26.228 -9.386 -28.536 1.00 93.74 79 A 1 ATOM 636 N NE . ARG A 1 79 ? -24.805 -8.988 -28.649 1.00 93.46 79 A 1 ATOM 637 C CZ . ARG A 1 79 ? -24.356 -7.735 -28.699 1.00 94.59 79 A 1 ATOM 638 N NH1 . ARG A 1 79 ? -25.136 -6.706 -28.523 1.00 90.24 79 A 1 ATOM 639 N NH2 . ARG A 1 79 ? -23.113 -7.481 -28.950 1.00 90.99 79 A 1 ATOM 640 N N . GLY A 1 80 ? -28.896 -9.574 -26.051 1.00 94.95 80 A 1 ATOM 641 C CA . GLY A 1 80 ? -30.358 -9.435 -26.040 1.00 94.50 80 A 1 ATOM 642 C C . GLY A 1 80 ? -30.952 -9.056 -24.676 1.00 95.32 80 A 1 ATOM 643 O O . GLY A 1 80 ? -32.090 -8.588 -24.626 1.00 93.80 80 A 1 ATOM 644 N N . ASN A 1 81 ? -30.188 -9.189 -23.570 1.00 96.01 81 A 1 ATOM 645 C CA . ASN A 1 81 ? -30.593 -8.827 -22.208 1.00 96.27 81 A 1 ATOM 646 C C . ASN A 1 81 ? -29.871 -7.584 -21.666 1.00 97.19 81 A 1 ATOM 647 O O . ASN A 1 81 ? -30.006 -7.275 -20.479 1.00 96.34 81 A 1 ATOM 648 C CB . ASN A 1 81 ? -30.353 -10.016 -21.271 1.00 94.23 81 A 1 ATOM 649 C CG . ASN A 1 81 ? -31.165 -11.250 -21.606 1.00 87.28 81 A 1 ATOM 650 O OD1 . ASN A 1 81 ? -32.295 -11.192 -22.065 1.00 78.63 81 A 1 ATOM 651 N ND2 . ASN A 1 81 ? -30.602 -12.404 -21.328 1.00 77.63 81 A 1 ATOM 652 N N . GLU A 1 82 ? -29.123 -6.857 -22.496 1.00 96.71 82 A 1 ATOM 653 C CA . GLU A 1 82 ? -28.258 -5.745 -22.070 1.00 96.73 82 A 1 ATOM 654 C C . GLU A 1 82 ? -29.004 -4.691 -21.232 1.00 96.98 82 A 1 ATOM 655 O O . GLU A 1 82 ? -28.464 -4.127 -20.284 1.00 95.71 82 A 1 ATOM 656 C CB . GLU A 1 82 ? -27.638 -5.058 -23.300 1.00 95.38 82 A 1 ATOM 657 C CG . GLU A 1 82 ? -26.811 -5.966 -24.230 1.00 92.75 82 A 1 ATOM 658 C CD . GLU A 1 82 ? -27.599 -6.585 -25.397 1.00 94.23 82 A 1 ATOM 659 O OE1 . GLU A 1 82 ? -26.987 -6.809 -26.470 1.00 87.89 82 A 1 ATOM 660 O OE2 . GLU A 1 82 ? -28.816 -6.828 -25.253 1.00 89.75 82 A 1 ATOM 661 N N . HIS A 1 83 ? -30.283 -4.465 -21.545 1.00 96.65 83 A 1 ATOM 662 C CA . HIS A 1 83 ? -31.157 -3.505 -20.870 1.00 95.96 83 A 1 ATOM 663 C C . HIS A 1 83 ? -31.529 -3.885 -19.425 1.00 96.51 83 A 1 ATOM 664 O O . HIS A 1 83 ? -32.043 -3.040 -18.692 1.00 94.93 83 A 1 ATOM 665 C CB . HIS A 1 83 ? -32.420 -3.320 -21.722 1.00 94.56 83 A 1 ATOM 666 C CG . HIS A 1 83 ? -33.252 -4.575 -21.855 1.00 89.85 83 A 1 ATOM 667 N ND1 . HIS A 1 83 ? -33.071 -5.587 -22.779 1.00 78.06 83 A 1 ATOM 668 C CD2 . HIS A 1 83 ? -34.324 -4.940 -21.074 1.00 78.74 83 A 1 ATOM 669 C CE1 . HIS A 1 83 ? -34.003 -6.527 -22.559 1.00 77.81 83 A 1 ATOM 670 N NE2 . HIS A 1 83 ? -34.786 -6.172 -21.534 1.00 79.21 83 A 1 ATOM 671 N N . ASN A 1 84 ? -31.283 -5.127 -18.999 1.00 96.51 84 A 1 ATOM 672 C CA . ASN A 1 84 ? -31.554 -5.587 -17.637 1.00 96.86 84 A 1 ATOM 673 C C . ASN A 1 84 ? -30.442 -5.220 -16.640 1.00 97.46 84 A 1 ATOM 674 O O . ASN A 1 84 ? -30.617 -5.409 -15.437 1.00 96.38 84 A 1 ATOM 675 C CB . ASN A 1 84 ? -31.808 -7.101 -17.657 1.00 96.06 84 A 1 ATOM 676 C CG . ASN A 1 84 ? -33.082 -7.471 -18.404 1.00 93.47 84 A 1 ATOM 677 O OD1 . ASN A 1 84 ? -34.097 -6.802 -18.337 1.00 85.90 84 A 1 ATOM 678 N ND2 . ASN A 1 84 ? -33.067 -8.572 -19.123 1.00 84.34 84 A 1 ATOM 679 N N . PHE A 1 85 ? -29.324 -4.695 -17.115 1.00 97.54 85 A 1 ATOM 680 C CA . PHE A 1 85 ? -28.169 -4.325 -16.304 1.00 97.81 85 A 1 ATOM 681 C C . PHE A 1 85 ? -28.022 -2.806 -16.203 1.00 97.66 85 A 1 ATOM 682 O O . PHE A 1 85 ? -28.209 -2.077 -17.175 1.00 96.59 85 A 1 ATOM 683 C CB . PHE A 1 85 ? -26.910 -4.991 -16.865 1.00 97.79 85 A 1 ATOM 684 C CG . PHE A 1 85 ? -26.997 -6.501 -16.874 1.00 98.16 85 A 1 ATOM 685 C CD1 . PHE A 1 85 ? -26.646 -7.238 -15.731 1.00 97.31 85 A 1 ATOM 686 C CD2 . PHE A 1 85 ? -27.503 -7.174 -18.002 1.00 97.42 85 A 1 ATOM 687 C CE1 . PHE A 1 85 ? -26.792 -8.631 -15.710 1.00 96.87 85 A 1 ATOM 688 C CE2 . PHE A 1 85 ? -27.656 -8.570 -17.987 1.00 97.03 85 A 1 ATOM 689 C CZ . PHE A 1 85 ? -27.304 -9.297 -16.838 1.00 97.45 85 A 1 ATOM 690 N N . ASN A 1 86 ? -27.691 -2.317 -15.016 1.00 98.13 86 A 1 ATOM 691 C CA . ASN A 1 86 ? -27.519 -0.891 -14.766 1.00 98.02 86 A 1 ATOM 692 C C . ASN A 1 86 ? -26.389 -0.613 -13.764 1.00 98.40 86 A 1 ATOM 693 O O . ASN A 1 86 ? -26.041 -1.446 -12.922 1.00 98.06 86 A 1 ATOM 694 C CB . ASN A 1 86 ? -28.864 -0.277 -14.334 1.00 96.73 86 A 1 ATOM 695 C CG . ASN A 1 86 ? -29.296 -0.751 -12.958 1.00 95.60 86 A 1 ATOM 696 O OD1 . ASN A 1 86 ? -28.814 -0.288 -11.941 1.00 89.37 86 A 1 ATOM 697 N ND2 . ASN A 1 86 ? -30.199 -1.703 -12.889 1.00 87.51 86 A 1 ATOM 698 N N . LEU A 1 87 ? -25.840 0.601 -13.849 1.00 98.08 87 A 1 ATOM 699 C CA . LEU A 1 87 ? -24.687 1.046 -13.064 1.00 98.21 87 A 1 ATOM 700 C C . LEU A 1 87 ? -24.938 1.081 -11.550 1.00 98.22 87 A 1 ATOM 701 O O . LEU A 1 87 ? -23.996 0.907 -10.784 1.00 97.72 87 A 1 ATOM 702 C CB . LEU A 1 87 ? -24.280 2.449 -13.544 1.00 98.14 87 A 1 ATOM 703 C CG . LEU A 1 87 ? -23.546 2.474 -14.901 1.00 97.80 87 A 1 ATOM 704 C CD1 . LEU A 1 87 ? -23.507 3.904 -15.433 1.00 97.18 87 A 1 ATOM 705 C CD2 . LEU A 1 87 ? -22.105 1.978 -14.760 1.00 96.74 87 A 1 ATOM 706 N N . ASP A 1 88 ? -26.170 1.320 -11.098 1.00 98.13 88 A 1 ATOM 707 C CA . ASP A 1 88 ? -26.438 1.462 -9.664 1.00 97.83 88 A 1 ATOM 708 C C . ASP A 1 88 ? -26.702 0.115 -8.980 1.00 98.15 88 A 1 ATOM 709 O O . ASP A 1 88 ? -26.306 -0.084 -7.830 1.00 97.38 88 A 1 ATOM 710 C CB . ASP A 1 88 ? -27.582 2.456 -9.437 1.00 96.36 88 A 1 ATOM 711 C CG . ASP A 1 88 ? -27.190 3.907 -9.760 1.00 92.38 88 A 1 ATOM 712 O OD1 . ASP A 1 88 ? -25.979 4.240 -9.696 1.00 88.46 88 A 1 ATOM 713 O OD2 . ASP A 1 88 ? -28.110 4.700 -10.045 1.00 87.13 88 A 1 ATOM 714 N N . THR A 1 89 ? -27.310 -0.840 -9.690 1.00 98.08 89 A 1 ATOM 715 C CA . THR A 1 89 ? -27.624 -2.171 -9.147 1.00 98.26 89 A 1 ATOM 716 C C . THR A 1 89 ? -26.484 -3.170 -9.332 1.00 98.47 89 A 1 ATOM 717 O O . THR A 1 89 ? -26.126 -3.879 -8.392 1.00 98.17 89 A 1 ATOM 718 C CB . THR A 1 89 ? -28.906 -2.733 -9.778 1.00 97.88 89 A 1 ATOM 719 O OG1 . THR A 1 89 ? -29.961 -1.811 -9.663 1.00 95.64 89 A 1 ATOM 720 C CG2 . THR A 1 89 ? -29.376 -4.018 -9.099 1.00 95.08 89 A 1 ATOM 721 N N . HIS A 1 90 ? -25.931 -3.245 -10.545 1.00 98.49 90 A 1 ATOM 722 C CA . HIS A 1 90 ? -24.935 -4.251 -10.930 1.00 98.56 90 A 1 ATOM 723 C C . HIS A 1 90 ? -23.511 -3.683 -10.942 1.00 98.64 90 A 1 ATOM 724 O O . HIS A 1 90 ? -22.547 -4.435 -10.808 1.00 98.41 90 A 1 ATOM 725 C CB . HIS A 1 90 ? -25.302 -4.821 -12.306 1.00 98.48 90 A 1 ATOM 726 C CG . HIS A 1 90 ? -26.729 -5.284 -12.416 1.00 98.32 90 A 1 ATOM 727 N ND1 . HIS A 1 90 ? -27.812 -4.503 -12.756 1.00 93.37 90 A 1 ATOM 728 C CD2 . HIS A 1 90 ? -27.216 -6.549 -12.180 1.00 93.60 90 A 1 ATOM 729 C CE1 . HIS A 1 90 ? -28.909 -5.276 -12.723 1.00 93.98 90 A 1 ATOM 730 N NE2 . HIS A 1 90 ? -28.591 -6.524 -12.378 1.00 95.33 90 A 1 ATOM 731 N N . GLY A 1 91 ? -23.382 -2.367 -11.088 1.00 98.46 91 A 1 ATOM 732 C CA . GLY A 1 91 ? -22.120 -1.643 -11.242 1.00 98.55 91 A 1 ATOM 733 C C . GLY A 1 91 ? -21.673 -1.462 -12.694 1.00 98.68 91 A 1 ATOM 734 O O . GLY A 1 91 ? -20.683 -0.780 -12.940 1.00 98.45 91 A 1 ATOM 735 N N . PHE A 1 92 ? -22.395 -2.032 -13.659 1.00 98.60 92 A 1 ATOM 736 C CA . PHE A 1 92 ? -22.086 -1.920 -15.081 1.00 98.62 92 A 1 ATOM 737 C C . PHE A 1 92 ? -23.352 -1.776 -15.930 1.00 98.56 92 A 1 ATOM 738 O O . PHE A 1 92 ? -24.451 -2.124 -15.501 1.00 98.33 92 A 1 ATOM 739 C CB . PHE A 1 92 ? -21.234 -3.116 -15.531 1.00 98.58 92 A 1 ATOM 740 C CG . PHE A 1 92 ? -21.891 -4.467 -15.322 1.00 98.69 92 A 1 ATOM 741 C CD1 . PHE A 1 92 ? -21.600 -5.220 -14.169 1.00 98.23 92 A 1 ATOM 742 C CD2 . PHE A 1 92 ? -22.804 -4.972 -16.262 1.00 98.21 92 A 1 ATOM 743 C CE1 . PHE A 1 92 ? -22.218 -6.461 -13.957 1.00 98.00 92 A 1 ATOM 744 C CE2 . PHE A 1 92 ? -23.430 -6.213 -16.055 1.00 97.99 92 A 1 ATOM 745 C CZ . PHE A 1 92 ? -23.136 -6.956 -14.898 1.00 98.28 92 A 1 ATOM 746 N N . ALA A 1 93 ? -23.190 -1.278 -17.154 1.00 98.46 93 A 1 ATOM 747 C CA . ALA A 1 93 ? -24.255 -1.213 -18.144 1.00 98.39 93 A 1 ATOM 748 C C . ALA A 1 93 ? -23.675 -1.240 -19.560 1.00 98.50 93 A 1 ATOM 749 O O . ALA A 1 93 ? -22.659 -0.597 -19.828 1.00 98.21 93 A 1 ATOM 750 C CB . ALA A 1 93 ? -25.073 0.064 -17.921 1.00 97.93 93 A 1 ATOM 751 N N . TRP A 1 94 ? -24.336 -1.948 -20.468 1.00 98.35 94 A 1 ATOM 752 C CA . TRP A 1 94 ? -24.069 -1.821 -21.900 1.00 98.35 94 A 1 ATOM 753 C C . TRP A 1 94 ? -24.908 -0.693 -22.495 1.00 98.16 94 A 1 ATOM 754 O O . TRP A 1 94 ? -26.073 -0.510 -22.144 1.00 97.71 94 A 1 ATOM 755 C CB . TRP A 1 94 ? -24.311 -3.143 -22.626 1.00 98.17 94 A 1 ATOM 756 C CG . TRP A 1 94 ? -23.355 -4.233 -22.251 1.00 98.28 94 A 1 ATOM 757 C CD1 . TRP A 1 94 ? -22.136 -4.433 -22.791 1.00 97.67 94 A 1 ATOM 758 C CD2 . TRP A 1 94 ? -23.521 -5.264 -21.231 1.00 98.31 94 A 1 ATOM 759 N NE1 . TRP A 1 94 ? -21.530 -5.528 -22.181 1.00 97.69 94 A 1 ATOM 760 C CE2 . TRP A 1 94 ? -22.344 -6.064 -21.223 1.00 98.08 94 A 1 ATOM 761 C CE3 . TRP A 1 94 ? -24.548 -5.598 -20.324 1.00 98.05 94 A 1 ATOM 762 C CZ2 . TRP A 1 94 ? -22.187 -7.164 -20.347 1.00 97.74 94 A 1 ATOM 763 C CZ3 . TRP A 1 94 ? -24.390 -6.693 -19.448 1.00 97.42 94 A 1 ATOM 764 C CH2 . TRP A 1 94 ? -23.224 -7.465 -19.462 1.00 97.28 94 A 1 ATOM 765 N N . VAL A 1 95 ? -24.320 0.063 -23.414 1.00 98.13 95 A 1 ATOM 766 C CA . VAL A 1 95 ? -24.990 1.156 -24.119 1.00 97.88 95 A 1 ATOM 767 C C . VAL A 1 95 ? -24.680 1.098 -25.612 1.00 97.92 95 A 1 ATOM 768 O O . VAL A 1 95 ? -23.580 0.727 -26.016 1.00 97.60 95 A 1 ATOM 769 C CB . VAL A 1 95 ? -24.618 2.536 -23.543 1.00 97.16 95 A 1 ATOM 770 C CG1 . VAL A 1 95 ? -25.049 2.669 -22.078 1.00 94.26 95 A 1 ATOM 771 C CG2 . VAL A 1 95 ? -23.119 2.869 -23.635 1.00 94.13 95 A 1 ATOM 772 N N . LYS A 1 96 ? -25.635 1.522 -26.440 1.00 97.45 96 A 1 ATOM 773 C CA . LYS A 1 96 ? -25.353 1.880 -27.829 1.00 97.09 96 A 1 ATOM 774 C C . LYS A 1 96 ? -24.892 3.327 -27.873 1.00 97.22 96 A 1 ATOM 775 O O . LYS A 1 96 ? -25.597 4.220 -27.399 1.00 95.79 96 A 1 ATOM 776 C CB . LYS A 1 96 ? -26.565 1.637 -28.732 1.00 95.82 96 A 1 ATOM 777 C CG . LYS A 1 96 ? -26.829 0.131 -28.881 1.00 87.54 96 A 1 ATOM 778 C CD . LYS A 1 96 ? -27.884 -0.156 -29.953 1.00 78.68 96 A 1 ATOM 779 C CE . LYS A 1 96 ? -28.011 -1.678 -30.082 1.00 68.93 96 A 1 ATOM 780 N NZ . LYS A 1 96 ? -28.881 -2.083 -31.200 1.00 59.65 96 A 1 ATOM 781 N N . HIS A 1 97 ? -23.717 3.556 -28.428 1.00 97.44 97 A 1 ATOM 782 C CA . HIS A 1 97 ? -23.110 4.876 -28.520 1.00 97.36 97 A 1 ATOM 783 C C . HIS A 1 97 ? -22.173 4.932 -29.724 1.00 97.30 97 A 1 ATOM 784 O O . HIS A 1 97 ? -21.055 4.421 -29.668 1.00 96.39 97 A 1 ATOM 785 C CB . HIS A 1 97 ? -22.374 5.181 -27.205 1.00 96.72 97 A 1 ATOM 786 C CG . HIS A 1 97 ? -21.612 6.478 -27.245 1.00 96.31 97 A 1 ATOM 787 N ND1 . HIS A 1 97 ? -20.245 6.614 -27.353 1.00 89.70 97 A 1 ATOM 788 C CD2 . HIS A 1 97 ? -22.146 7.740 -27.231 1.00 88.73 97 A 1 ATOM 789 C CE1 . HIS A 1 97 ? -19.960 7.925 -27.390 1.00 89.47 97 A 1 ATOM 790 N NE2 . HIS A 1 97 ? -21.090 8.639 -27.323 1.00 90.72 97 A 1 ATOM 791 N N . LYS A 1 98 ? -22.610 5.543 -30.809 1.00 96.52 98 A 1 ATOM 792 C CA . LYS A 1 98 ? -21.750 5.784 -31.974 1.00 96.28 98 A 1 ATOM 793 C C . LYS A 1 98 ? -20.650 6.781 -31.633 1.00 96.66 98 A 1 ATOM 794 O O . LYS A 1 98 ? -20.873 7.704 -30.854 1.00 94.56 98 A 1 ATOM 795 C CB . LYS A 1 98 ? -22.578 6.260 -33.174 1.00 94.65 98 A 1 ATOM 796 C CG . LYS A 1 98 ? -23.417 5.119 -33.767 1.00 87.26 98 A 1 ATOM 797 C CD . LYS A 1 98 ? -24.132 5.568 -35.049 1.00 81.17 98 A 1 ATOM 798 C CE . LYS A 1 98 ? -24.787 4.381 -35.763 1.00 71.61 98 A 1 ATOM 799 N NZ . LYS A 1 98 ? -23.783 3.551 -36.484 1.00 62.45 98 A 1 ATOM 800 N N . THR A 1 99 ? -19.479 6.598 -32.251 1.00 96.87 99 A 1 ATOM 801 C CA . THR A 1 99 ? -18.369 7.551 -32.195 1.00 97.04 99 A 1 ATOM 802 C C . THR A 1 99 ? -17.976 7.987 -33.604 1.00 97.00 99 A 1 ATOM 803 O O . THR A 1 99 ? -18.145 7.235 -34.563 1.00 96.00 99 A 1 ATOM 804 C CB . THR A 1 99 ? -17.173 6.972 -31.419 1.00 96.51 99 A 1 ATOM 805 O OG1 . THR A 1 99 ? -16.113 7.893 -31.428 1.00 93.91 99 A 1 ATOM 806 C CG2 . THR A 1 99 ? -16.633 5.654 -31.980 1.00 93.48 99 A 1 ATOM 807 N N . SER A 1 100 ? -17.451 9.199 -33.724 1.00 96.26 100 A 1 ATOM 808 C CA . SER A 1 100 ? -16.818 9.678 -34.959 1.00 95.74 100 A 1 ATOM 809 C C . SER A 1 100 ? -15.381 9.167 -35.128 1.00 95.97 100 A 1 ATOM 810 O O . SER A 1 100 ? -14.814 9.283 -36.210 1.00 94.04 100 A 1 ATOM 811 C CB . SER A 1 100 ? -16.841 11.210 -34.978 1.00 95.06 100 A 1 ATOM 812 O OG . SER A 1 100 ? -16.074 11.772 -33.935 1.00 92.63 100 A 1 ATOM 813 N N . VAL A 1 101 ? -14.791 8.601 -34.067 1.00 97.02 101 A 1 ATOM 814 C CA . VAL A 1 101 ? -13.400 8.138 -34.033 1.00 97.00 101 A 1 ATOM 815 C C . VAL A 1 101 ? -13.337 6.643 -34.348 1.00 96.82 101 A 1 ATOM 816 O O . VAL A 1 101 ? -14.015 5.834 -33.716 1.00 95.48 101 A 1 ATOM 817 C CB . VAL A 1 101 ? -12.745 8.462 -32.680 1.00 96.49 101 A 1 ATOM 818 C CG1 . VAL A 1 101 ? -11.264 8.076 -32.672 1.00 94.02 101 A 1 ATOM 819 C CG2 . VAL A 1 101 ? -12.835 9.966 -32.376 1.00 94.37 101 A 1 ATOM 820 N N . THR A 1 102 ? -12.491 6.281 -35.315 1.00 96.02 102 A 1 ATOM 821 C CA . THR A 1 102 ? -12.306 4.895 -35.787 1.00 95.06 102 A 1 ATOM 822 C C . THR A 1 102 ? -10.888 4.362 -35.564 1.00 95.40 102 A 1 ATOM 823 O O . THR A 1 102 ? -10.688 3.157 -35.479 1.00 92.85 102 A 1 ATOM 824 C CB . THR A 1 102 ? -12.648 4.793 -37.281 1.00 92.79 102 A 1 ATOM 825 O OG1 . THR A 1 102 ? -11.889 5.723 -38.029 1.00 86.35 102 A 1 ATOM 826 C CG2 . THR A 1 102 ? -14.121 5.095 -37.562 1.00 84.17 102 A 1 ATOM 827 N N . GLU A 1 103 ? -9.909 5.251 -35.455 1.00 95.37 103 A 1 ATOM 828 C CA . GLU A 1 103 ? -8.490 4.951 -35.225 1.00 95.04 103 A 1 ATOM 829 C C . GLU A 1 103 ? -8.103 5.323 -33.788 1.00 96.18 103 A 1 ATOM 830 O O . GLU A 1 103 ? -8.332 6.454 -33.366 1.00 94.57 103 A 1 ATOM 831 C CB . GLU A 1 103 ? -7.647 5.737 -36.244 1.00 92.67 103 A 1 ATOM 832 C CG . GLU A 1 103 ? -7.271 4.910 -37.489 1.00 82.85 103 A 1 ATOM 833 C CD . GLU A 1 103 ? -6.010 4.055 -37.285 1.00 74.23 103 A 1 ATOM 834 O OE1 . GLU A 1 103 ? -5.816 3.124 -38.095 1.00 66.36 103 A 1 ATOM 835 O OE2 . GLU A 1 103 ? -5.239 4.346 -36.341 1.00 66.85 103 A 1 ATOM 836 N N . PHE A 1 104 ? -7.506 4.376 -33.041 1.00 96.64 104 A 1 ATOM 837 C CA . PHE A 1 104 ? -7.153 4.546 -31.621 1.00 97.05 104 A 1 ATOM 838 C C . PHE A 1 104 ? -5.670 4.280 -31.310 1.00 96.81 104 A 1 ATOM 839 O O . PHE A 1 104 ? -5.283 4.283 -30.139 1.00 94.98 104 A 1 ATOM 840 C CB . PHE A 1 104 ? -8.076 3.677 -30.756 1.00 97.07 104 A 1 ATOM 841 C CG . PHE A 1 104 ? -9.494 4.198 -30.638 1.00 97.52 104 A 1 ATOM 842 C CD1 . PHE A 1 104 ? -9.837 5.061 -29.581 1.00 96.59 104 A 1 ATOM 843 C CD2 . PHE A 1 104 ? -10.471 3.836 -31.579 1.00 96.67 104 A 1 ATOM 844 C CE1 . PHE A 1 104 ? -11.146 5.548 -29.456 1.00 95.99 104 A 1 ATOM 845 C CE2 . PHE A 1 104 ? -11.786 4.325 -31.467 1.00 96.03 104 A 1 ATOM 846 C CZ . PHE A 1 104 ? -12.122 5.180 -30.404 1.00 96.51 104 A 1 ATOM 847 N N . ALA A 1 105 ? -4.835 4.046 -32.320 1.00 96.61 105 A 1 ATOM 848 C CA . ALA A 1 105 ? -3.429 3.689 -32.116 1.00 95.84 105 A 1 ATOM 849 C C . ALA A 1 105 ? -2.576 4.865 -31.600 1.00 95.98 105 A 1 ATOM 850 O O . ALA A 1 105 ? -1.681 4.666 -30.781 1.00 93.83 105 A 1 ATOM 851 C CB . ALA A 1 105 ? -2.881 3.132 -33.435 1.00 94.06 105 A 1 ATOM 852 N N . ASP A 1 106 ? -2.859 6.092 -32.048 1.00 96.26 106 A 1 ATOM 853 C CA . ASP A 1 106 ? -2.143 7.294 -31.612 1.00 96.39 106 A 1 ATOM 854 C C . ASP A 1 106 ? -2.769 7.874 -30.334 1.00 96.61 106 A 1 ATOM 855 O O . ASP A 1 106 ? -3.825 8.514 -30.344 1.00 95.98 106 A 1 ATOM 856 C CB . ASP A 1 106 ? -2.066 8.313 -32.758 1.00 95.79 106 A 1 ATOM 857 C CG . ASP A 1 106 ? -1.225 9.557 -32.421 1.00 94.18 106 A 1 ATOM 858 O OD1 . ASP A 1 106 ? -0.997 9.843 -31.220 1.00 91.08 106 A 1 ATOM 859 O OD2 . ASP A 1 106 ? -0.839 10.269 -33.370 1.00 89.48 106 A 1 ATOM 860 N N . TYR A 1 107 ? -2.073 7.684 -29.203 1.00 96.64 107 A 1 ATOM 861 C CA . TYR A 1 107 ? -2.509 8.169 -27.895 1.00 96.34 107 A 1 ATOM 862 C C . TYR A 1 107 ? -2.762 9.684 -27.867 1.00 96.95 107 A 1 ATOM 863 O O . TYR A 1 107 ? -3.761 10.142 -27.303 1.00 96.67 107 A 1 ATOM 864 C CB . TYR A 1 107 ? -1.457 7.795 -26.842 1.00 95.26 107 A 1 ATOM 865 C CG . TYR A 1 107 ? -1.823 8.245 -25.442 1.00 93.69 107 A 1 ATOM 866 C CD1 . TYR A 1 107 ? -1.309 9.444 -24.911 1.00 91.16 107 A 1 ATOM 867 C CD2 . TYR A 1 107 ? -2.729 7.485 -24.676 1.00 90.87 107 A 1 ATOM 868 C CE1 . TYR A 1 107 ? -1.698 9.882 -23.631 1.00 89.67 107 A 1 ATOM 869 C CE2 . TYR A 1 107 ? -3.124 7.914 -23.398 1.00 88.97 107 A 1 ATOM 870 C CZ . TYR A 1 107 ? -2.609 9.117 -22.880 1.00 89.32 107 A 1 ATOM 871 O OH . TYR A 1 107 ? -3.013 9.544 -21.641 1.00 87.02 107 A 1 ATOM 872 N N . LEU A 1 108 ? -1.856 10.477 -28.454 1.00 96.77 108 A 1 ATOM 873 C CA . LEU A 1 108 ? -1.972 11.935 -28.452 1.00 96.61 108 A 1 ATOM 874 C C . LEU A 1 108 ? -3.130 12.409 -29.332 1.00 96.97 108 A 1 ATOM 875 O O . LEU A 1 108 ? -3.869 13.302 -28.914 1.00 96.38 108 A 1 ATOM 876 C CB . LEU A 1 108 ? -0.645 12.571 -28.903 1.00 95.90 108 A 1 ATOM 877 C CG . LEU A 1 108 ? 0.444 12.591 -27.816 1.00 87.31 108 A 1 ATOM 878 C CD1 . LEU A 1 108 ? 1.785 12.978 -28.439 1.00 83.17 108 A 1 ATOM 879 C CD2 . LEU A 1 108 ? 0.128 13.615 -26.715 1.00 83.06 108 A 1 ATOM 880 N N . ALA A 1 109 ? -3.326 11.781 -30.491 1.00 97.29 109 A 1 ATOM 881 C CA . ALA A 1 109 ? -4.445 12.099 -31.377 1.00 97.18 109 A 1 ATOM 882 C C . ALA A 1 109 ? -5.797 11.866 -30.683 1.00 97.28 109 A 1 ATOM 883 O O . ALA A 1 109 ? -6.679 12.723 -30.752 1.00 96.30 109 A 1 ATOM 884 C CB . ALA A 1 109 ? -4.320 11.276 -32.660 1.00 96.62 109 A 1 ATOM 885 N N . ILE A 1 110 ? -5.948 10.761 -29.941 1.00 97.56 110 A 1 ATOM 886 C CA . ILE A 1 110 ? -7.172 10.497 -29.169 1.00 97.69 110 A 1 ATOM 887 C C . ILE A 1 110 ? -7.344 11.510 -28.035 1.00 97.58 110 A 1 ATOM 888 O O . ILE A 1 110 ? -8.433 12.052 -27.847 1.00 97.02 110 A 1 ATOM 889 C CB . ILE A 1 110 ? -7.196 9.049 -28.648 1.00 97.60 110 A 1 ATOM 890 C CG1 . ILE A 1 110 ? -7.175 8.019 -29.794 1.00 96.62 110 A 1 ATOM 891 C CG2 . ILE A 1 110 ? -8.426 8.796 -27.748 1.00 96.84 110 A 1 ATOM 892 C CD1 . ILE A 1 110 ? -8.332 8.113 -30.792 1.00 94.46 110 A 1 ATOM 893 N N . ARG A 1 111 ? -6.266 11.805 -27.294 1.00 97.52 111 A 1 ATOM 894 C CA . ARG A 1 111 ? -6.307 12.732 -26.155 1.00 96.91 111 A 1 ATOM 895 C C . ARG A 1 111 ? -6.668 14.163 -26.561 1.00 96.87 111 A 1 ATOM 896 O O . ARG A 1 111 ? -7.268 14.887 -25.769 1.00 95.31 111 A 1 ATOM 897 C CB . ARG A 1 111 ? -4.964 12.674 -25.414 1.00 95.57 111 A 1 ATOM 898 C CG . ARG A 1 111 ? -5.043 13.349 -24.042 1.00 87.56 111 A 1 ATOM 899 C CD . ARG A 1 111 ? -3.727 13.204 -23.278 1.00 85.55 111 A 1 ATOM 900 N NE . ARG A 1 111 ? -3.823 13.778 -21.923 1.00 81.45 111 A 1 ATOM 901 C CZ . ARG A 1 111 ? -4.008 13.118 -20.784 1.00 76.84 111 A 1 ATOM 902 N NH1 . ARG A 1 111 ? -4.059 11.819 -20.733 1.00 69.37 111 A 1 ATOM 903 N NH2 . ARG A 1 111 ? -4.138 13.765 -19.665 1.00 71.27 111 A 1 ATOM 904 N N . GLN A 1 112 ? -6.303 14.571 -27.764 1.00 97.05 112 A 1 ATOM 905 C CA . GLN A 1 112 ? -6.571 15.908 -28.313 1.00 96.46 112 A 1 ATOM 906 C C . GLN A 1 112 ? -7.807 15.947 -29.227 1.00 96.57 112 A 1 ATOM 907 O O . GLN A 1 112 ? -8.309 17.026 -29.538 1.00 94.87 112 A 1 ATOM 908 C CB . GLN A 1 112 ? -5.329 16.387 -29.076 1.00 95.47 112 A 1 ATOM 909 C CG . GLN A 1 112 ? -4.114 16.586 -28.148 1.00 91.70 112 A 1 ATOM 910 C CD . GLN A 1 112 ? -2.837 16.970 -28.906 1.00 86.28 112 A 1 ATOM 911 O OE1 . GLN A 1 112 ? -2.794 17.119 -30.114 1.00 79.52 112 A 1 ATOM 912 N NE2 . GLN A 1 112 ? -1.734 17.148 -28.213 1.00 76.80 112 A 1 ATOM 913 N N . GLY A 1 113 ? -8.279 14.783 -29.650 1.00 96.99 113 A 1 ATOM 914 C CA . GLY A 1 113 ? -9.400 14.630 -30.564 1.00 96.93 113 A 1 ATOM 915 C C . GLY A 1 113 ? -10.781 14.729 -29.897 1.00 97.62 113 A 1 ATOM 916 O O . GLY A 1 113 ? -10.900 15.041 -28.710 1.00 96.67 113 A 1 ATOM 917 N N . PRO A 1 114 ? -11.855 14.428 -30.642 1.00 97.59 114 A 1 ATOM 918 C CA . PRO A 1 114 ? -13.227 14.567 -30.144 1.00 97.64 114 A 1 ATOM 919 C C . PRO A 1 114 ? -13.658 13.461 -29.170 1.00 97.95 114 A 1 ATOM 920 O O . PRO A 1 114 ? -14.610 13.656 -28.417 1.00 97.19 114 A 1 ATOM 921 C CB . PRO A 1 114 ? -14.096 14.584 -31.409 1.00 96.88 114 A 1 ATOM 922 C CG . PRO A 1 114 ? -13.295 13.732 -32.396 1.00 95.66 114 A 1 ATOM 923 C CD . PRO A 1 114 ? -11.851 14.078 -32.052 1.00 97.20 114 A 1 ATOM 924 N N . TYR A 1 115 ? -12.973 12.304 -29.142 1.00 97.79 115 A 1 ATOM 925 C CA . TYR A 1 115 ? -13.432 11.106 -28.430 1.00 98.19 115 A 1 ATOM 926 C C . TYR A 1 115 ? -13.695 11.327 -26.936 1.00 98.38 115 A 1 ATOM 927 O O . TYR A 1 115 ? -14.721 10.891 -26.410 1.00 98.13 115 A 1 ATOM 928 C CB . TYR A 1 115 ? -12.419 9.969 -28.618 1.00 98.15 115 A 1 ATOM 929 C CG . TYR A 1 115 ? -12.934 8.644 -28.089 1.00 98.34 115 A 1 ATOM 930 C CD1 . TYR A 1 115 ? -12.368 8.042 -26.951 1.00 97.96 115 A 1 ATOM 931 C CD2 . TYR A 1 115 ? -14.031 8.028 -28.726 1.00 98.05 115 A 1 ATOM 932 C CE1 . TYR A 1 115 ? -12.885 6.834 -26.456 1.00 97.82 115 A 1 ATOM 933 C CE2 . TYR A 1 115 ? -14.560 6.824 -28.234 1.00 97.88 115 A 1 ATOM 934 C CZ . TYR A 1 115 ? -13.985 6.232 -27.095 1.00 98.14 115 A 1 ATOM 935 O OH . TYR A 1 115 ? -14.517 5.067 -26.610 1.00 97.67 115 A 1 ATOM 936 N N . TYR A 1 116 ? -12.810 12.040 -26.245 1.00 98.38 116 A 1 ATOM 937 C CA . TYR A 1 116 ? -12.995 12.338 -24.824 1.00 98.43 116 A 1 ATOM 938 C C . TYR A 1 116 ? -14.258 13.176 -24.574 1.00 98.38 116 A 1 ATOM 939 O O . TYR A 1 116 ? -14.964 12.946 -23.597 1.00 97.82 116 A 1 ATOM 940 C CB . TYR A 1 116 ? -11.753 13.052 -24.272 1.00 98.23 116 A 1 ATOM 941 C CG . TYR A 1 116 ? -10.524 12.204 -23.982 1.00 98.39 116 A 1 ATOM 942 C CD1 . TYR A 1 116 ? -10.302 10.942 -24.570 1.00 97.60 116 A 1 ATOM 943 C CD2 . TYR A 1 116 ? -9.565 12.713 -23.080 1.00 97.56 116 A 1 ATOM 944 C CE1 . TYR A 1 116 ? -9.143 10.198 -24.270 1.00 97.22 116 A 1 ATOM 945 C CE2 . TYR A 1 116 ? -8.404 11.983 -22.773 1.00 97.24 116 A 1 ATOM 946 C CZ . TYR A 1 116 ? -8.195 10.724 -23.371 1.00 97.84 116 A 1 ATOM 947 O OH . TYR A 1 116 ? -7.060 10.020 -23.065 1.00 97.11 116 A 1 ATOM 948 N N . GLY A 1 117 ? -14.560 14.117 -25.460 1.00 98.31 117 A 1 ATOM 949 C CA . GLY A 1 117 ? -15.792 14.906 -25.406 1.00 98.15 117 A 1 ATOM 950 C C . GLY A 1 117 ? -17.039 14.048 -25.633 1.00 98.25 117 A 1 ATOM 951 O O . GLY A 1 117 ? -17.992 14.145 -24.858 1.00 97.71 117 A 1 ATOM 952 N N . GLU A 1 118 ? -17.011 13.147 -26.621 1.00 98.07 118 A 1 ATOM 953 C CA . GLU A 1 118 ? -18.101 12.200 -26.892 1.00 97.96 118 A 1 ATOM 954 C C . GLU A 1 118 ? -18.378 11.280 -25.687 1.00 98.13 118 A 1 ATOM 955 O O . GLU A 1 118 ? -19.532 11.075 -25.303 1.00 97.67 118 A 1 ATOM 956 C CB . GLU A 1 118 ? -17.759 11.325 -28.109 1.00 97.47 118 A 1 ATOM 957 C CG . GLU A 1 118 ? -17.696 12.064 -29.456 1.00 95.56 118 A 1 ATOM 958 C CD . GLU A 1 118 ? -17.357 11.119 -30.625 1.00 95.92 118 A 1 ATOM 959 O OE1 . GLU A 1 118 ? -17.309 11.585 -31.782 1.00 90.68 118 A 1 ATOM 960 O OE2 . GLU A 1 118 ? -17.161 9.897 -30.398 1.00 92.69 118 A 1 ATOM 961 N N . VAL A 1 119 ? -17.311 10.748 -25.062 1.00 98.24 119 A 1 ATOM 962 C CA . VAL A 1 119 ? -17.410 9.904 -23.865 1.00 98.30 119 A 1 ATOM 963 C C . VAL A 1 119 ? -17.990 10.689 -22.683 1.00 98.40 119 A 1 ATOM 964 O O . VAL A 1 119 ? -18.895 10.199 -22.009 1.00 98.22 119 A 1 ATOM 965 C CB . VAL A 1 119 ? -16.033 9.296 -23.516 1.00 97.98 119 A 1 ATOM 966 C CG1 . VAL A 1 119 ? -16.012 8.628 -22.135 1.00 96.83 119 A 1 ATOM 967 C CG2 . VAL A 1 119 ? -15.641 8.225 -24.542 1.00 96.99 119 A 1 ATOM 968 N N . ALA A 1 120 ? -17.508 11.904 -22.443 1.00 98.35 120 A 1 ATOM 969 C CA . ALA A 1 120 ? -17.997 12.748 -21.355 1.00 98.31 120 A 1 ATOM 970 C C . ALA A 1 120 ? -19.483 13.113 -21.524 1.00 98.28 120 A 1 ATOM 971 O O . ALA A 1 120 ? -20.262 12.983 -20.577 1.00 97.96 120 A 1 ATOM 972 C CB . ALA A 1 120 ? -17.105 13.994 -21.265 1.00 98.07 120 A 1 ATOM 973 N N . GLU A 1 121 ? -19.893 13.509 -22.721 1.00 98.15 121 A 1 ATOM 974 C CA . GLU A 1 121 ? -21.297 13.799 -23.050 1.00 97.97 121 A 1 ATOM 975 C C . GLU A 1 121 ? -22.200 12.572 -22.847 1.00 98.15 121 A 1 ATOM 976 O O . GLU A 1 121 ? -23.271 12.672 -22.241 1.00 97.69 121 A 1 ATOM 977 C CB . GLU A 1 121 ? -21.389 14.261 -24.519 1.00 97.38 121 A 1 ATOM 978 C CG . GLU A 1 121 ? -21.291 15.785 -24.695 1.00 85.58 121 A 1 ATOM 979 C CD . GLU A 1 121 ? -22.643 16.483 -24.446 1.00 72.12 121 A 1 ATOM 980 O OE1 . GLU A 1 121 ? -22.648 17.499 -23.717 1.00 64.16 121 A 1 ATOM 981 O OE2 . GLU A 1 121 ? -23.670 15.985 -24.967 1.00 65.03 121 A 1 ATOM 982 N N . MET A 1 122 ? -21.757 11.395 -23.301 1.00 97.85 122 A 1 ATOM 983 C CA . MET A 1 122 ? -22.493 10.149 -23.126 1.00 97.86 122 A 1 ATOM 984 C C . MET A 1 122 ? -22.656 9.809 -21.649 1.00 98.18 122 A 1 ATOM 985 O O . MET A 1 122 ? -23.779 9.549 -21.205 1.00 97.92 122 A 1 ATOM 986 C CB . MET A 1 122 ? -21.803 9.039 -23.927 1.00 97.36 122 A 1 ATOM 987 C CG . MET A 1 122 ? -22.501 7.679 -23.815 1.00 96.06 122 A 1 ATOM 988 S SD . MET A 1 122 ? -22.095 6.695 -22.341 1.00 95.53 122 A 1 ATOM 989 C CE . MET A 1 122 ? -20.369 6.302 -22.717 1.00 90.12 122 A 1 ATOM 990 N N . LEU A 1 123 ? -21.575 9.851 -20.855 1.00 97.87 123 A 1 ATOM 991 C CA . LEU A 1 123 ? -21.624 9.565 -19.422 1.00 98.06 123 A 1 ATOM 992 C C . LEU A 1 123 ? -22.551 10.522 -18.676 1.00 98.08 123 A 1 ATOM 993 O O . LEU A 1 123 ? -23.359 10.063 -17.873 1.00 97.77 123 A 1 ATOM 994 C CB . LEU A 1 123 ? -20.214 9.599 -18.814 1.00 97.93 123 A 1 ATOM 995 C CG . LEU A 1 123 ? -19.377 8.333 -19.072 1.00 97.10 123 A 1 ATOM 996 C CD1 . LEU A 1 123 ? -17.980 8.550 -18.490 1.00 96.51 123 A 1 ATOM 997 C CD2 . LEU A 1 123 ? -19.975 7.092 -18.402 1.00 96.25 123 A 1 ATOM 998 N N . LYS A 1 124 ? -22.502 11.821 -18.960 1.00 98.32 124 A 1 ATOM 999 C CA . LYS A 1 124 ? -23.431 12.797 -18.366 1.00 98.18 124 A 1 ATOM 1000 C C . LYS A 1 124 ? -24.886 12.432 -18.663 1.00 98.05 124 A 1 ATOM 1001 O O . LYS A 1 124 ? -25.708 12.421 -17.756 1.00 97.37 124 A 1 ATOM 1002 C CB . LYS A 1 124 ? -23.127 14.214 -18.870 1.00 97.73 124 A 1 ATOM 1003 C CG . LYS A 1 124 ? -21.853 14.790 -18.230 1.00 93.63 124 A 1 ATOM 1004 C CD . LYS A 1 124 ? -21.559 16.218 -18.709 1.00 91.22 124 A 1 ATOM 1005 C CE . LYS A 1 124 ? -22.595 17.194 -18.129 1.00 83.18 124 A 1 ATOM 1006 N NZ . LYS A 1 124 ? -22.248 18.598 -18.425 1.00 77.25 124 A 1 ATOM 1007 N N . ARG A 1 125 ? -25.192 12.073 -19.908 1.00 98.04 125 A 1 ATOM 1008 C CA . ARG A 1 125 ? -26.553 11.704 -20.322 1.00 97.72 125 A 1 ATOM 1009 C C . ARG A 1 125 ? -27.033 10.402 -19.668 1.00 97.80 125 A 1 ATOM 1010 O O . ARG A 1 125 ? -28.197 10.312 -19.295 1.00 96.71 125 A 1 ATOM 1011 C CB . ARG A 1 125 ? -26.588 11.635 -21.854 1.00 96.79 125 A 1 ATOM 1012 C CG . ARG A 1 125 ? -27.998 11.372 -22.403 1.00 85.59 125 A 1 ATOM 1013 C CD . ARG A 1 125 ? -28.016 11.459 -23.943 1.00 83.69 125 A 1 ATOM 1014 N NE . ARG A 1 125 ? -27.085 10.497 -24.561 1.00 74.53 125 A 1 ATOM 1015 C CZ . ARG A 1 125 ? -26.123 10.751 -25.443 1.00 67.75 125 A 1 ATOM 1016 N NH1 . ARG A 1 125 ? -25.920 11.941 -25.926 1.00 60.45 125 A 1 ATOM 1017 N NH2 . ARG A 1 125 ? -25.347 9.794 -25.860 1.00 60.02 125 A 1 ATOM 1018 N N . VAL A 1 126 ? -26.157 9.395 -19.538 1.00 97.94 126 A 1 ATOM 1019 C CA . VAL A 1 126 ? -26.509 8.079 -18.975 1.00 97.72 126 A 1 ATOM 1020 C C . VAL A 1 126 ? -26.641 8.124 -17.452 1.00 97.87 126 A 1 ATOM 1021 O O . VAL A 1 126 ? -27.516 7.466 -16.897 1.00 97.07 126 A 1 ATOM 1022 C CB . VAL A 1 126 ? -25.483 7.013 -19.415 1.00 96.94 126 A 1 ATOM 1023 C CG1 . VAL A 1 126 ? -25.666 5.665 -18.706 1.00 93.76 126 A 1 ATOM 1024 C CG2 . VAL A 1 126 ? -25.604 6.739 -20.923 1.00 94.43 126 A 1 ATOM 1025 N N . THR A 1 127 ? -25.792 8.889 -16.767 1.00 97.83 127 A 1 ATOM 1026 C CA . THR A 1 127 ? -25.706 8.882 -15.293 1.00 97.85 127 A 1 ATOM 1027 C C . THR A 1 127 ? -26.420 10.051 -14.619 1.00 97.78 127 A 1 ATOM 1028 O O . THR A 1 127 ? -26.623 10.027 -13.407 1.00 96.93 127 A 1 ATOM 1029 C CB . THR A 1 127 ? -24.245 8.868 -14.824 1.00 97.61 127 A 1 ATOM 1030 O OG1 . THR A 1 127 ? -23.587 10.057 -15.200 1.00 96.49 127 A 1 ATOM 1031 C CG2 . THR A 1 127 ? -23.448 7.688 -15.381 1.00 96.47 127 A 1 ATOM 1032 N N . GLY A 1 128 ? -26.760 11.094 -15.367 1.00 97.62 128 A 1 ATOM 1033 C CA . GLY A 1 128 ? -27.236 12.362 -14.807 1.00 97.58 128 A 1 ATOM 1034 C C . GLY A 1 128 ? -26.142 13.202 -14.133 1.00 98.01 128 A 1 ATOM 1035 O O . GLY A 1 128 ? -26.456 14.177 -13.453 1.00 96.99 128 A 1 ATOM 1036 N N . ALA A 1 129 ? -24.863 12.852 -14.312 1.00 98.09 129 A 1 ATOM 1037 C CA . ALA A 1 129 ? -23.752 13.613 -13.753 1.00 98.21 129 A 1 ATOM 1038 C C . ALA A 1 129 ? -23.729 15.059 -14.276 1.00 98.33 129 A 1 ATOM 1039 O O . ALA A 1 129 ? -24.008 15.332 -15.446 1.00 97.95 129 A 1 ATOM 1040 C CB . ALA A 1 129 ? -22.438 12.896 -14.066 1.00 97.79 129 A 1 ATOM 1041 N N . THR A 1 130 ? -23.320 15.983 -13.404 1.00 98.22 130 A 1 ATOM 1042 C CA . THR A 1 130 ? -23.173 17.406 -13.752 1.00 98.19 130 A 1 ATOM 1043 C C . THR A 1 130 ? -21.839 17.693 -14.439 1.00 98.19 130 A 1 ATOM 1044 O O . THR A 1 130 ? -21.760 18.579 -15.295 1.00 97.63 130 A 1 ATOM 1045 C CB . THR A 1 130 ? -23.317 18.290 -12.506 1.00 97.93 130 A 1 ATOM 1046 O OG1 . THR A 1 130 ? -22.315 17.966 -11.570 1.00 96.56 130 A 1 ATOM 1047 C CG2 . THR A 1 130 ? -24.680 18.129 -11.831 1.00 96.15 130 A 1 ATOM 1048 N N . LYS A 1 131 ? -20.799 16.900 -14.110 1.00 98.40 131 A 1 ATOM 1049 C CA . LYS A 1 131 ? -19.443 17.034 -14.647 1.00 98.39 131 A 1 ATOM 1050 C C . LYS A 1 131 ? -18.814 15.665 -14.896 1.00 98.56 131 A 1 ATOM 1051 O O . LYS A 1 131 ? -18.955 14.748 -14.097 1.00 98.27 131 A 1 ATOM 1052 C CB . LYS A 1 131 ? -18.619 17.886 -13.660 1.00 97.87 131 A 1 ATOM 1053 C CG . LYS A 1 131 ? -17.181 18.182 -14.117 1.00 95.37 131 A 1 ATOM 1054 C CD . LYS A 1 131 ? -16.486 19.103 -13.105 1.00 93.15 131 A 1 ATOM 1055 C CE . LYS A 1 131 ? -15.077 19.468 -13.567 1.00 86.22 131 A 1 ATOM 1056 N NZ . LYS A 1 131 ? -14.445 20.447 -12.657 1.00 79.37 131 A 1 ATOM 1057 N N . VAL A 1 132 ? -18.070 15.538 -15.993 1.00 98.48 132 A 1 ATOM 1058 C CA . VAL A 1 132 ? -17.204 14.386 -16.279 1.00 98.55 132 A 1 ATOM 1059 C C . VAL A 1 132 ? -15.815 14.901 -16.631 1.00 98.49 132 A 1 ATOM 1060 O O . VAL A 1 132 ? -15.683 15.808 -17.447 1.00 98.08 132 A 1 ATOM 1061 C CB . VAL A 1 132 ? -17.783 13.499 -17.398 1.00 98.39 132 A 1 ATOM 1062 C CG1 . VAL A 1 132 ? -16.838 12.349 -17.771 1.00 97.72 132 A 1 ATOM 1063 C CG2 . VAL A 1 132 ? -19.123 12.875 -16.972 1.00 97.70 132 A 1 ATOM 1064 N N . HIS A 1 133 ? -14.783 14.312 -16.023 1.00 98.48 133 A 1 ATOM 1065 C CA . HIS A 1 133 ? -13.385 14.578 -16.348 1.00 98.37 133 A 1 ATOM 1066 C C . HIS A 1 133 ? -12.736 13.288 -16.852 1.00 98.46 133 A 1 ATOM 1067 O O . HIS A 1 133 ? -12.597 12.327 -16.096 1.00 98.15 133 A 1 ATOM 1068 C CB . HIS A 1 133 ? -12.667 15.146 -15.116 1.00 98.07 133 A 1 ATOM 1069 C CG . HIS A 1 133 ? -11.206 15.416 -15.359 1.00 96.69 133 A 1 ATOM 1070 N ND1 . HIS A 1 133 ? -10.656 16.622 -15.742 1.00 86.39 133 A 1 ATOM 1071 C CD2 . HIS A 1 133 ? -10.169 14.519 -15.269 1.00 87.36 133 A 1 ATOM 1072 C CE1 . HIS A 1 133 ? -9.331 16.455 -15.873 1.00 88.26 133 A 1 ATOM 1073 N NE2 . HIS A 1 133 ? -9.001 15.187 -15.595 1.00 90.33 133 A 1 ATOM 1074 N N . VAL A 1 134 ? -12.339 13.254 -18.114 1.00 98.43 134 A 1 ATOM 1075 C CA . VAL A 1 134 ? -11.639 12.101 -18.689 1.00 98.43 134 A 1 ATOM 1076 C C . VAL A 1 134 ? -10.180 12.124 -18.235 1.00 98.32 134 A 1 ATOM 1077 O O . VAL A 1 134 ? -9.451 13.069 -18.526 1.00 97.77 134 A 1 ATOM 1078 C CB . VAL A 1 134 ? -11.766 12.063 -20.219 1.00 98.23 134 A 1 ATOM 1079 C CG1 . VAL A 1 134 ? -11.058 10.829 -20.778 1.00 97.49 134 A 1 ATOM 1080 C CG2 . VAL A 1 134 ? -13.234 12.013 -20.663 1.00 97.54 134 A 1 ATOM 1081 N N . ILE A 1 135 ? -9.752 11.070 -17.525 1.00 98.28 135 A 1 ATOM 1082 C CA . ILE A 1 135 ? -8.391 10.929 -16.987 1.00 98.03 135 A 1 ATOM 1083 C C . ILE A 1 135 ? -7.417 10.537 -18.107 1.00 97.71 135 A 1 ATOM 1084 O O . ILE A 1 135 ? -6.351 11.132 -18.273 1.00 96.80 135 A 1 ATOM 1085 C CB . ILE A 1 135 ? -8.381 9.883 -15.844 1.00 97.84 135 A 1 ATOM 1086 C CG1 . ILE A 1 135 ? -9.400 10.237 -14.731 1.00 97.14 135 A 1 ATOM 1087 C CG2 . ILE A 1 135 ? -6.964 9.756 -15.255 1.00 96.73 135 A 1 ATOM 1088 C CD1 . ILE A 1 135 ? -9.594 9.120 -13.695 1.00 96.00 135 A 1 ATOM 1089 N N . GLY A 1 136 ? -7.795 9.534 -18.882 1.00 97.89 136 A 1 ATOM 1090 C CA . GLY A 1 136 ? -6.992 8.955 -19.952 1.00 97.73 136 A 1 ATOM 1091 C C . GLY A 1 136 ? -7.661 7.725 -20.554 1.00 98.19 136 A 1 ATOM 1092 O O . GLY A 1 136 ? -8.759 7.342 -20.150 1.00 97.93 136 A 1 ATOM 1093 N N . HIS A 1 137 ? -6.990 7.104 -21.515 1.00 97.97 137 A 1 ATOM 1094 C CA . HIS A 1 137 ? -7.447 5.874 -22.155 1.00 98.12 137 A 1 ATOM 1095 C C . HIS A 1 137 ? -6.280 4.908 -22.368 1.00 97.96 137 A 1 ATOM 1096 O O . HIS A 1 137 ? -5.115 5.302 -22.319 1.00 97.51 137 A 1 ATOM 1097 C CB . HIS A 1 137 ? -8.168 6.196 -23.476 1.00 98.08 137 A 1 ATOM 1098 C CG . HIS A 1 137 ? -7.242 6.660 -24.566 1.00 98.11 137 A 1 ATOM 1099 N ND1 . HIS A 1 137 ? -6.607 7.884 -24.623 1.00 95.50 137 A 1 ATOM 1100 C CD2 . HIS A 1 137 ? -6.804 5.931 -25.646 1.00 95.22 137 A 1 ATOM 1101 C CE1 . HIS A 1 137 ? -5.809 7.885 -25.704 1.00 95.91 137 A 1 ATOM 1102 N NE2 . HIS A 1 137 ? -5.904 6.720 -26.351 1.00 96.26 137 A 1 ATOM 1103 N N . LEU A 1 138 ? -6.607 3.637 -22.614 1.00 98.03 138 A 1 ATOM 1104 C CA . LEU A 1 138 ? -5.678 2.588 -23.004 1.00 97.99 138 A 1 ATOM 1105 C C . LEU A 1 138 ? -6.228 1.900 -24.257 1.00 98.32 138 A 1 ATOM 1106 O O . LEU A 1 138 ? -7.414 1.579 -24.315 1.00 98.00 138 A 1 ATOM 1107 C CB . LEU A 1 138 ? -5.520 1.622 -21.817 1.00 97.02 138 A 1 ATOM 1108 C CG . LEU A 1 138 ? -4.384 0.601 -21.981 1.00 90.99 138 A 1 ATOM 1109 C CD1 . LEU A 1 138 ? -3.010 1.275 -21.913 1.00 86.07 138 A 1 ATOM 1110 C CD2 . LEU A 1 138 ? -4.450 -0.421 -20.850 1.00 85.78 138 A 1 ATOM 1111 N N . HIS A 1 139 ? -5.373 1.671 -25.253 1.00 98.22 139 A 1 ATOM 1112 C CA . HIS A 1 139 ? -5.715 0.922 -26.461 1.00 98.21 139 A 1 ATOM 1113 C C . HIS A 1 139 ? -5.068 -0.462 -26.409 1.00 98.15 139 A 1 ATOM 1114 O O . HIS A 1 139 ? -3.867 -0.579 -26.170 1.00 97.60 139 A 1 ATOM 1115 C CB . HIS A 1 139 ? -5.281 1.721 -27.696 1.00 97.89 139 A 1 ATOM 1116 C CG . HIS A 1 139 ? -5.541 1.000 -28.993 1.00 96.86 139 A 1 ATOM 1117 N ND1 . HIS A 1 139 ? -6.777 0.670 -29.515 1.00 87.62 139 A 1 ATOM 1118 C CD2 . HIS A 1 139 ? -4.597 0.541 -29.881 1.00 88.18 139 A 1 ATOM 1119 C CE1 . HIS A 1 139 ? -6.575 0.038 -30.686 1.00 89.45 139 A 1 ATOM 1120 N NE2 . HIS A 1 139 ? -5.270 -0.060 -30.939 1.00 91.38 139 A 1 ATOM 1121 N N . ARG A 1 140 ? -5.854 -1.513 -26.629 1.00 98.49 140 A 1 ATOM 1122 C CA . ARG A 1 140 ? -5.409 -2.914 -26.662 1.00 98.46 140 A 1 ATOM 1123 C C . ARG A 1 140 ? -5.658 -3.474 -28.059 1.00 98.44 140 A 1 ATOM 1124 O O . ARG A 1 140 ? -6.801 -3.486 -28.500 1.00 98.00 140 A 1 ATOM 1125 C CB . ARG A 1 140 ? -6.157 -3.750 -25.618 1.00 98.29 140 A 1 ATOM 1126 C CG . ARG A 1 140 ? -6.053 -3.175 -24.199 1.00 97.61 140 A 1 ATOM 1127 C CD . ARG A 1 140 ? -6.830 -4.056 -23.223 1.00 97.33 140 A 1 ATOM 1128 N NE . ARG A 1 140 ? -6.873 -3.443 -21.895 1.00 97.27 140 A 1 ATOM 1129 C CZ . ARG A 1 140 ? -6.053 -3.640 -20.882 1.00 97.61 140 A 1 ATOM 1130 N NH1 . ARG A 1 140 ? -5.088 -4.508 -20.913 1.00 95.64 140 A 1 ATOM 1131 N NH2 . ARG A 1 140 ? -6.208 -2.938 -19.805 1.00 95.90 140 A 1 ATOM 1132 N N . SER A 1 141 ? -4.611 -3.939 -28.719 1.00 98.28 141 A 1 ATOM 1133 C CA . SER A 1 141 ? -4.707 -4.428 -30.104 1.00 98.13 141 A 1 ATOM 1134 C C . SER A 1 141 ? -3.826 -5.639 -30.414 1.00 98.16 141 A 1 ATOM 1135 O O . SER A 1 141 ? -3.806 -6.096 -31.556 1.00 97.15 141 A 1 ATOM 1136 C CB . SER A 1 141 ? -4.393 -3.286 -31.076 1.00 97.35 141 A 1 ATOM 1137 O OG . SER A 1 141 ? -3.081 -2.800 -30.860 1.00 95.15 141 A 1 ATOM 1138 N N . LEU A 1 142 ? -3.090 -6.154 -29.422 1.00 97.97 142 A 1 ATOM 1139 C CA . LEU A 1 142 ? -2.207 -7.303 -29.602 1.00 97.92 142 A 1 ATOM 1140 C C . LEU A 1 142 ? -2.854 -8.586 -29.081 1.00 97.99 142 A 1 ATOM 1141 O O . LEU A 1 142 ? -3.578 -8.574 -28.085 1.00 97.58 142 A 1 ATOM 1142 C CB . LEU A 1 142 ? -0.851 -7.044 -28.935 1.00 97.68 142 A 1 ATOM 1143 C CG . LEU A 1 142 ? -0.110 -5.789 -29.428 1.00 96.67 142 A 1 ATOM 1144 C CD1 . LEU A 1 142 ? 1.246 -5.725 -28.741 1.00 95.12 142 A 1 ATOM 1145 C CD2 . LEU A 1 142 ? 0.118 -5.781 -30.941 1.00 94.67 142 A 1 ATOM 1146 N N . ASN A 1 143 ? -2.537 -9.709 -29.735 1.00 97.34 143 A 1 ATOM 1147 C CA . ASN A 1 143 ? -2.912 -11.027 -29.242 1.00 96.95 143 A 1 ATOM 1148 C C . ASN A 1 143 ? -2.075 -11.380 -28.002 1.00 97.09 143 A 1 ATOM 1149 O O . ASN A 1 143 ? -0.861 -11.176 -27.981 1.00 96.50 143 A 1 ATOM 1150 C CB . ASN A 1 143 ? -2.747 -12.048 -30.375 1.00 95.81 143 A 1 ATOM 1151 C CG . ASN A 1 143 ? -3.168 -13.430 -29.910 1.00 93.15 143 A 1 ATOM 1152 O OD1 . ASN A 1 143 ? -2.414 -14.145 -29.285 1.00 86.37 143 A 1 ATOM 1153 N ND2 . ASN A 1 143 ? -4.403 -13.811 -30.137 1.00 84.96 143 A 1 ATOM 1154 N N . TYR A 1 144 ? -2.730 -11.928 -26.972 1.00 96.95 144 A 1 ATOM 1155 C CA . TYR A 1 144 ? -2.072 -12.272 -25.711 1.00 96.63 144 A 1 ATOM 1156 C C . TYR A 1 144 ? -0.992 -13.342 -25.910 1.00 96.40 144 A 1 ATOM 1157 O O . TYR A 1 144 ? 0.151 -13.141 -25.509 1.00 95.53 144 A 1 ATOM 1158 C CB . TYR A 1 144 ? -3.136 -12.721 -24.700 1.00 96.26 144 A 1 ATOM 1159 C CG . TYR A 1 144 ? -2.603 -13.026 -23.317 1.00 96.17 144 A 1 ATOM 1160 C CD1 . TYR A 1 144 ? -2.004 -14.270 -23.036 1.00 94.90 144 A 1 ATOM 1161 C CD2 . TYR A 1 144 ? -2.704 -12.064 -22.293 1.00 94.94 144 A 1 ATOM 1162 C CE1 . TYR A 1 144 ? -1.486 -14.544 -21.758 1.00 93.95 144 A 1 ATOM 1163 C CE2 . TYR A 1 144 ? -2.197 -12.326 -21.009 1.00 93.81 144 A 1 ATOM 1164 C CZ . TYR A 1 144 ? -1.578 -13.565 -20.750 1.00 93.85 144 A 1 ATOM 1165 O OH . TYR A 1 144 ? -1.052 -13.814 -19.508 1.00 92.35 144 A 1 ATOM 1166 N N . ASN A 1 145 ? -1.342 -14.463 -26.542 1.00 96.50 145 A 1 ATOM 1167 C CA . ASN A 1 145 ? -0.448 -15.612 -26.703 1.00 95.78 145 A 1 ATOM 1168 C C . ASN A 1 145 ? 0.745 -15.281 -27.611 1.00 96.06 145 A 1 ATOM 1169 O O . ASN A 1 145 ? 1.877 -15.589 -27.255 1.00 95.24 145 A 1 ATOM 1170 C CB . ASN A 1 145 ? -1.243 -16.810 -27.244 1.00 94.59 145 A 1 ATOM 1171 C CG . ASN A 1 145 ? -2.302 -17.331 -26.278 1.00 91.93 145 A 1 ATOM 1172 O OD1 . ASN A 1 145 ? -2.282 -17.122 -25.079 1.00 86.43 145 A 1 ATOM 1173 N ND2 . ASN A 1 145 ? -3.282 -18.044 -26.792 1.00 84.58 145 A 1 ATOM 1174 N N . ASP A 1 146 ? 0.503 -14.583 -28.721 1.00 96.44 146 A 1 ATOM 1175 C CA . ASP A 1 146 ? 1.572 -14.173 -29.641 1.00 96.17 146 A 1 ATOM 1176 C C . ASP A 1 146 ? 2.562 -13.231 -28.945 1.00 96.58 146 A 1 ATOM 1177 O O . ASP A 1 146 ? 3.773 -13.386 -29.069 1.00 95.86 146 A 1 ATOM 1178 C CB . ASP A 1 146 ? 0.982 -13.463 -30.873 1.00 95.27 146 A 1 ATOM 1179 C CG . ASP A 1 146 ? 0.053 -14.318 -31.739 1.00 92.20 146 A 1 ATOM 1180 O OD1 . ASP A 1 146 ? 0.044 -15.558 -31.590 1.00 89.90 146 A 1 ATOM 1181 O OD2 . ASP A 1 146 ? -0.680 -13.699 -32.547 1.00 89.52 146 A 1 ATOM 1182 N N . THR A 1 147 ? 2.053 -12.274 -28.161 1.00 96.85 147 A 1 ATOM 1183 C CA . THR A 1 147 ? 2.892 -11.302 -27.443 1.00 96.86 147 A 1 ATOM 1184 C C . THR A 1 147 ? 3.718 -11.978 -26.349 1.00 96.98 147 A 1 ATOM 1185 O O . THR A 1 147 ? 4.913 -11.715 -26.238 1.00 96.44 147 A 1 ATOM 1186 C CB . THR A 1 147 ? 2.047 -10.164 -26.849 1.00 96.65 147 A 1 ATOM 1187 O OG1 . THR A 1 147 ? 1.259 -9.562 -27.855 1.00 94.70 147 A 1 ATOM 1188 C CG2 . THR A 1 147 ? 2.902 -9.054 -26.239 1.00 94.70 147 A 1 ATOM 1189 N N . THR A 1 148 ? 3.119 -12.878 -25.562 1.00 96.75 148 A 1 ATOM 1190 C CA . THR A 1 148 ? 3.853 -13.616 -24.521 1.00 96.12 148 A 1 ATOM 1191 C C . THR A 1 148 ? 4.919 -14.536 -25.106 1.00 96.39 148 A 1 ATOM 1192 O O . THR A 1 148 ? 6.010 -14.627 -24.547 1.00 95.48 148 A 1 ATOM 1193 C CB . THR A 1 148 ? 2.928 -14.452 -23.626 1.00 94.77 148 A 1 ATOM 1194 O OG1 . THR A 1 148 ? 2.073 -15.295 -24.366 1.00 85.61 148 A 1 ATOM 1195 C CG2 . THR A 1 148 ? 2.035 -13.576 -22.754 1.00 84.77 148 A 1 ATOM 1196 N N . GLU A 1 149 ? 4.647 -15.188 -26.237 1.00 96.35 149 A 1 ATOM 1197 C CA . GLU A 1 149 ? 5.604 -16.072 -26.905 1.00 96.14 149 A 1 ATOM 1198 C C . GLU A 1 149 ? 6.782 -15.284 -27.498 1.00 96.42 149 A 1 ATOM 1199 O O . GLU A 1 149 ? 7.936 -15.684 -27.351 1.00 96.02 149 A 1 ATOM 1200 C CB . GLU A 1 149 ? 4.868 -16.894 -27.976 1.00 95.80 149 A 1 ATOM 1201 C CG . GLU A 1 149 ? 5.753 -17.888 -28.756 1.00 89.71 149 A 1 ATOM 1202 C CD . GLU A 1 149 ? 6.478 -18.940 -27.893 1.00 87.66 149 A 1 ATOM 1203 O OE1 . GLU A 1 149 ? 7.480 -19.507 -28.389 1.00 80.58 149 A 1 ATOM 1204 O OE2 . GLU A 1 149 ? 6.092 -19.188 -26.729 1.00 82.93 149 A 1 ATOM 1205 N N . GLU A 1 150 ? 6.504 -14.124 -28.110 1.00 96.93 150 A 1 ATOM 1206 C CA . GLU A 1 150 ? 7.539 -13.261 -28.689 1.00 96.79 150 A 1 ATOM 1207 C C . GLU A 1 150 ? 8.449 -12.647 -27.610 1.00 97.01 150 A 1 ATOM 1208 O O . GLU A 1 150 ? 9.660 -12.546 -27.793 1.00 96.21 150 A 1 ATOM 1209 C CB . GLU A 1 150 ? 6.840 -12.192 -29.544 1.00 96.03 150 A 1 ATOM 1210 C CG . GLU A 1 150 ? 7.816 -11.378 -30.406 1.00 84.55 150 A 1 ATOM 1211 C CD . GLU A 1 150 ? 7.085 -10.378 -31.322 1.00 81.99 150 A 1 ATOM 1212 O OE1 . GLU A 1 150 ? 7.716 -9.846 -32.262 1.00 76.04 150 A 1 ATOM 1213 O OE2 . GLU A 1 150 ? 5.888 -10.093 -31.091 1.00 79.19 150 A 1 ATOM 1214 N N . GLU A 1 151 ? 7.888 -12.297 -26.449 1.00 97.21 151 A 1 ATOM 1215 C CA . GLU A 1 151 ? 8.600 -11.640 -25.342 1.00 97.13 151 A 1 ATOM 1216 C C . GLU A 1 151 ? 9.114 -12.617 -24.260 1.00 97.06 151 A 1 ATOM 1217 O O . GLU A 1 151 ? 9.683 -12.180 -23.259 1.00 95.94 151 A 1 ATOM 1218 C CB . GLU A 1 151 ? 7.714 -10.535 -24.743 1.00 96.91 151 A 1 ATOM 1219 C CG . GLU A 1 151 ? 7.422 -9.398 -25.749 1.00 96.27 151 A 1 ATOM 1220 C CD . GLU A 1 151 ? 6.610 -8.252 -25.137 1.00 96.50 151 A 1 ATOM 1221 O OE1 . GLU A 1 151 ? 6.859 -7.082 -25.503 1.00 92.72 151 A 1 ATOM 1222 O OE2 . GLU A 1 151 ? 5.729 -8.506 -24.282 1.00 93.83 151 A 1 ATOM 1223 N N . LYS A 1 152 ? 8.986 -13.940 -24.445 1.00 96.75 152 A 1 ATOM 1224 C CA . LYS A 1 152 ? 9.283 -14.961 -23.414 1.00 96.32 152 A 1 ATOM 1225 C C . LYS A 1 152 ? 10.696 -14.910 -22.822 1.00 96.47 152 A 1 ATOM 1226 O O . LYS A 1 152 ? 10.906 -15.335 -21.691 1.00 95.65 152 A 1 ATOM 1227 C CB . LYS A 1 152 ? 8.992 -16.358 -23.975 1.00 95.41 152 A 1 ATOM 1228 C CG . LYS A 1 152 ? 9.986 -16.807 -25.061 1.00 92.18 152 A 1 ATOM 1229 C CD . LYS A 1 152 ? 9.512 -18.127 -25.667 1.00 89.65 152 A 1 ATOM 1230 C CE . LYS A 1 152 ? 10.409 -18.540 -26.834 1.00 82.05 152 A 1 ATOM 1231 N NZ . LYS A 1 152 ? 9.836 -19.722 -27.501 1.00 75.03 152 A 1 ATOM 1232 N N . ASN A 1 153 ? 11.665 -14.402 -23.588 1.00 96.83 153 A 1 ATOM 1233 C CA . ASN A 1 153 ? 13.068 -14.298 -23.173 1.00 96.49 153 A 1 ATOM 1234 C C . ASN A 1 153 ? 13.448 -12.903 -22.646 1.00 96.33 153 A 1 ATOM 1235 O O . ASN A 1 153 ? 14.578 -12.717 -22.205 1.00 94.89 153 A 1 ATOM 1236 C CB . ASN A 1 153 ? 13.963 -14.710 -24.351 1.00 96.28 153 A 1 ATOM 1237 C CG . ASN A 1 153 ? 13.780 -16.163 -24.762 1.00 95.13 153 A 1 ATOM 1238 O OD1 . ASN A 1 153 ? 13.660 -17.070 -23.963 1.00 89.45 153 A 1 ATOM 1239 N ND2 . ASN A 1 153 ? 13.770 -16.433 -26.051 1.00 88.77 153 A 1 ATOM 1240 N N . ALA A 1 154 ? 12.550 -11.918 -22.707 1.00 96.40 154 A 1 ATOM 1241 C CA . ALA A 1 154 ? 12.818 -10.579 -22.196 1.00 96.18 154 A 1 ATOM 1242 C C . ALA A 1 154 ? 12.854 -10.576 -20.652 1.00 96.30 154 A 1 ATOM 1243 O O . ALA A 1 154 ? 12.105 -11.323 -20.015 1.00 95.56 154 A 1 ATOM 1244 C CB . ALA A 1 154 ? 11.786 -9.603 -22.761 1.00 95.47 154 A 1 ATOM 1245 N N . PRO A 1 155 ? 13.698 -9.732 -20.018 1.00 96.00 155 A 1 ATOM 1246 C CA . PRO A 1 155 ? 13.668 -9.522 -18.570 1.00 95.77 155 A 1 ATOM 1247 C C . PRO A 1 155 ? 12.313 -8.986 -18.089 1.00 96.40 155 A 1 ATOM 1248 O O . PRO A 1 155 ? 11.640 -8.247 -18.808 1.00 96.20 155 A 1 ATOM 1249 C CB . PRO A 1 155 ? 14.798 -8.531 -18.268 1.00 94.63 155 A 1 ATOM 1250 C CG . PRO A 1 155 ? 15.742 -8.678 -19.461 1.00 93.20 155 A 1 ATOM 1251 C CD . PRO A 1 155 ? 14.790 -8.985 -20.616 1.00 95.03 155 A 1 ATOM 1252 N N . ASP A 1 156 ? 11.944 -9.294 -16.843 1.00 96.48 156 A 1 ATOM 1253 C CA . ASP A 1 156 ? 10.640 -8.940 -16.264 1.00 96.85 156 A 1 ATOM 1254 C C . ASP A 1 156 ? 10.315 -7.440 -16.329 1.00 97.18 156 A 1 ATOM 1255 O O . ASP A 1 156 ? 9.176 -7.068 -16.607 1.00 96.73 156 A 1 ATOM 1256 C CB . ASP A 1 156 ? 10.583 -9.399 -14.797 1.00 96.37 156 A 1 ATOM 1257 C CG . ASP A 1 156 ? 10.400 -10.905 -14.605 1.00 95.46 156 A 1 ATOM 1258 O OD1 . ASP A 1 156 ? 10.153 -11.620 -15.598 1.00 93.29 156 A 1 ATOM 1259 O OD2 . ASP A 1 156 ? 10.493 -11.341 -13.437 1.00 92.63 156 A 1 ATOM 1260 N N . MET A 1 157 ? 11.308 -6.577 -16.114 1.00 96.45 157 A 1 ATOM 1261 C CA . MET A 1 157 ? 11.121 -5.119 -16.103 1.00 96.29 157 A 1 ATOM 1262 C C . MET A 1 157 ? 11.084 -4.481 -17.502 1.00 96.14 157 A 1 ATOM 1263 O O . MET A 1 157 ? 10.903 -3.269 -17.616 1.00 94.80 157 A 1 ATOM 1264 C CB . MET A 1 157 ? 12.198 -4.465 -15.226 1.00 95.74 157 A 1 ATOM 1265 C CG . MET A 1 157 ? 12.208 -4.975 -13.777 1.00 93.73 157 A 1 ATOM 1266 S SD . MET A 1 157 ? 10.602 -5.017 -12.929 1.00 92.36 157 A 1 ATOM 1267 C CE . MET A 1 157 ? 10.144 -3.279 -12.938 1.00 85.47 157 A 1 ATOM 1268 N N . THR A 1 158 ? 11.243 -5.278 -18.567 1.00 96.16 158 A 1 ATOM 1269 C CA . THR A 1 158 ? 11.109 -4.791 -19.948 1.00 96.03 158 A 1 ATOM 1270 C C . THR A 1 158 ? 9.672 -4.343 -20.200 1.00 96.54 158 A 1 ATOM 1271 O O . THR A 1 158 ? 8.733 -5.058 -19.854 1.00 96.15 158 A 1 ATOM 1272 C CB . THR A 1 158 ? 11.498 -5.879 -20.963 1.00 95.03 158 A 1 ATOM 1273 O OG1 . THR A 1 158 ? 12.778 -6.385 -20.665 1.00 90.53 158 A 1 ATOM 1274 C CG2 . THR A 1 158 ? 11.562 -5.368 -22.406 1.00 90.61 158 A 1 ATOM 1275 N N . MET A 1 159 ? 9.488 -3.171 -20.830 1.00 96.72 159 A 1 ATOM 1276 C CA . MET A 1 159 ? 8.163 -2.739 -21.283 1.00 96.74 159 A 1 ATOM 1277 C C . MET A 1 159 ? 7.710 -3.604 -22.464 1.00 96.79 159 A 1 ATOM 1278 O O . MET A 1 159 ? 8.484 -3.828 -23.392 1.00 96.11 159 A 1 ATOM 1279 C CB . MET A 1 159 ? 8.171 -1.254 -21.668 1.00 96.33 159 A 1 ATOM 1280 C CG . MET A 1 159 ? 8.479 -0.317 -20.490 1.00 94.29 159 A 1 ATOM 1281 S SD . MET A 1 159 ? 7.376 -0.423 -19.048 1.00 92.97 159 A 1 ATOM 1282 C CE . MET A 1 159 ? 5.800 0.073 -19.770 1.00 86.35 159 A 1 ATOM 1283 N N . THR A 1 160 ? 6.457 -4.050 -22.438 1.00 97.37 160 A 1 ATOM 1284 C CA . THR A 1 160 ? 5.869 -4.805 -23.548 1.00 97.36 160 A 1 ATOM 1285 C C . THR A 1 160 ? 5.749 -3.928 -24.795 1.00 97.31 160 A 1 ATOM 1286 O O . THR A 1 160 ? 5.576 -2.706 -24.700 1.00 96.36 160 A 1 ATOM 1287 C CB . THR A 1 160 ? 4.487 -5.382 -23.196 1.00 96.61 160 A 1 ATOM 1288 O OG1 . THR A 1 160 ? 3.552 -4.363 -22.945 1.00 90.79 160 A 1 ATOM 1289 C CG2 . THR A 1 160 ? 4.513 -6.281 -21.963 1.00 90.69 160 A 1 ATOM 1290 N N . LYS A 1 161 ? 5.756 -4.543 -25.978 1.00 96.77 161 A 1 ATOM 1291 C CA . LYS A 1 161 ? 5.609 -3.838 -27.267 1.00 96.26 161 A 1 ATOM 1292 C C . LYS A 1 161 ? 4.244 -3.153 -27.459 1.00 96.32 161 A 1 ATOM 1293 O O . LYS A 1 161 ? 4.075 -2.346 -28.364 1.00 94.56 161 A 1 ATOM 1294 C CB . LYS A 1 161 ? 5.920 -4.809 -28.422 1.00 94.72 161 A 1 ATOM 1295 C CG . LYS A 1 161 ? 4.854 -5.909 -28.594 1.00 89.24 161 A 1 ATOM 1296 C CD . LYS A 1 161 ? 5.135 -6.782 -29.822 1.00 86.75 161 A 1 ATOM 1297 C CE . LYS A 1 161 ? 3.946 -7.732 -30.038 1.00 78.98 161 A 1 ATOM 1298 N NZ . LYS A 1 161 ? 4.021 -8.432 -31.330 1.00 72.02 161 A 1 ATOM 1299 N N . GLY A 1 162 ? 3.247 -3.504 -26.644 1.00 96.72 162 A 1 ATOM 1300 C CA . GLY A 1 162 ? 1.880 -2.995 -26.711 1.00 96.56 162 A 1 ATOM 1301 C C . GLY A 1 162 ? 0.954 -3.713 -25.733 1.00 97.15 162 A 1 ATOM 1302 O O . GLY A 1 162 ? 1.390 -4.545 -24.939 1.00 95.94 162 A 1 ATOM 1303 N N . GLN A 1 163 ? -0.331 -3.375 -25.776 1.00 97.56 163 A 1 ATOM 1304 C CA . GLN A 1 163 ? -1.291 -3.874 -24.799 1.00 97.63 163 A 1 ATOM 1305 C C . GLN A 1 163 ? -2.127 -5.039 -25.339 1.00 98.03 163 A 1 ATOM 1306 O O . GLN A 1 163 ? -2.702 -4.967 -26.428 1.00 97.54 163 A 1 ATOM 1307 C CB . GLN A 1 163 ? -2.172 -2.730 -24.278 1.00 96.92 163 A 1 ATOM 1308 C CG . GLN A 1 163 ? -1.364 -1.579 -23.649 1.00 93.89 163 A 1 ATOM 1309 C CD . GLN A 1 163 ? -0.466 -2.049 -22.508 1.00 89.76 163 A 1 ATOM 1310 O OE1 . GLN A 1 163 ? -0.894 -2.763 -21.621 1.00 80.31 163 A 1 ATOM 1311 N NE2 . GLN A 1 163 ? 0.798 -1.687 -22.506 1.00 76.39 163 A 1 ATOM 1312 N N . THR A 1 164 ? -2.227 -6.085 -24.530 1.00 97.77 164 A 1 ATOM 1313 C CA . THR A 1 164 ? -3.059 -7.274 -24.750 1.00 97.91 164 A 1 ATOM 1314 C C . THR A 1 164 ? -4.318 -7.229 -23.865 1.00 98.10 164 A 1 ATOM 1315 O O . THR A 1 164 ? -4.418 -6.370 -22.979 1.00 97.74 164 A 1 ATOM 1316 C CB . THR A 1 164 ? -2.247 -8.547 -24.473 1.00 97.42 164 A 1 ATOM 1317 O OG1 . THR A 1 164 ? -1.849 -8.597 -23.122 1.00 96.15 164 A 1 ATOM 1318 C CG2 . THR A 1 164 ? -0.989 -8.641 -25.339 1.00 95.92 164 A 1 ATOM 1319 N N . PRO A 1 165 ? -5.298 -8.131 -24.060 1.00 98.16 165 A 1 ATOM 1320 C CA . PRO A 1 165 ? -6.404 -8.291 -23.118 1.00 98.13 165 A 1 ATOM 1321 C C . PRO A 1 165 ? -5.921 -8.566 -21.683 1.00 97.97 165 A 1 ATOM 1322 O O . PRO A 1 165 ? -4.970 -9.308 -21.465 1.00 97.32 165 A 1 ATOM 1323 C CB . PRO A 1 165 ? -7.247 -9.438 -23.675 1.00 97.85 165 A 1 ATOM 1324 C CG . PRO A 1 165 ? -6.964 -9.367 -25.177 1.00 97.03 165 A 1 ATOM 1325 C CD . PRO A 1 165 ? -5.489 -8.990 -25.219 1.00 98.01 165 A 1 ATOM 1326 N N . GLY A 1 166 ? -6.589 -7.969 -20.683 1.00 97.91 166 A 1 ATOM 1327 C CA . GLY A 1 166 ? -6.274 -8.166 -19.264 1.00 97.82 166 A 1 ATOM 1328 C C . GLY A 1 166 ? -6.868 -9.476 -18.739 1.00 97.94 166 A 1 ATOM 1329 O O . GLY A 1 166 ? -8.039 -9.502 -18.373 1.00 97.19 166 A 1 ATOM 1330 N N . ARG A 1 167 ? -6.076 -10.552 -18.702 1.00 97.81 167 A 1 ATOM 1331 C CA . ARG A 1 167 ? -6.511 -11.895 -18.271 1.00 97.49 167 A 1 ATOM 1332 C C . ARG A 1 167 ? -6.353 -12.134 -16.763 1.00 97.52 167 A 1 ATOM 1333 O O . ARG A 1 167 ? -5.776 -13.136 -16.343 1.00 96.18 167 A 1 ATOM 1334 C CB . ARG A 1 167 ? -5.804 -12.983 -19.091 1.00 96.51 167 A 1 ATOM 1335 C CG . ARG A 1 167 ? -6.182 -13.017 -20.580 1.00 94.19 167 A 1 ATOM 1336 C CD . ARG A 1 167 ? -5.641 -14.328 -21.157 1.00 92.11 167 A 1 ATOM 1337 N NE . ARG A 1 167 ? -5.830 -14.478 -22.605 1.00 90.80 167 A 1 ATOM 1338 C CZ . ARG A 1 167 ? -5.367 -15.481 -23.330 1.00 89.51 167 A 1 ATOM 1339 N NH1 . ARG A 1 167 ? -4.709 -16.472 -22.806 1.00 85.88 167 A 1 ATOM 1340 N NH2 . ARG A 1 167 ? -5.549 -15.518 -24.609 1.00 84.74 167 A 1 ATOM 1341 N N . PHE A 1 168 ? -6.849 -11.230 -15.927 1.00 98.01 168 A 1 ATOM 1342 C CA . PHE A 1 168 ? -6.909 -11.414 -14.476 1.00 98.08 168 A 1 ATOM 1343 C C . PHE A 1 168 ? -8.101 -10.655 -13.888 1.00 98.45 168 A 1 ATOM 1344 O O . PHE A 1 168 ? -8.462 -9.576 -14.364 1.00 98.21 168 A 1 ATOM 1345 C CB . PHE A 1 168 ? -5.588 -11.003 -13.808 1.00 97.19 168 A 1 ATOM 1346 C CG . PHE A 1 168 ? -5.160 -9.576 -14.064 1.00 94.55 168 A 1 ATOM 1347 C CD1 . PHE A 1 168 ? -4.391 -9.266 -15.202 1.00 90.21 168 A 1 ATOM 1348 C CD2 . PHE A 1 168 ? -5.495 -8.559 -13.154 1.00 89.45 168 A 1 ATOM 1349 C CE1 . PHE A 1 168 ? -3.959 -7.949 -15.428 1.00 85.05 168 A 1 ATOM 1350 C CE2 . PHE A 1 168 ? -5.065 -7.238 -13.376 1.00 85.69 168 A 1 ATOM 1351 C CZ . PHE A 1 168 ? -4.294 -6.936 -14.514 1.00 82.75 168 A 1 ATOM 1352 N N . VAL A 1 169 ? -8.706 -11.227 -12.849 1.00 98.39 169 A 1 ATOM 1353 C CA . VAL A 1 169 ? -9.853 -10.627 -12.163 1.00 98.57 169 A 1 ATOM 1354 C C . VAL A 1 169 ? -9.368 -9.486 -11.274 1.00 98.57 169 A 1 ATOM 1355 O O . VAL A 1 169 ? -8.530 -9.692 -10.397 1.00 98.36 169 A 1 ATOM 1356 C CB . VAL A 1 169 ? -10.625 -11.669 -11.345 1.00 98.53 169 A 1 ATOM 1357 C CG1 . VAL A 1 169 ? -11.857 -11.049 -10.688 1.00 98.14 169 A 1 ATOM 1358 C CG2 . VAL A 1 169 ? -11.096 -12.833 -12.229 1.00 98.02 169 A 1 ATOM 1359 N N . HIS A 1 170 ? -9.917 -8.292 -11.482 1.00 98.62 170 A 1 ATOM 1360 C CA . HIS A 1 170 ? -9.521 -7.106 -10.730 1.00 98.65 170 A 1 ATOM 1361 C C . HIS A 1 170 ? -10.614 -6.031 -10.714 1.00 98.68 170 A 1 ATOM 1362 O O . HIS A 1 170 ? -11.528 -6.032 -11.533 1.00 98.60 170 A 1 ATOM 1363 C CB . HIS A 1 170 ? -8.218 -6.537 -11.312 1.00 98.58 170 A 1 ATOM 1364 C CG . HIS A 1 170 ? -8.346 -5.979 -12.706 1.00 98.58 170 A 1 ATOM 1365 N ND1 . HIS A 1 170 ? -8.521 -6.716 -13.861 1.00 98.20 170 A 1 ATOM 1366 C CD2 . HIS A 1 170 ? -8.326 -4.659 -13.074 1.00 98.08 170 A 1 ATOM 1367 C CE1 . HIS A 1 170 ? -8.597 -5.860 -14.885 1.00 97.98 170 A 1 ATOM 1368 N NE2 . HIS A 1 170 ? -8.484 -4.601 -14.448 1.00 98.02 170 A 1 ATOM 1369 N N . VAL A 1 171 ? -10.476 -5.095 -9.775 1.00 98.47 171 A 1 ATOM 1370 C CA . VAL A 1 171 ? -11.099 -3.765 -9.815 1.00 98.45 171 A 1 ATOM 1371 C C . VAL A 1 171 ? -9.966 -2.754 -9.957 1.00 98.38 171 A 1 ATOM 1372 O O . VAL A 1 171 ? -9.024 -2.792 -9.172 1.00 98.21 171 A 1 ATOM 1373 C CB . VAL A 1 171 ? -11.918 -3.472 -8.548 1.00 98.37 171 A 1 ATOM 1374 C CG1 . VAL A 1 171 ? -12.660 -2.138 -8.659 1.00 98.05 171 A 1 ATOM 1375 C CG2 . VAL A 1 171 ? -12.959 -4.560 -8.252 1.00 98.04 171 A 1 ATOM 1376 N N . ASP A 1 172 ? -10.053 -1.845 -10.925 1.00 98.64 172 A 1 ATOM 1377 C CA . ASP A 1 172 ? -8.978 -0.888 -11.237 1.00 98.48 172 A 1 ATOM 1378 C C . ASP A 1 172 ? -8.572 0.021 -10.062 1.00 98.39 172 A 1 ATOM 1379 O O . ASP A 1 172 ? -7.469 0.560 -10.057 1.00 97.68 172 A 1 ATOM 1380 C CB . ASP A 1 172 ? -9.417 0.024 -12.385 1.00 98.20 172 A 1 ATOM 1381 C CG . ASP A 1 172 ? -9.396 -0.597 -13.777 1.00 97.68 172 A 1 ATOM 1382 O OD1 . ASP A 1 172 ? -9.550 -1.821 -13.922 1.00 95.97 172 A 1 ATOM 1383 O OD2 . ASP A 1 172 ? -9.254 0.210 -14.730 1.00 94.80 172 A 1 ATOM 1384 N N . GLN A 1 173 ? -9.473 0.219 -9.091 1.00 97.95 173 A 1 ATOM 1385 C CA . GLN A 1 173 ? -9.253 1.083 -7.937 1.00 97.65 173 A 1 ATOM 1386 C C . GLN A 1 173 ? -9.774 0.432 -6.653 1.00 98.02 173 A 1 ATOM 1387 O O . GLN A 1 173 ? -10.933 0.019 -6.594 1.00 97.41 173 A 1 ATOM 1388 C CB . GLN A 1 173 ? -9.977 2.427 -8.141 1.00 95.94 173 A 1 ATOM 1389 C CG . GLN A 1 173 ? -9.616 3.197 -9.426 1.00 90.43 173 A 1 ATOM 1390 C CD . GLN A 1 173 ? -8.178 3.683 -9.493 1.00 89.25 173 A 1 ATOM 1391 O OE1 . GLN A 1 173 ? -7.433 3.666 -8.543 1.00 82.16 173 A 1 ATOM 1392 N NE2 . GLN A 1 173 ? -7.743 4.148 -10.643 1.00 78.62 173 A 1 ATOM 1393 N N . SER A 1 174 ? -8.963 0.426 -5.599 1.00 97.97 174 A 1 ATOM 1394 C CA . SER A 1 174 ? -9.482 0.359 -4.234 1.00 97.86 174 A 1 ATOM 1395 C C . SER A 1 174 ? -10.187 1.679 -3.879 1.00 97.73 174 A 1 ATOM 1396 O O . SER A 1 174 ? -10.076 2.671 -4.608 1.00 97.41 174 A 1 ATOM 1397 C CB . SER A 1 174 ? -8.354 0.047 -3.242 1.00 97.67 174 A 1 ATOM 1398 O OG . SER A 1 174 ? -7.533 1.179 -3.049 1.00 97.30 174 A 1 ATOM 1399 N N . TYR A 1 175 ? -10.899 1.734 -2.755 1.00 97.71 175 A 1 ATOM 1400 C CA . TYR A 1 175 ? -11.516 2.996 -2.316 1.00 97.39 175 A 1 ATOM 1401 C C . TYR A 1 175 ? -10.460 4.067 -2.004 1.00 97.38 175 A 1 ATOM 1402 O O . TYR A 1 175 ? -10.597 5.207 -2.446 1.00 97.07 175 A 1 ATOM 1403 C CB . TYR A 1 175 ? -12.443 2.749 -1.121 1.00 96.93 175 A 1 ATOM 1404 C CG . TYR A 1 175 ? -13.625 1.821 -1.370 1.00 96.69 175 A 1 ATOM 1405 C CD1 . TYR A 1 175 ? -14.203 1.693 -2.650 1.00 95.05 175 A 1 ATOM 1406 C CD2 . TYR A 1 175 ? -14.166 1.080 -0.301 1.00 94.92 175 A 1 ATOM 1407 C CE1 . TYR A 1 175 ? -15.293 0.828 -2.869 1.00 94.31 175 A 1 ATOM 1408 C CE2 . TYR A 1 175 ? -15.255 0.215 -0.508 1.00 94.08 175 A 1 ATOM 1409 C CZ . TYR A 1 175 ? -15.813 0.087 -1.797 1.00 94.91 175 A 1 ATOM 1410 O OH . TYR A 1 175 ? -16.860 -0.767 -2.014 1.00 93.04 175 A 1 ATOM 1411 N N . GLN A 1 176 ? -9.367 3.686 -1.334 1.00 97.21 176 A 1 ATOM 1412 C CA . GLN A 1 176 ? -8.223 4.571 -1.108 1.00 97.15 176 A 1 ATOM 1413 C C . GLN A 1 176 ? -7.561 4.981 -2.436 1.00 97.47 176 A 1 ATOM 1414 O O . GLN A 1 176 ? -7.282 6.157 -2.658 1.00 97.37 176 A 1 ATOM 1415 C CB . GLN A 1 176 ? -7.233 3.859 -0.176 1.00 96.72 176 A 1 ATOM 1416 C CG . GLN A 1 176 ? -6.009 4.732 0.160 1.00 93.47 176 A 1 ATOM 1417 C CD . GLN A 1 176 ? -5.005 4.025 1.069 1.00 91.56 176 A 1 ATOM 1418 O OE1 . GLN A 1 176 ? -5.213 2.927 1.549 1.00 85.26 176 A 1 ATOM 1419 N NE2 . GLN A 1 176 ? -3.874 4.633 1.324 1.00 82.72 176 A 1 ATOM 1420 N N . GLY A 1 177 ? -7.368 4.025 -3.350 1.00 97.64 177 A 1 ATOM 1421 C CA . GLY A 1 177 ? -6.797 4.284 -4.673 1.00 97.70 177 A 1 ATOM 1422 C C . GLY A 1 177 ? -7.642 5.241 -5.519 1.00 97.82 177 A 1 ATOM 1423 O O . GLY A 1 177 ? -7.094 6.078 -6.234 1.00 97.64 177 A 1 ATOM 1424 N N . ALA A 1 178 ? -8.970 5.172 -5.410 1.00 97.88 178 A 1 ATOM 1425 C CA . ALA A 1 178 ? -9.867 6.117 -6.070 1.00 97.88 178 A 1 ATOM 1426 C C . ALA A 1 178 ? -9.654 7.552 -5.557 1.00 97.84 178 A 1 ATOM 1427 O O . ALA A 1 178 ? -9.448 8.468 -6.358 1.00 97.76 178 A 1 ATOM 1428 C CB . ALA A 1 178 ? -11.313 5.649 -5.874 1.00 97.86 178 A 1 ATOM 1429 N N . VAL A 1 179 ? -9.624 7.741 -4.237 1.00 97.74 179 A 1 ATOM 1430 C CA . VAL A 1 179 ? -9.328 9.044 -3.614 1.00 97.65 179 A 1 ATOM 1431 C C . VAL A 1 179 ? -7.936 9.526 -4.025 1.00 97.76 179 A 1 ATOM 1432 O O . VAL A 1 179 ? -7.782 10.674 -4.439 1.00 97.55 179 A 1 ATOM 1433 C CB . VAL A 1 179 ? -9.472 8.972 -2.083 1.00 97.20 179 A 1 ATOM 1434 C CG1 . VAL A 1 179 ? -9.082 10.294 -1.417 1.00 96.07 179 A 1 ATOM 1435 C CG2 . VAL A 1 179 ? -10.923 8.667 -1.683 1.00 96.14 179 A 1 ATOM 1436 N N . ARG A 1 180 ? -6.931 8.642 -4.009 1.00 97.84 180 A 1 ATOM 1437 C CA . ARG A 1 180 ? -5.569 8.971 -4.453 1.00 97.80 180 A 1 ATOM 1438 C C . ARG A 1 180 ? -5.553 9.500 -5.887 1.00 97.86 180 A 1 ATOM 1439 O O . ARG A 1 180 ? -4.928 10.527 -6.140 1.00 97.50 180 A 1 ATOM 1440 C CB . ARG A 1 180 ? -4.672 7.737 -4.272 1.00 97.49 180 A 1 ATOM 1441 C CG . ARG A 1 180 ? -3.190 7.983 -4.603 1.00 95.17 180 A 1 ATOM 1442 C CD . ARG A 1 180 ? -2.563 9.049 -3.701 1.00 93.55 180 A 1 ATOM 1443 N NE . ARG A 1 180 ? -1.111 9.132 -3.922 1.00 92.28 180 A 1 ATOM 1444 C CZ . ARG A 1 180 ? -0.312 10.093 -3.514 1.00 91.44 180 A 1 ATOM 1445 N NH1 . ARG A 1 180 ? -0.754 11.131 -2.850 1.00 86.20 180 A 1 ATOM 1446 N NH2 . ARG A 1 180 ? 0.957 10.022 -3.776 1.00 87.23 180 A 1 ATOM 1447 N N . ARG A 1 181 ? -6.275 8.857 -6.822 1.00 98.08 181 A 1 ATOM 1448 C CA . ARG A 1 181 ? -6.417 9.340 -8.208 1.00 97.97 181 A 1 ATOM 1449 C C . ARG A 1 181 ? -7.063 10.723 -8.280 1.00 97.98 181 A 1 ATOM 1450 O O . ARG A 1 181 ? -6.604 11.546 -9.057 1.00 97.63 181 A 1 ATOM 1451 C CB . ARG A 1 181 ? -7.229 8.371 -9.083 1.00 97.65 181 A 1 ATOM 1452 C CG . ARG A 1 181 ? -6.534 7.076 -9.503 1.00 92.88 181 A 1 ATOM 1453 C CD . ARG A 1 181 ? -5.070 7.163 -9.869 1.00 92.22 181 A 1 ATOM 1454 N NE . ARG A 1 181 ? -4.744 8.204 -10.850 1.00 89.95 181 A 1 ATOM 1455 C CZ . ARG A 1 181 ? -3.514 8.554 -11.176 1.00 89.77 181 A 1 ATOM 1456 N NH1 . ARG A 1 181 ? -2.470 7.966 -10.668 1.00 81.96 181 A 1 ATOM 1457 N NH2 . ARG A 1 181 ? -3.292 9.498 -12.021 1.00 82.11 181 A 1 ATOM 1458 N N . LEU A 1 182 ? -8.092 10.983 -7.469 1.00 98.03 182 A 1 ATOM 1459 C CA . LEU A 1 182 ? -8.768 12.283 -7.447 1.00 98.07 182 A 1 ATOM 1460 C C . LEU A 1 182 ? -7.786 13.418 -7.122 1.00 98.08 182 A 1 ATOM 1461 O O . LEU A 1 182 ? -7.771 14.431 -7.815 1.00 97.80 182 A 1 ATOM 1462 C CB . LEU A 1 182 ? -9.936 12.221 -6.443 1.00 97.98 182 A 1 ATOM 1463 C CG . LEU A 1 182 ? -10.833 13.473 -6.443 1.00 97.19 182 A 1 ATOM 1464 C CD1 . LEU A 1 182 ? -11.669 13.566 -7.716 1.00 96.55 182 A 1 ATOM 1465 C CD2 . LEU A 1 182 ? -11.784 13.434 -5.249 1.00 96.36 182 A 1 ATOM 1466 N N . TYR A 1 183 ? -6.932 13.216 -6.109 1.00 97.99 183 A 1 ATOM 1467 C CA . TYR A 1 183 ? -5.954 14.224 -5.675 1.00 97.67 183 A 1 ATOM 1468 C C . TYR A 1 183 ? -4.685 14.279 -6.542 1.00 97.44 183 A 1 ATOM 1469 O O . TYR A 1 183 ? -3.998 15.299 -6.540 1.00 96.57 183 A 1 ATOM 1470 C CB . TYR A 1 183 ? -5.614 13.994 -4.202 1.00 97.33 183 A 1 ATOM 1471 C CG . TYR A 1 183 ? -6.691 14.506 -3.261 1.00 97.54 183 A 1 ATOM 1472 C CD1 . TYR A 1 183 ? -6.645 15.832 -2.794 1.00 96.95 183 A 1 ATOM 1473 C CD2 . TYR A 1 183 ? -7.763 13.681 -2.877 1.00 97.04 183 A 1 ATOM 1474 C CE1 . TYR A 1 183 ? -7.649 16.329 -1.942 1.00 96.70 183 A 1 ATOM 1475 C CE2 . TYR A 1 183 ? -8.776 14.167 -2.029 1.00 96.79 183 A 1 ATOM 1476 C CZ . TYR A 1 183 ? -8.712 15.492 -1.562 1.00 96.99 183 A 1 ATOM 1477 O OH . TYR A 1 183 ? -9.695 15.968 -0.736 1.00 96.24 183 A 1 ATOM 1478 N N . LEU A 1 184 ? -4.357 13.212 -7.281 1.00 97.97 184 A 1 ATOM 1479 C CA . LEU A 1 184 ? -3.226 13.211 -8.218 1.00 97.57 184 A 1 ATOM 1480 C C . LEU A 1 184 ? -3.579 13.825 -9.577 1.00 97.45 184 A 1 ATOM 1481 O O . LEU A 1 184 ? -2.728 14.462 -10.190 1.00 96.61 184 A 1 ATOM 1482 C CB . LEU A 1 184 ? -2.697 11.782 -8.402 1.00 97.24 184 A 1 ATOM 1483 C CG . LEU A 1 184 ? -1.917 11.210 -7.203 1.00 96.54 184 A 1 ATOM 1484 C CD1 . LEU A 1 184 ? -1.524 9.765 -7.517 1.00 95.43 184 A 1 ATOM 1485 C CD2 . LEU A 1 184 ? -0.644 11.996 -6.901 1.00 95.00 184 A 1 ATOM 1486 N N . ASP A 1 185 ? -4.807 13.620 -10.059 1.00 97.72 185 A 1 ATOM 1487 C CA . ASP A 1 185 ? -5.203 14.018 -11.415 1.00 97.48 185 A 1 ATOM 1488 C C . ASP A 1 185 ? -5.895 15.382 -11.474 1.00 97.64 185 A 1 ATOM 1489 O O . ASP A 1 185 ? -5.976 15.981 -12.549 1.00 96.52 185 A 1 ATOM 1490 C CB . ASP A 1 185 ? -6.089 12.933 -12.039 1.00 96.91 185 A 1 ATOM 1491 C CG . ASP A 1 185 ? -5.349 11.622 -12.292 1.00 94.42 185 A 1 ATOM 1492 O OD1 . ASP A 1 185 ? -4.117 11.636 -12.511 1.00 88.46 185 A 1 ATOM 1493 O OD2 . ASP A 1 185 ? -5.987 10.549 -12.302 1.00 88.02 185 A 1 ATOM 1494 N N . LEU A 1 186 ? -6.394 15.893 -10.344 1.00 98.05 186 A 1 ATOM 1495 C CA . LEU A 1 186 ? -7.020 17.209 -10.247 1.00 98.13 186 A 1 ATOM 1496 C C . LEU A 1 186 ? -6.195 18.159 -9.367 1.00 98.16 186 A 1 ATOM 1497 O O . LEU A 1 186 ? -5.501 17.716 -8.456 1.00 97.61 186 A 1 ATOM 1498 C CB . LEU A 1 186 ? -8.459 17.075 -9.723 1.00 97.97 186 A 1 ATOM 1499 C CG . LEU A 1 186 ? -9.398 16.210 -10.583 1.00 96.75 186 A 1 ATOM 1500 C CD1 . LEU A 1 186 ? -10.787 16.221 -9.960 1.00 94.31 186 A 1 ATOM 1501 C CD2 . LEU A 1 186 ? -9.524 16.725 -12.017 1.00 93.58 186 A 1 ATOM 1502 N N . PRO A 1 187 ? -6.311 19.488 -9.569 1.00 97.89 187 A 1 ATOM 1503 C CA . PRO A 1 187 ? -5.788 20.464 -8.620 1.00 97.76 187 A 1 ATOM 1504 C C . PRO A 1 187 ? -6.370 20.228 -7.221 1.00 97.91 187 A 1 ATOM 1505 O O . PRO A 1 187 ? -7.560 19.954 -7.085 1.00 97.63 187 A 1 ATOM 1506 C CB . PRO A 1 187 ? -6.185 21.837 -9.172 1.00 97.37 187 A 1 ATOM 1507 C CG . PRO A 1 187 ? -6.403 21.582 -10.662 1.00 96.38 187 A 1 ATOM 1508 C CD . PRO A 1 187 ? -6.950 20.158 -10.687 1.00 97.72 187 A 1 ATOM 1509 N N . GLN A 1 188 ? -5.552 20.392 -6.166 1.00 97.42 188 A 1 ATOM 1510 C CA . GLN A 1 188 ? -5.930 20.070 -4.782 1.00 97.20 188 A 1 ATOM 1511 C C . GLN A 1 188 ? -7.244 20.730 -4.334 1.00 97.48 188 A 1 ATOM 1512 O O . GLN A 1 188 ? -8.086 20.073 -3.723 1.00 97.07 188 A 1 ATOM 1513 C CB . GLN A 1 188 ? -4.775 20.481 -3.855 1.00 96.18 188 A 1 ATOM 1514 C CG . GLN A 1 188 ? -5.008 20.071 -2.392 1.00 91.27 188 A 1 ATOM 1515 C CD . GLN A 1 188 ? -3.912 20.621 -1.477 1.00 88.36 188 A 1 ATOM 1516 O OE1 . GLN A 1 188 ? -3.764 21.822 -1.326 1.00 81.11 188 A 1 ATOM 1517 N NE2 . GLN A 1 188 ? -3.132 19.776 -0.844 1.00 77.21 188 A 1 ATOM 1518 N N . GLU A 1 189 ? -7.453 22.015 -4.634 1.00 97.45 189 A 1 ATOM 1519 C CA . GLU A 1 189 ? -8.702 22.709 -4.284 1.00 97.35 189 A 1 ATOM 1520 C C . GLU A 1 189 ? -9.920 22.105 -4.987 1.00 97.64 189 A 1 ATOM 1521 O O . GLU A 1 189 ? -10.975 21.953 -4.377 1.00 97.13 189 A 1 ATOM 1522 C CB . GLU A 1 189 ? -8.622 24.198 -4.650 1.00 96.86 189 A 1 ATOM 1523 C CG . GLU A 1 189 ? -7.970 25.039 -3.547 1.00 84.93 189 A 1 ATOM 1524 C CD . GLU A 1 189 ? -8.087 26.547 -3.815 1.00 71.76 189 A 1 ATOM 1525 O OE1 . GLU A 1 189 ? -8.095 27.311 -2.821 1.00 65.61 189 A 1 ATOM 1526 O OE2 . GLU A 1 189 ? -8.174 26.929 -5.004 1.00 67.06 189 A 1 ATOM 1527 N N . GLU A 1 190 ? -9.774 21.725 -6.248 1.00 97.84 190 A 1 ATOM 1528 C CA . GLU A 1 190 ? -10.849 21.124 -7.026 1.00 97.82 190 A 1 ATOM 1529 C C . GLU A 1 190 ? -11.162 19.699 -6.538 1.00 98.09 190 A 1 ATOM 1530 O O . GLU A 1 190 ? -12.329 19.359 -6.373 1.00 97.70 190 A 1 ATOM 1531 C CB . GLU A 1 190 ? -10.474 21.172 -8.516 1.00 97.10 190 A 1 ATOM 1532 C CG . GLU A 1 190 ? -11.570 20.708 -9.476 1.00 85.47 190 A 1 ATOM 1533 C CD . GLU A 1 190 ? -12.826 21.595 -9.539 1.00 81.98 190 A 1 ATOM 1534 O OE1 . GLU A 1 190 ? -13.655 21.355 -10.448 1.00 75.15 190 A 1 ATOM 1535 O OE2 . GLU A 1 190 ? -13.029 22.492 -8.692 1.00 77.40 190 A 1 ATOM 1536 N N . ALA A 1 191 ? -10.130 18.908 -6.209 1.00 97.76 191 A 1 ATOM 1537 C CA . ALA A 1 191 ? -10.290 17.601 -5.578 1.00 97.79 191 A 1 ATOM 1538 C C . ALA A 1 191 ? -11.029 17.713 -4.233 1.00 97.67 191 A 1 ATOM 1539 O O . ALA A 1 191 ? -12.034 17.036 -4.029 1.00 97.49 191 A 1 ATOM 1540 C CB . ALA A 1 191 ? -8.911 16.950 -5.426 1.00 97.73 191 A 1 ATOM 1541 N N . ARG A 1 192 ? -10.609 18.632 -3.355 1.00 97.76 192 A 1 ATOM 1542 C CA . ARG A 1 192 ? -11.270 18.896 -2.059 1.00 97.44 192 A 1 ATOM 1543 C C . ARG A 1 192 ? -12.727 19.336 -2.213 1.00 97.43 192 A 1 ATOM 1544 O O . ARG A 1 192 ? -13.548 19.008 -1.360 1.00 96.94 192 A 1 ATOM 1545 C CB . ARG A 1 192 ? -10.509 19.987 -1.288 1.00 96.92 192 A 1 ATOM 1546 C CG . ARG A 1 192 ? -9.209 19.500 -0.626 1.00 91.42 192 A 1 ATOM 1547 C CD . ARG A 1 192 ? -8.504 20.701 0.008 1.00 88.38 192 A 1 ATOM 1548 N NE . ARG A 1 192 ? -7.301 20.339 0.793 1.00 81.96 192 A 1 ATOM 1549 C CZ . ARG A 1 192 ? -6.420 21.204 1.271 1.00 76.73 192 A 1 ATOM 1550 N NH1 . ARG A 1 192 ? -6.506 22.482 1.056 1.00 69.29 192 A 1 ATOM 1551 N NH2 . ARG A 1 192 ? -5.420 20.807 1.993 1.00 71.14 192 A 1 ATOM 1552 N N . ARG A 1 193 ? -13.044 20.099 -3.249 1.00 97.54 193 A 1 ATOM 1553 C CA . ARG A 1 193 ? -14.419 20.512 -3.552 1.00 97.46 193 A 1 ATOM 1554 C C . ARG A 1 193 ? -15.259 19.329 -4.018 1.00 97.64 193 A 1 ATOM 1555 O O . ARG A 1 193 ? -16.347 19.119 -3.497 1.00 97.37 193 A 1 ATOM 1556 C CB . ARG A 1 193 ? -14.399 21.632 -4.605 1.00 96.99 193 A 1 ATOM 1557 C CG . ARG A 1 193 ? -15.805 22.219 -4.849 1.00 93.93 193 A 1 ATOM 1558 C CD . ARG A 1 193 ? -15.803 23.253 -5.977 1.00 92.96 193 A 1 ATOM 1559 N NE . ARG A 1 193 ? -15.602 22.660 -7.308 1.00 91.42 193 A 1 ATOM 1560 C CZ . ARG A 1 193 ? -16.528 22.106 -8.086 1.00 91.09 193 A 1 ATOM 1561 N NH1 . ARG A 1 193 ? -17.773 21.972 -7.723 1.00 84.76 193 A 1 ATOM 1562 N NH2 . ARG A 1 193 ? -16.214 21.692 -9.270 1.00 86.76 193 A 1 ATOM 1563 N N . LEU A 1 194 ? -14.739 18.559 -4.972 1.00 97.78 194 A 1 ATOM 1564 C CA . LEU A 1 194 ? -15.460 17.460 -5.617 1.00 97.80 194 A 1 ATOM 1565 C C . LEU A 1 194 ? -15.582 16.212 -4.731 1.00 97.65 194 A 1 ATOM 1566 O O . LEU A 1 194 ? -16.579 15.506 -4.831 1.00 97.36 194 A 1 ATOM 1567 C CB . LEU A 1 194 ? -14.786 17.140 -6.954 1.00 97.89 194 A 1 ATOM 1568 C CG . LEU A 1 194 ? -14.962 18.236 -8.025 1.00 97.51 194 A 1 ATOM 1569 C CD1 . LEU A 1 194 ? -14.064 17.936 -9.216 1.00 96.89 194 A 1 ATOM 1570 C CD2 . LEU A 1 194 ? -16.404 18.327 -8.527 1.00 96.54 194 A 1 ATOM 1571 N N . GLU A 1 195 ? -14.639 15.966 -3.816 1.00 97.68 195 A 1 ATOM 1572 C CA . GLU A 1 195 ? -14.733 14.874 -2.830 1.00 97.49 195 A 1 ATOM 1573 C C . GLU A 1 195 ? -15.914 15.062 -1.860 1.00 97.34 195 A 1 ATOM 1574 O O . GLU A 1 195 ? -16.412 14.096 -1.288 1.00 96.66 195 A 1 ATOM 1575 C CB . GLU A 1 195 ? -13.403 14.736 -2.066 1.00 97.10 195 A 1 ATOM 1576 C CG . GLU A 1 195 ? -13.337 13.427 -1.250 1.00 96.46 195 A 1 ATOM 1577 C CD . GLU A 1 195 ? -12.037 13.220 -0.452 1.00 96.34 195 A 1 ATOM 1578 O OE1 . GLU A 1 195 ? -11.818 12.086 0.040 1.00 93.61 195 A 1 ATOM 1579 O OE2 . GLU A 1 195 ? -11.242 14.163 -0.269 1.00 94.22 195 A 1 ATOM 1580 N N . LYS A 1 196 ? -16.402 16.292 -1.696 1.00 97.46 196 A 1 ATOM 1581 C CA . LYS A 1 196 ? -17.592 16.599 -0.883 1.00 97.11 196 A 1 ATOM 1582 C C . LYS A 1 196 ? -18.910 16.367 -1.624 1.00 96.99 196 A 1 ATOM 1583 O O . LYS A 1 196 ? -19.969 16.481 -1.012 1.00 95.91 196 A 1 ATOM 1584 C CB . LYS A 1 196 ? -17.533 18.046 -0.383 1.00 96.51 196 A 1 ATOM 1585 C CG . LYS A 1 196 ? -16.327 18.294 0.529 1.00 93.74 196 A 1 ATOM 1586 C CD . LYS A 1 196 ? -16.272 19.777 0.906 1.00 89.42 196 A 1 ATOM 1587 C CE . LYS A 1 196 ? -15.017 20.029 1.740 1.00 82.25 196 A 1 ATOM 1588 N NZ . LYS A 1 196 ? -14.889 21.458 2.097 1.00 72.11 196 A 1 ATOM 1589 N N . THR A 1 197 ? -18.866 16.080 -2.918 1.00 97.43 197 A 1 ATOM 1590 C CA . THR A 1 197 ? -20.035 15.735 -3.734 1.00 97.12 197 A 1 ATOM 1591 C C . THR A 1 197 ? -20.101 14.223 -3.943 1.00 97.18 197 A 1 ATOM 1592 O O . THR A 1 197 ? -19.125 13.509 -3.695 1.00 96.23 197 A 1 ATOM 1593 C CB . THR A 1 197 ? -20.018 16.466 -5.087 1.00 96.25 197 A 1 ATOM 1594 O OG1 . THR A 1 197 ? -19.041 15.961 -5.963 1.00 92.44 197 A 1 ATOM 1595 C CG2 . THR A 1 197 ? -19.772 17.971 -4.946 1.00 91.72 197 A 1 ATOM 1596 N N . ARG A 1 198 ? -21.229 13.695 -4.432 1.00 97.40 198 A 1 ATOM 1597 C CA . ARG A 1 198 ? -21.211 12.334 -4.971 1.00 97.67 198 A 1 ATOM 1598 C C . ARG A 1 198 ? -20.286 12.296 -6.180 1.00 97.97 198 A 1 ATOM 1599 O O . ARG A 1 198 ? -20.410 13.122 -7.082 1.00 97.65 198 A 1 ATOM 1600 C CB . ARG A 1 198 ? -22.613 11.848 -5.331 1.00 97.18 198 A 1 ATOM 1601 C CG . ARG A 1 198 ? -22.582 10.390 -5.850 1.00 96.36 198 A 1 ATOM 1602 C CD . ARG A 1 198 ? -23.955 9.947 -6.357 1.00 94.60 198 A 1 ATOM 1603 N NE . ARG A 1 198 ? -23.901 8.594 -6.939 1.00 94.26 198 A 1 ATOM 1604 C CZ . ARG A 1 198 ? -24.851 7.993 -7.639 1.00 94.66 198 A 1 ATOM 1605 N NH1 . ARG A 1 198 ? -25.987 8.571 -7.896 1.00 91.35 198 A 1 ATOM 1606 N NH2 . ARG A 1 198 ? -24.667 6.787 -8.088 1.00 91.89 198 A 1 ATOM 1607 N N . TRP A 1 199 ? -19.425 11.296 -6.225 1.00 98.01 199 A 1 ATOM 1608 C CA . TRP A 1 199 ? -18.543 11.077 -7.364 1.00 98.13 199 A 1 ATOM 1609 C C . TRP A 1 199 ? -18.257 9.593 -7.589 1.00 98.17 199 A 1 ATOM 1610 O O . TRP A 1 199 ? -18.435 8.761 -6.697 1.00 97.96 199 A 1 ATOM 1611 C CB . TRP A 1 199 ? -17.258 11.890 -7.191 1.00 98.10 199 A 1 ATOM 1612 C CG . TRP A 1 199 ? -16.336 11.428 -6.105 1.00 98.16 199 A 1 ATOM 1613 C CD1 . TRP A 1 199 ? -16.513 11.611 -4.779 1.00 97.78 199 A 1 ATOM 1614 C CD2 . TRP A 1 199 ? -15.073 10.708 -6.252 1.00 98.20 199 A 1 ATOM 1615 N NE1 . TRP A 1 199 ? -15.444 11.062 -4.083 1.00 97.71 199 A 1 ATOM 1616 C CE2 . TRP A 1 199 ? -14.532 10.503 -4.949 1.00 97.97 199 A 1 ATOM 1617 C CE3 . TRP A 1 199 ? -14.338 10.233 -7.359 1.00 97.96 199 A 1 ATOM 1618 C CZ2 . TRP A 1 199 ? -13.296 9.848 -4.753 1.00 97.60 199 A 1 ATOM 1619 C CZ3 . TRP A 1 199 ? -13.111 9.581 -7.163 1.00 97.60 199 A 1 ATOM 1620 C CH2 . TRP A 1 199 ? -12.598 9.392 -5.873 1.00 97.48 199 A 1 ATOM 1621 N N . ALA A 1 200 ? -17.823 9.272 -8.801 1.00 98.33 200 A 1 ATOM 1622 C CA . ALA A 1 200 ? -17.472 7.923 -9.214 1.00 98.38 200 A 1 ATOM 1623 C C . ALA A 1 200 ? -16.265 7.922 -10.161 1.00 98.49 200 A 1 ATOM 1624 O O . ALA A 1 200 ? -15.901 8.944 -10.741 1.00 98.42 200 A 1 ATOM 1625 C CB . ALA A 1 200 ? -18.707 7.276 -9.861 1.00 98.21 200 A 1 ATOM 1626 N N . ILE A 1 201 ? -15.671 6.737 -10.338 1.00 98.58 201 A 1 ATOM 1627 C CA . ILE A 1 201 ? -14.793 6.430 -11.470 1.00 98.63 201 A 1 ATOM 1628 C C . ILE A 1 201 ? -15.518 5.401 -12.332 1.00 98.65 201 A 1 ATOM 1629 O O . ILE A 1 201 ? -15.945 4.360 -11.833 1.00 98.51 201 A 1 ATOM 1630 C CB . ILE A 1 201 ? -13.394 5.950 -11.029 1.00 98.56 201 A 1 ATOM 1631 C CG1 . ILE A 1 201 ? -12.691 7.035 -10.174 1.00 98.20 201 A 1 ATOM 1632 C CG2 . ILE A 1 201 ? -12.537 5.597 -12.269 1.00 98.29 201 A 1 ATOM 1633 C CD1 . ILE A 1 201 ? -11.317 6.629 -9.619 1.00 97.79 201 A 1 ATOM 1634 N N . ILE A 1 202 ? -15.659 5.679 -13.618 1.00 98.65 202 A 1 ATOM 1635 C CA . ILE A 1 202 ? -16.272 4.773 -14.592 1.00 98.69 202 A 1 ATOM 1636 C C . ILE A 1 202 ? -15.311 4.607 -15.770 1.00 98.68 202 A 1 ATOM 1637 O O . ILE A 1 202 ? -14.886 5.594 -16.367 1.00 98.48 202 A 1 ATOM 1638 C CB . ILE A 1 202 ? -17.672 5.269 -15.035 1.00 98.66 202 A 1 ATOM 1639 C CG1 . ILE A 1 202 ? -18.618 5.417 -13.812 1.00 98.38 202 A 1 ATOM 1640 C CG2 . ILE A 1 202 ? -18.281 4.305 -16.079 1.00 98.44 202 A 1 ATOM 1641 C CD1 . ILE A 1 202 ? -20.032 5.924 -14.135 1.00 98.01 202 A 1 ATOM 1642 N N . ASN A 1 203 ? -14.992 3.350 -16.116 1.00 98.82 203 A 1 ATOM 1643 C CA . ASN A 1 203 ? -14.329 3.034 -17.374 1.00 98.79 203 A 1 ATOM 1644 C C . ASN A 1 203 ? -15.385 2.840 -18.463 1.00 98.84 203 A 1 ATOM 1645 O O . ASN A 1 203 ? -16.375 2.135 -18.263 1.00 98.66 203 A 1 ATOM 1646 C CB . ASN A 1 203 ? -13.422 1.800 -17.230 1.00 98.49 203 A 1 ATOM 1647 C CG . ASN A 1 203 ? -12.094 2.096 -16.550 1.00 96.66 203 A 1 ATOM 1648 O OD1 . ASN A 1 203 ? -11.830 3.178 -16.051 1.00 89.93 203 A 1 ATOM 1649 N ND2 . ASN A 1 203 ? -11.201 1.130 -16.526 1.00 89.02 203 A 1 ATOM 1650 N N . VAL A 1 204 ? -15.151 3.437 -19.626 1.00 98.67 204 A 1 ATOM 1651 C CA . VAL A 1 204 ? -15.941 3.227 -20.843 1.00 98.67 204 A 1 ATOM 1652 C C . VAL A 1 204 ? -15.131 2.330 -21.763 1.00 98.67 204 A 1 ATOM 1653 O O . VAL A 1 204 ? -14.208 2.797 -22.430 1.00 98.42 204 A 1 ATOM 1654 C CB . VAL A 1 204 ? -16.310 4.561 -21.515 1.00 98.49 204 A 1 ATOM 1655 C CG1 . VAL A 1 204 ? -17.175 4.333 -22.759 1.00 98.00 204 A 1 ATOM 1656 C CG2 . VAL A 1 204 ? -17.083 5.469 -20.545 1.00 98.10 204 A 1 ATOM 1657 N N . TRP A 1 205 ? -15.458 1.037 -21.765 1.00 98.80 205 A 1 ATOM 1658 C CA . TRP A 1 205 ? -14.811 0.049 -22.626 1.00 98.83 205 A 1 ATOM 1659 C C . TRP A 1 205 ? -15.556 -0.051 -23.953 1.00 98.79 205 A 1 ATOM 1660 O O . TRP A 1 205 ? -16.779 -0.202 -23.972 1.00 98.63 205 A 1 ATOM 1661 C CB . TRP A 1 205 ? -14.733 -1.287 -21.892 1.00 98.81 205 A 1 ATOM 1662 C CG . TRP A 1 205 ? -13.921 -2.327 -22.611 1.00 98.76 205 A 1 ATOM 1663 C CD1 . TRP A 1 205 ? -12.612 -2.572 -22.406 1.00 98.49 205 A 1 ATOM 1664 C CD2 . TRP A 1 205 ? -14.356 -3.257 -23.650 1.00 98.65 205 A 1 ATOM 1665 N NE1 . TRP A 1 205 ? -12.196 -3.599 -23.243 1.00 98.28 205 A 1 ATOM 1666 C CE2 . TRP A 1 205 ? -13.234 -4.050 -24.021 1.00 98.47 205 A 1 ATOM 1667 C CE3 . TRP A 1 205 ? -15.577 -3.513 -24.301 1.00 98.44 205 A 1 ATOM 1668 C CZ2 . TRP A 1 205 ? -13.323 -5.064 -25.004 1.00 98.03 205 A 1 ATOM 1669 C CZ3 . TRP A 1 205 ? -15.665 -4.524 -25.285 1.00 97.87 205 A 1 ATOM 1670 C CH2 . TRP A 1 205 ? -14.545 -5.287 -25.625 1.00 97.73 205 A 1 ATOM 1671 N N . ARG A 1 206 ? -14.830 0.033 -25.065 1.00 98.63 206 A 1 ATOM 1672 C CA . ARG A 1 206 ? -15.399 0.002 -26.418 1.00 98.58 206 A 1 ATOM 1673 C C . ARG A 1 206 ? -14.549 -0.875 -27.336 1.00 98.70 206 A 1 ATOM 1674 O O . ARG A 1 206 ? -13.338 -0.686 -27.380 1.00 98.46 206 A 1 ATOM 1675 C CB . ARG A 1 206 ? -15.483 1.435 -26.959 1.00 97.84 206 A 1 ATOM 1676 C CG . ARG A 1 206 ? -16.038 1.498 -28.383 1.00 96.27 206 A 1 ATOM 1677 C CD . ARG A 1 206 ? -15.932 2.906 -28.985 1.00 95.35 206 A 1 ATOM 1678 N NE . ARG A 1 206 ? -16.722 3.868 -28.203 1.00 94.03 206 A 1 ATOM 1679 C CZ . ARG A 1 206 ? -18.008 4.118 -28.315 1.00 95.10 206 A 1 ATOM 1680 N NH1 . ARG A 1 206 ? -18.759 3.550 -29.205 1.00 89.17 206 A 1 ATOM 1681 N NH2 . ARG A 1 206 ? -18.555 4.980 -27.523 1.00 90.29 206 A 1 ATOM 1682 N N . PRO A 1 207 ? -15.160 -1.774 -28.127 1.00 98.58 207 A 1 ATOM 1683 C CA . PRO A 1 207 ? -14.478 -2.386 -29.259 1.00 98.48 207 A 1 ATOM 1684 C C . PRO A 1 207 ? -14.112 -1.325 -30.305 1.00 98.44 207 A 1 ATOM 1685 O O . PRO A 1 207 ? -14.903 -0.434 -30.601 1.00 97.87 207 A 1 ATOM 1686 C CB . PRO A 1 207 ? -15.452 -3.421 -29.831 1.00 97.97 207 A 1 ATOM 1687 C CG . PRO A 1 207 ? -16.462 -3.643 -28.709 1.00 96.36 207 A 1 ATOM 1688 C CD . PRO A 1 207 ? -16.512 -2.289 -28.013 1.00 98.09 207 A 1 ATOM 1689 N N . VAL A 1 208 ? -12.920 -1.451 -30.888 1.00 98.32 208 A 1 ATOM 1690 C CA . VAL A 1 208 ? -12.511 -0.667 -32.072 1.00 98.05 208 A 1 ATOM 1691 C C . VAL A 1 208 ? -13.017 -1.338 -33.353 1.00 97.66 208 A 1 ATOM 1692 O O . VAL A 1 208 ? -13.302 -0.673 -34.345 1.00 96.15 208 A 1 ATOM 1693 C CB . VAL A 1 208 ? -10.979 -0.504 -32.094 1.00 97.55 208 A 1 ATOM 1694 C CG1 . VAL A 1 208 ? -10.468 0.231 -33.335 1.00 96.05 208 A 1 ATOM 1695 C CG2 . VAL A 1 208 ? -10.497 0.279 -30.861 1.00 96.60 208 A 1 ATOM 1696 N N . ARG A 1 209 ? -13.178 -2.664 -33.302 1.00 97.34 209 A 1 ATOM 1697 C CA . ARG A 1 209 ? -13.866 -3.499 -34.297 1.00 96.77 209 A 1 ATOM 1698 C C . ARG A 1 209 ? -14.630 -4.606 -33.577 1.00 97.26 209 A 1 ATOM 1699 O O . ARG A 1 209 ? -14.365 -4.860 -32.402 1.00 96.52 209 A 1 ATOM 1700 C CB . ARG A 1 209 ? -12.858 -4.065 -35.315 1.00 94.52 209 A 1 ATOM 1701 C CG . ARG A 1 209 ? -11.747 -4.931 -34.699 1.00 89.97 209 A 1 ATOM 1702 C CD . ARG A 1 209 ? -10.817 -5.443 -35.799 1.00 88.97 209 A 1 ATOM 1703 N NE . ARG A 1 209 ? -9.683 -6.199 -35.249 1.00 86.11 209 A 1 ATOM 1704 C CZ . ARG A 1 209 ? -8.427 -5.791 -35.146 1.00 86.20 209 A 1 ATOM 1705 N NH1 . ARG A 1 209 ? -8.049 -4.588 -35.453 1.00 77.30 209 A 1 ATOM 1706 N NH2 . ARG A 1 209 ? -7.517 -6.618 -34.753 1.00 79.87 209 A 1 ATOM 1707 N N . LYS A 1 210 ? -15.545 -5.295 -34.275 1.00 96.86 210 A 1 ATOM 1708 C CA . LYS A 1 210 ? -16.350 -6.376 -33.695 1.00 97.04 210 A 1 ATOM 1709 C C . LYS A 1 210 ? -15.477 -7.371 -32.919 1.00 97.34 210 A 1 ATOM 1710 O O . LYS A 1 210 ? -14.479 -7.864 -33.439 1.00 96.71 210 A 1 ATOM 1711 C CB . LYS A 1 210 ? -17.156 -7.075 -34.800 1.00 96.44 210 A 1 ATOM 1712 C CG . LYS A 1 210 ? -18.126 -8.118 -34.223 1.00 95.23 210 A 1 ATOM 1713 C CD . LYS A 1 210 ? -18.992 -8.761 -35.309 1.00 92.78 210 A 1 ATOM 1714 C CE . LYS A 1 210 ? -19.955 -9.758 -34.652 1.00 88.74 210 A 1 ATOM 1715 N NZ . LYS A 1 210 ? -20.849 -10.411 -35.630 1.00 82.53 210 A 1 ATOM 1716 N N . VAL A 1 211 ? -15.874 -7.686 -31.684 1.00 97.45 211 A 1 ATOM 1717 C CA . VAL A 1 211 ? -15.179 -8.661 -30.833 1.00 97.51 211 A 1 ATOM 1718 C C . VAL A 1 211 ? -15.454 -10.071 -31.353 1.00 97.25 211 A 1 ATOM 1719 O O . VAL A 1 211 ? -16.603 -10.508 -31.382 1.00 96.83 211 A 1 ATOM 1720 C CB . VAL A 1 211 ? -15.612 -8.519 -29.363 1.00 97.53 211 A 1 ATOM 1721 C CG1 . VAL A 1 211 ? -14.901 -9.531 -28.463 1.00 97.07 211 A 1 ATOM 1722 C CG2 . VAL A 1 211 ? -15.287 -7.116 -28.831 1.00 97.13 211 A 1 ATOM 1723 N N . THR A 1 212 ? -14.391 -10.772 -31.751 1.00 97.16 212 A 1 ATOM 1724 C CA . THR A 1 212 ? -14.443 -12.168 -32.215 1.00 96.77 212 A 1 ATOM 1725 C C . THR A 1 212 ? -13.579 -13.100 -31.366 1.00 96.55 212 A 1 ATOM 1726 O O . THR A 1 212 ? -13.623 -14.311 -31.552 1.00 95.63 212 A 1 ATOM 1727 C CB . THR A 1 212 ? -14.027 -12.282 -33.689 1.00 96.22 212 A 1 ATOM 1728 O OG1 . THR A 1 212 ? -12.698 -11.855 -33.870 1.00 94.73 212 A 1 ATOM 1729 C CG2 . THR A 1 212 ? -14.909 -11.443 -34.619 1.00 94.53 212 A 1 ATOM 1730 N N . ASN A 1 213 ? -12.790 -12.552 -30.435 1.00 97.15 213 A 1 ATOM 1731 C CA . ASN A 1 213 ? -11.942 -13.268 -29.492 1.00 97.26 213 A 1 ATOM 1732 C C . ASN A 1 213 ? -11.740 -12.442 -28.218 1.00 97.53 213 A 1 ATOM 1733 O O . ASN A 1 213 ? -11.886 -11.218 -28.226 1.00 97.38 213 A 1 ATOM 1734 C CB . ASN A 1 213 ? -10.605 -13.624 -30.162 1.00 97.00 213 A 1 ATOM 1735 C CG . ASN A 1 213 ? -9.865 -12.421 -30.723 1.00 96.71 213 A 1 ATOM 1736 O OD1 . ASN A 1 213 ? -9.107 -11.750 -30.052 1.00 91.02 213 A 1 ATOM 1737 N ND2 . ASN A 1 213 ? -10.063 -12.113 -31.987 1.00 90.95 213 A 1 ATOM 1738 N N . GLU A 1 214 ? -11.409 -13.132 -27.129 1.00 97.82 214 A 1 ATOM 1739 C CA . GLU A 1 214 ? -11.071 -12.560 -25.820 1.00 97.74 214 A 1 ATOM 1740 C C . GLU A 1 214 ? -12.041 -11.458 -25.335 1.00 98.07 214 A 1 ATOM 1741 O O . GLU A 1 214 ? -11.613 -10.346 -25.011 1.00 97.58 214 A 1 ATOM 1742 C CB . GLU A 1 214 ? -9.602 -12.111 -25.793 1.00 96.85 214 A 1 ATOM 1743 C CG . GLU A 1 214 ? -8.636 -13.259 -26.109 1.00 92.42 214 A 1 ATOM 1744 C CD . GLU A 1 214 ? -7.217 -13.010 -25.613 1.00 89.78 214 A 1 ATOM 1745 O OE1 . GLU A 1 214 ? -6.278 -13.569 -26.208 1.00 83.61 214 A 1 ATOM 1746 O OE2 . GLU A 1 214 ? -7.032 -12.361 -24.563 1.00 84.34 214 A 1 ATOM 1747 N N . PRO A 1 215 ? -13.352 -11.730 -25.263 1.00 98.18 215 A 1 ATOM 1748 C CA . PRO A 1 215 ? -14.316 -10.756 -24.771 1.00 98.20 215 A 1 ATOM 1749 C C . PRO A 1 215 ? -14.010 -10.327 -23.328 1.00 98.37 215 A 1 ATOM 1750 O O . PRO A 1 215 ? -13.309 -11.009 -22.579 1.00 98.15 215 A 1 ATOM 1751 C CB . PRO A 1 215 ? -15.683 -11.428 -24.908 1.00 97.72 215 A 1 ATOM 1752 C CG . PRO A 1 215 ? -15.357 -12.917 -24.811 1.00 96.69 215 A 1 ATOM 1753 C CD . PRO A 1 215 ? -14.003 -13.010 -25.512 1.00 97.77 215 A 1 ATOM 1754 N N . LEU A 1 216 ? -14.567 -9.185 -22.916 1.00 98.63 216 A 1 ATOM 1755 C CA . LEU A 1 216 ? -14.466 -8.686 -21.547 1.00 98.72 216 A 1 ATOM 1756 C C . LEU A 1 216 ? -15.697 -9.107 -20.741 1.00 98.74 216 A 1 ATOM 1757 O O . LEU A 1 216 ? -16.821 -8.749 -21.096 1.00 98.57 216 A 1 ATOM 1758 C CB . LEU A 1 216 ? -14.275 -7.160 -21.579 1.00 98.66 216 A 1 ATOM 1759 C CG . LEU A 1 216 ? -14.103 -6.519 -20.188 1.00 98.22 216 A 1 ATOM 1760 C CD1 . LEU A 1 216 ? -12.834 -6.984 -19.474 1.00 97.66 216 A 1 ATOM 1761 C CD2 . LEU A 1 216 ? -14.013 -4.999 -20.332 1.00 97.42 216 A 1 ATOM 1762 N N . ALA A 1 217 ? -15.475 -9.822 -19.637 1.00 98.74 217 A 1 ATOM 1763 C CA . ALA A 1 217 ? -16.499 -10.170 -18.662 1.00 98.77 217 A 1 ATOM 1764 C C . ALA A 1 217 ? -16.521 -9.174 -17.498 1.00 98.84 217 A 1 ATOM 1765 O O . ALA A 1 217 ? -15.486 -8.660 -17.078 1.00 98.77 217 A 1 ATOM 1766 C CB . ALA A 1 217 ? -16.274 -11.598 -18.168 1.00 98.57 217 A 1 ATOM 1767 N N . VAL A 1 218 ? -17.710 -8.951 -16.950 1.00 98.80 218 A 1 ATOM 1768 C CA . VAL A 1 218 ? -17.970 -8.136 -15.761 1.00 98.81 218 A 1 ATOM 1769 C C . VAL A 1 218 ? -18.714 -8.960 -14.716 1.00 98.76 218 A 1 ATOM 1770 O O . VAL A 1 218 ? -19.557 -9.793 -15.049 1.00 98.53 218 A 1 ATOM 1771 C CB . VAL A 1 218 ? -18.742 -6.850 -16.104 1.00 98.69 218 A 1 ATOM 1772 C CG1 . VAL A 1 218 ? -17.841 -5.853 -16.831 1.00 98.11 218 A 1 ATOM 1773 C CG2 . VAL A 1 218 ? -19.990 -7.099 -16.969 1.00 97.58 218 A 1 ATOM 1774 N N . CYS A 1 219 ? -18.402 -8.735 -13.447 1.00 98.71 219 A 1 ATOM 1775 C CA . CYS A 1 219 ? -19.016 -9.430 -12.321 1.00 98.56 219 A 1 ATOM 1776 C C . CYS A 1 219 ? -20.025 -8.519 -11.616 1.00 98.66 219 A 1 ATOM 1777 O O . CYS A 1 219 ? -19.699 -7.389 -11.259 1.00 98.09 219 A 1 ATOM 1778 C CB . CYS A 1 219 ? -17.898 -9.895 -11.389 1.00 97.42 219 A 1 ATOM 1779 S SG . CYS A 1 219 ? -18.568 -11.000 -10.131 1.00 94.67 219 A 1 ATOM 1780 N N . ASP A 1 220 ? -21.235 -9.020 -11.360 1.00 98.66 220 A 1 ATOM 1781 C CA . ASP A 1 220 ? -22.241 -8.290 -10.581 1.00 98.64 220 A 1 ATOM 1782 C C . ASP A 1 220 ? -21.656 -7.900 -9.217 1.00 98.61 220 A 1 ATOM 1783 O O . ASP A 1 220 ? -21.290 -8.765 -8.413 1.00 98.28 220 A 1 ATOM 1784 C CB . ASP A 1 220 ? -23.502 -9.146 -10.431 1.00 98.42 220 A 1 ATOM 1785 C CG . ASP A 1 220 ? -24.679 -8.454 -9.730 1.00 97.90 220 A 1 ATOM 1786 O OD1 . ASP A 1 220 ? -24.501 -7.561 -8.871 1.00 96.05 220 A 1 ATOM 1787 O OD2 . ASP A 1 220 ? -25.831 -8.843 -10.010 1.00 95.25 220 A 1 ATOM 1788 N N . ALA A 1 221 ? -21.598 -6.599 -8.948 1.00 98.57 221 A 1 ATOM 1789 C CA . ALA A 1 221 ? -20.994 -6.046 -7.738 1.00 98.49 221 A 1 ATOM 1790 C C . ALA A 1 221 ? -21.572 -6.648 -6.447 1.00 98.41 221 A 1 ATOM 1791 O O . ALA A 1 221 ? -20.858 -6.794 -5.453 1.00 97.79 221 A 1 ATOM 1792 C CB . ALA A 1 221 ? -21.194 -4.530 -7.772 1.00 98.13 221 A 1 ATOM 1793 N N . ARG A 1 222 ? -22.844 -7.051 -6.461 1.00 98.33 222 A 1 ATOM 1794 C CA . ARG A 1 222 ? -23.553 -7.647 -5.314 1.00 98.05 222 A 1 ATOM 1795 C C . ARG A 1 222 ? -23.080 -9.066 -4.993 1.00 97.98 222 A 1 ATOM 1796 O O . ARG A 1 222 ? -23.333 -9.550 -3.895 1.00 97.13 222 A 1 ATOM 1797 C CB . ARG A 1 222 ? -25.054 -7.669 -5.613 1.00 97.49 222 A 1 ATOM 1798 C CG . ARG A 1 222 ? -25.639 -6.284 -5.919 1.00 96.47 222 A 1 ATOM 1799 C CD . ARG A 1 222 ? -27.093 -6.382 -6.368 1.00 95.37 222 A 1 ATOM 1800 N NE . ARG A 1 222 ? -27.216 -7.078 -7.661 1.00 94.19 222 A 1 ATOM 1801 C CZ . ARG A 1 222 ? -28.344 -7.355 -8.302 1.00 94.14 222 A 1 ATOM 1802 N NH1 . ARG A 1 222 ? -29.505 -7.005 -7.832 1.00 90.03 222 A 1 ATOM 1803 N NH2 . ARG A 1 222 ? -28.313 -7.988 -9.431 1.00 90.87 222 A 1 ATOM 1804 N N . SER A 1 223 ? -22.445 -9.742 -5.942 1.00 98.37 223 A 1 ATOM 1805 C CA . SER A 1 223 ? -21.991 -11.127 -5.779 1.00 98.25 223 A 1 ATOM 1806 C C . SER A 1 223 ? -20.588 -11.262 -5.184 1.00 98.21 223 A 1 ATOM 1807 O O . SER A 1 223 ? -20.180 -12.378 -4.868 1.00 97.31 223 A 1 ATOM 1808 C CB . SER A 1 223 ? -22.116 -11.884 -7.103 1.00 97.85 223 A 1 ATOM 1809 O OG . SER A 1 223 ? -21.167 -11.476 -8.059 1.00 96.70 223 A 1 ATOM 1810 N N . VAL A 1 224 ? -19.874 -10.146 -5.013 1.00 98.18 224 A 1 ATOM 1811 C CA . VAL A 1 224 ? -18.529 -10.097 -4.423 1.00 98.02 224 A 1 ATOM 1812 C C . VAL A 1 224 ? -18.571 -9.247 -3.157 1.00 97.82 224 A 1 ATOM 1813 O O . VAL A 1 224 ? -18.934 -8.070 -3.204 1.00 97.28 224 A 1 ATOM 1814 C CB . VAL A 1 224 ? -17.497 -9.560 -5.428 1.00 97.74 224 A 1 ATOM 1815 C CG1 . VAL A 1 224 ? -16.082 -9.605 -4.854 1.00 95.72 224 A 1 ATOM 1816 C CG2 . VAL A 1 224 ? -17.504 -10.393 -6.718 1.00 95.96 224 A 1 ATOM 1817 N N . ARG A 1 225 ? -18.208 -9.836 -2.019 1.00 97.78 225 A 1 ATOM 1818 C CA . ARG A 1 225 ? -18.186 -9.150 -0.720 1.00 97.40 225 A 1 ATOM 1819 C C . ARG A 1 225 ? -16.965 -8.236 -0.603 1.00 97.45 225 A 1 ATOM 1820 O O . ARG A 1 225 ? -15.985 -8.403 -1.323 1.00 97.24 225 A 1 ATOM 1821 C CB . ARG A 1 225 ? -18.196 -10.174 0.423 1.00 96.98 225 A 1 ATOM 1822 C CG . ARG A 1 225 ? -19.344 -11.194 0.343 1.00 95.62 225 A 1 ATOM 1823 C CD . ARG A 1 225 ? -19.371 -12.111 1.577 1.00 94.71 225 A 1 ATOM 1824 N NE . ARG A 1 225 ? -18.051 -12.689 1.872 1.00 92.70 225 A 1 ATOM 1825 C CZ . ARG A 1 225 ? -17.416 -13.664 1.237 1.00 92.04 225 A 1 ATOM 1826 N NH1 . ARG A 1 225 ? -17.974 -14.346 0.286 1.00 87.41 225 A 1 ATOM 1827 N NH2 . ARG A 1 225 ? -16.192 -13.943 1.575 1.00 89.72 225 A 1 ATOM 1828 N N . GLU A 1 226 ? -17.006 -7.300 0.336 1.00 96.83 226 A 1 ATOM 1829 C CA . GLU A 1 226 ? -15.859 -6.442 0.654 1.00 96.26 226 A 1 ATOM 1830 C C . GLU A 1 226 ? -14.634 -7.269 1.083 1.00 97.05 226 A 1 ATOM 1831 O O . GLU A 1 226 ? -13.542 -7.043 0.577 1.00 96.41 226 A 1 ATOM 1832 C CB . GLU A 1 226 ? -16.250 -5.433 1.744 1.00 94.13 226 A 1 ATOM 1833 C CG . GLU A 1 226 ? -17.271 -4.372 1.295 1.00 86.44 226 A 1 ATOM 1834 C CD . GLU A 1 226 ? -16.722 -3.376 0.270 1.00 82.96 226 A 1 ATOM 1835 O OE1 . GLU A 1 226 ? -17.459 -3.028 -0.680 1.00 75.83 226 A 1 ATOM 1836 O OE2 . GLU A 1 226 ? -15.567 -2.938 0.410 1.00 75.92 226 A 1 ATOM 1837 N N . ASP A 1 227 ? -14.811 -8.294 1.920 1.00 96.98 227 A 1 ATOM 1838 C CA . ASP A 1 227 ? -13.737 -9.162 2.432 1.00 97.01 227 A 1 ATOM 1839 C C . ASP A 1 227 ? -13.089 -10.081 1.377 1.00 97.56 227 A 1 ATOM 1840 O O . ASP A 1 227 ? -12.134 -10.794 1.678 1.00 96.98 227 A 1 ATOM 1841 C CB . ASP A 1 227 ? -14.260 -9.982 3.632 1.00 96.34 227 A 1 ATOM 1842 C CG . ASP A 1 227 ? -15.286 -11.068 3.250 1.00 94.92 227 A 1 ATOM 1843 O OD1 . ASP A 1 227 ? -16.112 -10.848 2.340 1.00 93.12 227 A 1 ATOM 1844 O OD2 . ASP A 1 227 ? -15.305 -12.160 3.855 1.00 91.89 227 A 1 ATOM 1845 N N . GLU A 1 228 ? -13.577 -10.070 0.133 1.00 97.64 228 A 1 ATOM 1846 C CA . GLU A 1 228 ? -12.972 -10.786 -0.998 1.00 97.84 228 A 1 ATOM 1847 C C . GLU A 1 228 ? -12.024 -9.900 -1.821 1.00 98.07 228 A 1 ATOM 1848 O O . GLU A 1 228 ? -11.385 -10.387 -2.753 1.00 97.82 228 A 1 ATOM 1849 C CB . GLU A 1 228 ? -14.069 -11.377 -1.898 1.00 97.78 228 A 1 ATOM 1850 C CG . GLU A 1 228 ? -14.916 -12.435 -1.172 1.00 97.30 228 A 1 ATOM 1851 C CD . GLU A 1 228 ? -16.019 -12.992 -2.074 1.00 97.20 228 A 1 ATOM 1852 O OE1 . GLU A 1 228 ? -15.755 -13.972 -2.801 1.00 94.45 228 A 1 ATOM 1853 O OE2 . GLU A 1 228 ? -17.150 -12.475 -2.043 1.00 95.21 228 A 1 ATOM 1854 N N . LEU A 1 229 ? -11.943 -8.611 -1.500 1.00 97.91 229 A 1 ATOM 1855 C CA . LEU A 1 229 ? -11.119 -7.640 -2.213 1.00 97.86 229 A 1 ATOM 1856 C C . LEU A 1 229 ? -9.811 -7.404 -1.450 1.00 97.74 229 A 1 ATOM 1857 O O . LEU A 1 229 ? -9.825 -7.230 -0.238 1.00 97.37 229 A 1 ATOM 1858 C CB . LEU A 1 229 ? -11.917 -6.341 -2.407 1.00 97.83 229 A 1 ATOM 1859 C CG . LEU A 1 229 ? -13.268 -6.505 -3.139 1.00 97.48 229 A 1 ATOM 1860 C CD1 . LEU A 1 229 ? -14.005 -5.169 -3.185 1.00 97.25 229 A 1 ATOM 1861 C CD2 . LEU A 1 229 ? -13.088 -7.000 -4.578 1.00 96.92 229 A 1 ATOM 1862 N N . PHE A 1 230 ? -8.679 -7.374 -2.147 1.00 98.10 230 A 1 ATOM 1863 C CA . PHE A 1 230 ? -7.361 -7.233 -1.532 1.00 97.96 230 A 1 ATOM 1864 C C . PHE A 1 230 ? -6.556 -6.140 -2.220 1.00 97.93 230 A 1 ATOM 1865 O O . PHE A 1 230 ? -6.410 -6.144 -3.442 1.00 97.44 230 A 1 ATOM 1866 C CB . PHE A 1 230 ? -6.615 -8.567 -1.590 1.00 97.67 230 A 1 ATOM 1867 C CG . PHE A 1 230 ? -7.204 -9.648 -0.709 1.00 97.48 230 A 1 ATOM 1868 C CD1 . PHE A 1 230 ? -6.625 -9.938 0.535 1.00 96.53 230 A 1 ATOM 1869 C CD2 . PHE A 1 230 ? -8.348 -10.356 -1.123 1.00 96.61 230 A 1 ATOM 1870 C CE1 . PHE A 1 230 ? -7.174 -10.933 1.355 1.00 95.90 230 A 1 ATOM 1871 C CE2 . PHE A 1 230 ? -8.908 -11.346 -0.303 1.00 96.03 230 A 1 ATOM 1872 C CZ . PHE A 1 230 ? -8.318 -11.634 0.936 1.00 95.95 230 A 1 ATOM 1873 N N . ASN A 1 231 ? -5.991 -5.235 -1.423 1.00 97.99 231 A 1 ATOM 1874 C CA . ASN A 1 231 ? -5.134 -4.179 -1.936 1.00 97.81 231 A 1 ATOM 1875 C C . ASN A 1 231 ? -3.937 -4.777 -2.682 1.00 97.94 231 A 1 ATOM 1876 O O . ASN A 1 231 ? -3.232 -5.645 -2.171 1.00 97.50 231 A 1 ATOM 1877 C CB . ASN A 1 231 ? -4.670 -3.271 -0.787 1.00 97.23 231 A 1 ATOM 1878 C CG . ASN A 1 231 ? -5.801 -2.466 -0.158 1.00 96.09 231 A 1 ATOM 1879 O OD1 . ASN A 1 231 ? -6.846 -2.244 -0.735 1.00 92.27 231 A 1 ATOM 1880 N ND2 . ASN A 1 231 ? -5.607 -1.989 1.049 1.00 91.43 231 A 1 ATOM 1881 N N . THR A 1 232 ? -3.704 -4.283 -3.896 1.00 98.04 232 A 1 ATOM 1882 C CA . THR A 1 232 ? -2.536 -4.607 -4.719 1.00 98.09 232 A 1 ATOM 1883 C C . THR A 1 232 ? -2.083 -3.316 -5.379 1.00 98.18 232 A 1 ATOM 1884 O O . THR A 1 232 ? -2.890 -2.643 -6.018 1.00 97.72 232 A 1 ATOM 1885 C CB . THR A 1 232 ? -2.881 -5.659 -5.785 1.00 97.59 232 A 1 ATOM 1886 O OG1 . THR A 1 232 ? -3.396 -6.826 -5.183 1.00 94.04 232 A 1 ATOM 1887 C CG2 . THR A 1 232 ? -1.670 -6.084 -6.614 1.00 93.95 232 A 1 ATOM 1888 N N . LEU A 1 233 ? -0.806 -2.944 -5.234 1.00 98.44 233 A 1 ATOM 1889 C CA . LEU A 1 233 ? -0.306 -1.741 -5.885 1.00 98.46 233 A 1 ATOM 1890 C C . LEU A 1 233 ? 0.070 -2.042 -7.334 1.00 98.55 233 A 1 ATOM 1891 O O . LEU A 1 233 ? 0.916 -2.888 -7.605 1.00 98.33 233 A 1 ATOM 1892 C CB . LEU A 1 233 ? 0.854 -1.147 -5.078 1.00 98.15 233 A 1 ATOM 1893 C CG . LEU A 1 233 ? 1.264 0.241 -5.601 1.00 95.64 233 A 1 ATOM 1894 C CD1 . LEU A 1 233 ? 0.207 1.303 -5.303 1.00 93.76 233 A 1 ATOM 1895 C CD2 . LEU A 1 233 ? 2.558 0.673 -4.935 1.00 93.90 233 A 1 ATOM 1896 N N . HIS A 1 234 ? -0.528 -1.317 -8.268 1.00 98.63 234 A 1 ATOM 1897 C CA . HIS A 1 234 ? -0.172 -1.352 -9.679 1.00 98.59 234 A 1 ATOM 1898 C C . HIS A 1 234 ? 0.725 -0.154 -10.003 1.00 98.58 234 A 1 ATOM 1899 O O . HIS A 1 234 ? 0.307 0.994 -9.856 1.00 98.27 234 A 1 ATOM 1900 C CB . HIS A 1 234 ? -1.458 -1.380 -10.519 1.00 98.30 234 A 1 ATOM 1901 C CG . HIS A 1 234 ? -1.254 -1.457 -12.007 1.00 97.47 234 A 1 ATOM 1902 N ND1 . HIS A 1 234 ? -2.118 -0.933 -12.955 1.00 90.46 234 A 1 ATOM 1903 C CD2 . HIS A 1 234 ? -0.231 -2.053 -12.689 1.00 90.11 234 A 1 ATOM 1904 C CE1 . HIS A 1 234 ? -1.624 -1.210 -14.169 1.00 90.31 234 A 1 ATOM 1905 N NE2 . HIS A 1 234 ? -0.478 -1.887 -14.048 1.00 91.82 234 A 1 ATOM 1906 N N . LEU A 1 235 ? 1.950 -0.429 -10.459 1.00 98.56 235 A 1 ATOM 1907 C CA . LEU A 1 235 ? 2.944 0.570 -10.843 1.00 98.53 235 A 1 ATOM 1908 C C . LEU A 1 235 ? 3.234 0.466 -12.339 1.00 98.42 235 A 1 ATOM 1909 O O . LEU A 1 235 ? 3.505 -0.620 -12.842 1.00 97.94 235 A 1 ATOM 1910 C CB . LEU A 1 235 ? 4.223 0.370 -10.022 1.00 98.44 235 A 1 ATOM 1911 C CG . LEU A 1 235 ? 4.059 0.607 -8.512 1.00 97.87 235 A 1 ATOM 1912 C CD1 . LEU A 1 235 ? 5.311 0.147 -7.786 1.00 96.76 235 A 1 ATOM 1913 C CD2 . LEU A 1 235 ? 3.844 2.088 -8.190 1.00 96.48 235 A 1 ATOM 1914 N N . VAL A 1 236 ? 3.225 1.595 -13.049 1.00 98.19 236 A 1 ATOM 1915 C CA . VAL A 1 236 ? 3.503 1.648 -14.492 1.00 97.93 236 A 1 ATOM 1916 C C . VAL A 1 236 ? 4.779 2.456 -14.736 1.00 97.95 236 A 1 ATOM 1917 O O . VAL A 1 236 ? 4.737 3.686 -14.690 1.00 97.55 236 A 1 ATOM 1918 C CB . VAL A 1 236 ? 2.303 2.206 -15.283 1.00 97.27 236 A 1 ATOM 1919 C CG1 . VAL A 1 236 ? 2.583 2.139 -16.787 1.00 95.40 236 A 1 ATOM 1920 C CG2 . VAL A 1 236 ? 1.020 1.414 -15.002 1.00 95.80 236 A 1 ATOM 1921 N N . PRO A 1 237 ? 5.930 1.807 -15.015 1.00 97.84 237 A 1 ATOM 1922 C CA . PRO A 1 237 ? 7.227 2.480 -15.127 1.00 97.58 237 A 1 ATOM 1923 C C . PRO A 1 237 ? 7.492 3.081 -16.519 1.00 96.80 237 A 1 ATOM 1924 O O . PRO A 1 237 ? 8.624 3.093 -16.986 1.00 95.01 237 A 1 ATOM 1925 C CB . PRO A 1 237 ? 8.243 1.412 -14.711 1.00 97.27 237 A 1 ATOM 1926 C CG . PRO A 1 237 ? 7.633 0.133 -15.274 1.00 96.66 237 A 1 ATOM 1927 C CD . PRO A 1 237 ? 6.131 0.354 -15.052 1.00 97.68 237 A 1 ATOM 1928 N N . MET A 1 238 ? 6.469 3.587 -17.205 1.00 96.69 238 A 1 ATOM 1929 C CA . MET A 1 238 ? 6.538 3.994 -18.619 1.00 95.33 238 A 1 ATOM 1930 C C . MET A 1 238 ? 7.541 5.124 -18.904 1.00 95.30 238 A 1 ATOM 1931 O O . MET A 1 238 ? 8.074 5.213 -20.005 1.00 93.00 238 A 1 ATOM 1932 C CB . MET A 1 238 ? 5.137 4.418 -19.062 1.00 92.87 238 A 1 ATOM 1933 C CG . MET A 1 238 ? 5.025 4.609 -20.586 1.00 83.68 238 A 1 ATOM 1934 S SD . MET A 1 238 ? 3.424 5.255 -21.143 1.00 77.15 238 A 1 ATOM 1935 C CE . MET A 1 238 ? 2.300 3.973 -20.557 1.00 67.89 238 A 1 ATOM 1936 N N . ARG A 1 239 ? 7.783 6.001 -17.913 1.00 95.12 239 A 1 ATOM 1937 C CA . ARG A 1 239 ? 8.687 7.161 -18.035 1.00 95.07 239 A 1 ATOM 1938 C C . ARG A 1 239 ? 9.945 7.018 -17.180 1.00 95.64 239 A 1 ATOM 1939 O O . ARG A 1 239 ? 10.558 8.019 -16.827 1.00 94.39 239 A 1 ATOM 1940 C CB . ARG A 1 239 ? 7.930 8.461 -17.730 1.00 93.93 239 A 1 ATOM 1941 C CG . ARG A 1 239 ? 6.770 8.708 -18.710 1.00 88.61 239 A 1 ATOM 1942 C CD . ARG A 1 239 ? 6.125 10.073 -18.449 1.00 83.09 239 A 1 ATOM 1943 N NE . ARG A 1 239 ? 5.453 10.102 -17.138 1.00 74.11 239 A 1 ATOM 1944 C CZ . ARG A 1 239 ? 5.233 11.171 -16.383 1.00 66.66 239 A 1 ATOM 1945 N NH1 . ARG A 1 239 ? 5.597 12.368 -16.755 1.00 60.62 239 A 1 ATOM 1946 N NH2 . ARG A 1 239 ? 4.635 11.040 -15.239 1.00 58.55 239 A 1 ATOM 1947 N N . TRP A 1 240 ? 10.326 5.810 -16.811 1.00 94.93 240 A 1 ATOM 1948 C CA . TRP A 1 240 ? 11.571 5.568 -16.079 1.00 94.97 240 A 1 ATOM 1949 C C . TRP A 1 240 ? 12.785 5.867 -16.966 1.00 94.43 240 A 1 ATOM 1950 O O . TRP A 1 240 ? 12.814 5.411 -18.105 1.00 92.40 240 A 1 ATOM 1951 C CB . TRP A 1 240 ? 11.597 4.122 -15.596 1.00 94.39 240 A 1 ATOM 1952 C CG . TRP A 1 240 ? 12.759 3.797 -14.711 1.00 94.20 240 A 1 ATOM 1953 C CD1 . TRP A 1 240 ? 14.033 3.595 -15.114 1.00 91.08 240 A 1 ATOM 1954 C CD2 . TRP A 1 240 ? 12.770 3.699 -13.256 1.00 93.31 240 A 1 ATOM 1955 N NE1 . TRP A 1 240 ? 14.841 3.376 -14.003 1.00 90.09 240 A 1 ATOM 1956 C CE2 . TRP A 1 240 ? 14.101 3.432 -12.846 1.00 91.85 240 A 1 ATOM 1957 C CE3 . TRP A 1 240 ? 11.777 3.812 -12.263 1.00 90.85 240 A 1 ATOM 1958 C CZ2 . TRP A 1 240 ? 14.449 3.290 -11.484 1.00 91.00 240 A 1 ATOM 1959 C CZ3 . TRP A 1 240 ? 12.120 3.666 -10.910 1.00 89.33 240 A 1 ATOM 1960 C CH2 . TRP A 1 240 ? 13.448 3.414 -10.529 1.00 89.81 240 A 1 ATOM 1961 N N . PRO A 1 241 ? 13.826 6.574 -16.477 1.00 94.36 241 A 1 ATOM 1962 C CA . PRO A 1 241 ? 14.003 7.135 -15.128 1.00 94.31 241 A 1 ATOM 1963 C C . PRO A 1 241 ? 13.518 8.581 -14.968 1.00 94.93 241 A 1 ATOM 1964 O O . PRO A 1 241 ? 13.650 9.146 -13.891 1.00 93.73 241 A 1 ATOM 1965 C CB . PRO A 1 241 ? 15.512 7.038 -14.891 1.00 92.73 241 A 1 ATOM 1966 C CG . PRO A 1 241 ? 16.081 7.344 -16.281 1.00 90.93 241 A 1 ATOM 1967 C CD . PRO A 1 241 ? 15.076 6.679 -17.215 1.00 92.55 241 A 1 ATOM 1968 N N . ASP A 1 242 ? 12.954 9.192 -16.021 1.00 94.69 242 A 1 ATOM 1969 C CA . ASP A 1 242 ? 12.606 10.624 -16.035 1.00 94.81 242 A 1 ATOM 1970 C C . ASP A 1 242 ? 11.470 10.991 -15.065 1.00 95.06 242 A 1 ATOM 1971 O O . ASP A 1 242 ? 11.305 12.150 -14.678 1.00 93.86 242 A 1 ATOM 1972 C CB . ASP A 1 242 ? 12.195 11.047 -17.455 1.00 94.01 242 A 1 ATOM 1973 C CG . ASP A 1 242 ? 13.273 10.833 -18.514 1.00 89.91 242 A 1 ATOM 1974 O OD1 . ASP A 1 242 ? 14.472 10.910 -18.168 1.00 86.16 242 A 1 ATOM 1975 O OD2 . ASP A 1 242 ? 12.882 10.601 -19.678 1.00 85.02 242 A 1 ATOM 1976 N N . ALA A 1 243 ? 10.665 10.012 -14.678 1.00 95.03 243 A 1 ATOM 1977 C CA . ALA A 1 243 ? 9.660 10.133 -13.640 1.00 95.20 243 A 1 ATOM 1978 C C . ALA A 1 243 ? 9.510 8.809 -12.880 1.00 96.12 243 A 1 ATOM 1979 O O . ALA A 1 243 ? 9.731 7.730 -13.436 1.00 95.70 243 A 1 ATOM 1980 C CB . ALA A 1 243 ? 8.332 10.570 -14.272 1.00 93.71 243 A 1 ATOM 1981 N N . ALA A 1 244 ? 9.065 8.904 -11.623 1.00 95.73 244 A 1 ATOM 1982 C CA . ALA A 1 244 ? 8.632 7.736 -10.870 1.00 96.16 244 A 1 ATOM 1983 C C . ALA A 1 244 ? 7.490 7.008 -11.616 1.00 96.76 244 A 1 ATOM 1984 O O . ALA A 1 244 ? 6.703 7.651 -12.323 1.00 96.40 244 A 1 ATOM 1985 C CB . ALA A 1 244 ? 8.198 8.175 -9.466 1.00 95.42 244 A 1 ATOM 1986 N N . PRO A 1 245 ? 7.375 5.679 -11.465 1.00 97.11 245 A 1 ATOM 1987 C CA . PRO A 1 245 ? 6.226 4.934 -11.958 1.00 97.40 245 A 1 ATOM 1988 C C . PRO A 1 245 ? 4.910 5.549 -11.481 1.00 97.50 245 A 1 ATOM 1989 O O . PRO A 1 245 ? 4.799 5.988 -10.337 1.00 97.01 245 A 1 ATOM 1990 C CB . PRO A 1 245 ? 6.408 3.509 -11.439 1.00 97.10 245 A 1 ATOM 1991 C CG . PRO A 1 245 ? 7.923 3.386 -11.308 1.00 96.31 245 A 1 ATOM 1992 C CD . PRO A 1 245 ? 8.337 4.781 -10.859 1.00 97.20 245 A 1 ATOM 1993 N N . GLN A 1 246 ? 3.909 5.561 -12.366 1.00 97.28 246 A 1 ATOM 1994 C CA . GLN A 1 246 ? 2.562 5.937 -11.959 1.00 97.14 246 A 1 ATOM 1995 C C . GLN A 1 246 ? 2.029 4.879 -10.995 1.00 97.77 246 A 1 ATOM 1996 O O . GLN A 1 246 ? 2.039 3.692 -11.318 1.00 97.50 246 A 1 ATOM 1997 C CB . GLN A 1 246 ? 1.642 6.079 -13.175 1.00 95.84 246 A 1 ATOM 1998 C CG . GLN A 1 246 ? 1.994 7.312 -14.011 1.00 85.48 246 A 1 ATOM 1999 C CD . GLN A 1 246 ? 1.041 7.514 -15.187 1.00 79.84 246 A 1 ATOM 2000 O OE1 . GLN A 1 246 ? 0.543 6.592 -15.799 1.00 72.64 246 A 1 ATOM 2001 N NE2 . GLN A 1 246 ? 0.759 8.740 -15.557 1.00 68.64 246 A 1 ATOM 2002 N N . GLU A 1 247 ? 1.553 5.325 -9.837 1.00 97.74 247 A 1 ATOM 2003 C CA . GLU A 1 247 ? 0.972 4.454 -8.822 1.00 97.81 247 A 1 ATOM 2004 C C . GLU A 1 247 ? -0.551 4.402 -8.942 1.00 97.93 247 A 1 ATOM 2005 O O . GLU A 1 247 ? -1.219 5.391 -9.255 1.00 97.24 247 A 1 ATOM 2006 C CB . GLU A 1 247 ? 1.436 4.886 -7.416 1.00 96.56 247 A 1 ATOM 2007 C CG . GLU A 1 247 ? 0.888 6.244 -6.960 1.00 92.73 247 A 1 ATOM 2008 C CD . GLU A 1 247 ? 1.499 6.764 -5.652 1.00 93.99 247 A 1 ATOM 2009 O OE1 . GLU A 1 247 ? 0.809 7.540 -4.948 1.00 88.95 247 A 1 ATOM 2010 O OE2 . GLU A 1 247 ? 2.674 6.462 -5.372 1.00 91.46 247 A 1 ATOM 2011 N N . ASN A 1 248 ? -1.105 3.216 -8.673 1.00 98.17 248 A 1 ATOM 2012 C CA . ASN A 1 248 ? -2.533 3.029 -8.536 1.00 98.06 248 A 1 ATOM 2013 C C . ASN A 1 248 ? -2.803 1.821 -7.635 1.00 98.32 248 A 1 ATOM 2014 O O . ASN A 1 248 ? -2.487 0.691 -8.009 1.00 97.83 248 A 1 ATOM 2015 C CB . ASN A 1 248 ? -3.144 2.860 -9.934 1.00 97.06 248 A 1 ATOM 2016 C CG . ASN A 1 248 ? -4.640 2.734 -9.854 1.00 89.47 248 A 1 ATOM 2017 O OD1 . ASN A 1 248 ? -5.315 3.475 -9.158 1.00 79.87 248 A 1 ATOM 2018 N ND2 . ASN A 1 248 ? -5.206 1.796 -10.575 1.00 76.19 248 A 1 ATOM 2019 N N . GLN A 1 249 ? -3.399 2.044 -6.460 1.00 97.80 249 A 1 ATOM 2020 C CA . GLN A 1 249 ? -3.851 0.945 -5.619 1.00 97.86 249 A 1 ATOM 2021 C C . GLN A 1 249 ? -5.145 0.382 -6.203 1.00 97.99 249 A 1 ATOM 2022 O O . GLN A 1 249 ? -6.182 1.048 -6.223 1.00 97.74 249 A 1 ATOM 2023 C CB . GLN A 1 249 ? -3.994 1.392 -4.162 1.00 97.59 249 A 1 ATOM 2024 C CG . GLN A 1 249 ? -4.219 0.193 -3.236 1.00 96.26 249 A 1 ATOM 2025 C CD . GLN A 1 249 ? -4.442 0.630 -1.795 1.00 95.51 249 A 1 ATOM 2026 O OE1 . GLN A 1 249 ? -5.537 0.991 -1.412 1.00 89.70 249 A 1 ATOM 2027 N NE2 . GLN A 1 249 ? -3.428 0.620 -0.962 1.00 88.11 249 A 1 ATOM 2028 N N . MET A 1 250 ? -5.069 -0.856 -6.674 1.00 98.28 250 A 1 ATOM 2029 C CA . MET A 1 250 ? -6.184 -1.634 -7.198 1.00 98.30 250 A 1 ATOM 2030 C C . MET A 1 250 ? -6.644 -2.678 -6.179 1.00 98.38 250 A 1 ATOM 2031 O O . MET A 1 250 ? -6.032 -2.859 -5.126 1.00 98.09 250 A 1 ATOM 2032 C CB . MET A 1 250 ? -5.787 -2.266 -8.547 1.00 97.81 250 A 1 ATOM 2033 C CG . MET A 1 250 ? -4.660 -3.307 -8.441 1.00 95.63 250 A 1 ATOM 2034 S SD . MET A 1 250 ? -4.346 -4.237 -9.972 1.00 93.61 250 A 1 ATOM 2035 C CE . MET A 1 250 ? -5.833 -5.244 -10.037 1.00 86.23 250 A 1 ATOM 2036 N N . TRP A 1 251 ? -7.710 -3.406 -6.526 1.00 98.23 251 A 1 ATOM 2037 C CA . TRP A 1 251 ? -8.084 -4.635 -5.843 1.00 98.25 251 A 1 ATOM 2038 C C . TRP A 1 251 ? -7.892 -5.855 -6.741 1.00 98.30 251 A 1 ATOM 2039 O O . TRP A 1 251 ? -8.417 -5.915 -7.852 1.00 98.20 251 A 1 ATOM 2040 C CB . TRP A 1 251 ? -9.511 -4.541 -5.311 1.00 98.08 251 A 1 ATOM 2041 C CG . TRP A 1 251 ? -9.669 -3.755 -4.039 1.00 98.00 251 A 1 ATOM 2042 C CD1 . TRP A 1 251 ? -8.803 -3.718 -3.005 1.00 97.24 251 A 1 ATOM 2043 C CD2 . TRP A 1 251 ? -10.808 -2.941 -3.633 1.00 97.85 251 A 1 ATOM 2044 N NE1 . TRP A 1 251 ? -9.330 -2.941 -1.974 1.00 96.95 251 A 1 ATOM 2045 C CE2 . TRP A 1 251 ? -10.559 -2.459 -2.314 1.00 97.45 251 A 1 ATOM 2046 C CE3 . TRP A 1 251 ? -12.023 -2.588 -4.253 1.00 97.45 251 A 1 ATOM 2047 C CZ2 . TRP A 1 251 ? -11.496 -1.660 -1.620 1.00 96.89 251 A 1 ATOM 2048 C CZ3 . TRP A 1 251 ? -12.952 -1.784 -3.558 1.00 96.63 251 A 1 ATOM 2049 C CH2 . TRP A 1 251 ? -12.684 -1.332 -2.259 1.00 96.34 251 A 1 ATOM 2050 N N . ALA A 1 252 ? -7.182 -6.842 -6.211 1.00 98.41 252 A 1 ATOM 2051 C CA . ALA A 1 252 ? -7.308 -8.225 -6.642 1.00 98.32 252 A 1 ATOM 2052 C C . ALA A 1 252 ? -8.482 -8.880 -5.891 1.00 98.41 252 A 1 ATOM 2053 O O . ALA A 1 252 ? -8.921 -8.381 -4.855 1.00 98.17 252 A 1 ATOM 2054 C CB . ALA A 1 252 ? -5.974 -8.939 -6.404 1.00 97.93 252 A 1 ATOM 2055 N N . VAL A 1 253 ? -9.000 -9.993 -6.409 1.00 98.42 253 A 1 ATOM 2056 C CA . VAL A 1 253 ? -10.191 -10.668 -5.873 1.00 98.48 253 A 1 ATOM 2057 C C . VAL A 1 253 ? -9.832 -12.086 -5.435 1.00 98.44 253 A 1 ATOM 2058 O O . VAL A 1 253 ? -9.160 -12.815 -6.164 1.00 98.30 253 A 1 ATOM 2059 C CB . VAL A 1 253 ? -11.340 -10.659 -6.897 1.00 98.42 253 A 1 ATOM 2060 C CG1 . VAL A 1 253 ? -12.641 -11.210 -6.304 1.00 98.05 253 A 1 ATOM 2061 C CG2 . VAL A 1 253 ? -11.637 -9.244 -7.418 1.00 98.02 253 A 1 ATOM 2062 N N . ALA A 1 254 ? -10.287 -12.479 -4.242 1.00 98.21 254 A 1 ATOM 2063 C CA . ALA A 1 254 ? -10.097 -13.824 -3.720 1.00 98.14 254 A 1 ATOM 2064 C C . ALA A 1 254 ? -10.830 -14.864 -4.590 1.00 98.31 254 A 1 ATOM 2065 O O . ALA A 1 254 ? -11.920 -14.590 -5.101 1.00 98.12 254 A 1 ATOM 2066 C CB . ALA A 1 254 ? -10.583 -13.877 -2.268 1.00 97.65 254 A 1 ATOM 2067 N N . PRO A 1 255 ? -10.268 -16.068 -4.759 1.00 98.39 255 A 1 ATOM 2068 C CA . PRO A 1 255 ? -10.882 -17.109 -5.576 1.00 98.27 255 A 1 ATOM 2069 C C . PRO A 1 255 ? -12.223 -17.571 -4.984 1.00 98.27 255 A 1 ATOM 2070 O O . PRO A 1 255 ? -12.317 -17.824 -3.778 1.00 97.79 255 A 1 ATOM 2071 C CB . PRO A 1 255 ? -9.848 -18.236 -5.636 1.00 97.67 255 A 1 ATOM 2072 C CG . PRO A 1 255 ? -9.027 -18.047 -4.359 1.00 95.88 255 A 1 ATOM 2073 C CD . PRO A 1 255 ? -9.004 -16.534 -4.189 1.00 97.93 255 A 1 ATOM 2074 N N . PRO A 1 256 ? -13.276 -17.725 -5.811 1.00 98.28 256 A 1 ATOM 2075 C CA . PRO A 1 256 ? -14.581 -18.163 -5.332 1.00 98.21 256 A 1 ATOM 2076 C C . PRO A 1 256 ? -14.561 -19.640 -4.921 1.00 97.88 256 A 1 ATOM 2077 O O . PRO A 1 256 ? -13.778 -20.451 -5.420 1.00 96.99 256 A 1 ATOM 2078 C CB . PRO A 1 256 ? -15.545 -17.895 -6.491 1.00 98.08 256 A 1 ATOM 2079 C CG . PRO A 1 256 ? -14.655 -18.093 -7.719 1.00 97.93 256 A 1 ATOM 2080 C CD . PRO A 1 256 ? -13.308 -17.535 -7.255 1.00 98.28 256 A 1 ATOM 2081 N N . LYS A 1 257 ? -15.501 -20.011 -4.042 1.00 97.86 257 A 1 ATOM 2082 C CA . LYS A 1 257 ? -15.670 -21.405 -3.586 1.00 97.32 257 A 1 ATOM 2083 C C . LYS A 1 257 ? -16.443 -22.269 -4.582 1.00 97.30 257 A 1 ATOM 2084 O O . LYS A 1 257 ? -16.329 -23.488 -4.556 1.00 95.09 257 A 1 ATOM 2085 C CB . LYS A 1 257 ? -16.360 -21.417 -2.216 1.00 96.24 257 A 1 ATOM 2086 C CG . LYS A 1 257 ? -15.508 -20.735 -1.133 1.00 90.60 257 A 1 ATOM 2087 C CD . LYS A 1 257 ? -16.221 -20.763 0.229 1.00 79.94 257 A 1 ATOM 2088 C CE . LYS A 1 257 ? -15.344 -20.031 1.251 1.00 71.94 257 A 1 ATOM 2089 N NZ . LYS A 1 257 ? -15.993 -19.925 2.581 1.00 59.90 257 A 1 ATOM 2090 N N . THR A 1 258 ? -17.260 -21.643 -5.438 1.00 96.15 258 A 1 ATOM 2091 C CA . THR A 1 258 ? -18.061 -22.332 -6.465 1.00 96.15 258 A 1 ATOM 2092 C C . THR A 1 258 ? -18.039 -21.550 -7.783 1.00 96.79 258 A 1 ATOM 2093 O O . THR A 1 258 ? -17.931 -20.320 -7.750 1.00 96.60 258 A 1 ATOM 2094 C CB . THR A 1 258 ? -19.528 -22.531 -6.036 1.00 95.81 258 A 1 ATOM 2095 O OG1 . THR A 1 258 ? -20.246 -21.322 -6.045 1.00 94.00 258 A 1 ATOM 2096 C CG2 . THR A 1 258 ? -19.698 -23.166 -4.655 1.00 92.96 258 A 1 ATOM 2097 N N . PRO A 1 259 ? -18.263 -22.201 -8.943 1.00 96.13 259 A 1 ATOM 2098 C CA . PRO A 1 259 ? -18.266 -21.533 -10.253 1.00 95.42 259 A 1 ATOM 2099 C C . PRO A 1 259 ? -19.329 -20.440 -10.432 1.00 95.88 259 A 1 ATOM 2100 O O . PRO A 1 259 ? -19.265 -19.654 -11.377 1.00 94.64 259 A 1 ATOM 2101 C CB . PRO A 1 259 ? -18.486 -22.659 -11.273 1.00 94.89 259 A 1 ATOM 2102 C CG . PRO A 1 259 ? -17.949 -23.901 -10.566 1.00 92.76 259 A 1 ATOM 2103 C CD . PRO A 1 259 ? -18.324 -23.643 -9.109 1.00 95.39 259 A 1 ATOM 2104 N N . THR A 1 260 ? -20.333 -20.392 -9.558 1.00 95.78 260 A 1 ATOM 2105 C CA . THR A 1 260 ? -21.461 -19.450 -9.645 1.00 95.89 260 A 1 ATOM 2106 C C . THR A 1 260 ? -21.573 -18.520 -8.437 1.00 96.72 260 A 1 ATOM 2107 O O . THR A 1 260 ? -22.575 -17.813 -8.318 1.00 95.52 260 A 1 ATOM 2108 C CB . THR A 1 260 ? -22.788 -20.189 -9.875 1.00 94.82 260 A 1 ATOM 2109 O OG1 . THR A 1 260 ? -23.065 -21.053 -8.795 1.00 91.90 260 A 1 ATOM 2110 C CG2 . THR A 1 260 ? -22.786 -21.023 -11.158 1.00 90.16 260 A 1 ATOM 2111 N N . GLN A 1 261 ? -20.591 -18.519 -7.519 1.00 97.66 261 A 1 ATOM 2112 C CA . GLN A 1 261 ? -20.552 -17.575 -6.397 1.00 97.85 261 A 1 ATOM 2113 C C . GLN A 1 261 ? -20.472 -16.139 -6.927 1.00 98.20 261 A 1 ATOM 2114 O O . GLN A 1 261 ? -21.330 -15.319 -6.604 1.00 97.74 261 A 1 ATOM 2115 C CB . GLN A 1 261 ? -19.369 -17.911 -5.480 1.00 97.36 261 A 1 ATOM 2116 C CG . GLN A 1 261 ? -19.241 -16.921 -4.300 1.00 95.62 261 A 1 ATOM 2117 C CD . GLN A 1 261 ? -18.045 -17.246 -3.405 1.00 95.61 261 A 1 ATOM 2118 O OE1 . GLN A 1 261 ? -17.767 -18.394 -3.095 1.00 90.14 261 A 1 ATOM 2119 N NE2 . GLN A 1 261 ? -17.302 -16.261 -2.968 1.00 87.96 261 A 1 ATOM 2120 N N . HIS A 1 262 ? -19.492 -15.875 -7.783 1.00 98.34 262 A 1 ATOM 2121 C CA . HIS A 1 262 ? -19.399 -14.626 -8.526 1.00 98.41 262 A 1 ATOM 2122 C C . HIS A 1 262 ? -20.318 -14.692 -9.754 1.00 98.31 262 A 1 ATOM 2123 O O . HIS A 1 262 ? -20.300 -15.673 -10.503 1.00 97.74 262 A 1 ATOM 2124 C CB . HIS A 1 262 ? -17.934 -14.363 -8.901 1.00 98.32 262 A 1 ATOM 2125 C CG . HIS A 1 262 ? -16.996 -14.214 -7.727 1.00 98.55 262 A 1 ATOM 2126 N ND1 . HIS A 1 262 ? -15.611 -14.263 -7.793 1.00 95.97 262 A 1 ATOM 2127 C CD2 . HIS A 1 262 ? -17.321 -13.994 -6.413 1.00 96.04 262 A 1 ATOM 2128 C CE1 . HIS A 1 262 ? -15.133 -14.082 -6.559 1.00 96.49 262 A 1 ATOM 2129 N NE2 . HIS A 1 262 ? -16.140 -13.919 -5.694 1.00 96.81 262 A 1 ATOM 2130 N N . LYS A 1 263 ? -21.149 -13.667 -9.953 1.00 98.63 263 A 1 ATOM 2131 C CA . LYS A 1 263 ? -22.111 -13.607 -11.060 1.00 98.58 263 A 1 ATOM 2132 C C . LYS A 1 263 ? -21.478 -12.901 -12.252 1.00 98.65 263 A 1 ATOM 2133 O O . LYS A 1 263 ? -21.517 -11.677 -12.337 1.00 98.33 263 A 1 ATOM 2134 C CB . LYS A 1 263 ? -23.420 -12.942 -10.607 1.00 98.26 263 A 1 ATOM 2135 C CG . LYS A 1 263 ? -24.147 -13.670 -9.462 1.00 92.80 263 A 1 ATOM 2136 C CD . LYS A 1 263 ? -24.515 -15.109 -9.820 1.00 80.95 263 A 1 ATOM 2137 C CE . LYS A 1 263 ? -25.269 -15.777 -8.669 1.00 74.77 263 A 1 ATOM 2138 N NZ . LYS A 1 263 ? -25.409 -17.230 -8.910 1.00 61.14 263 A 1 ATOM 2139 N N . TRP A 1 264 ? -20.881 -13.680 -13.145 1.00 98.54 264 A 1 ATOM 2140 C CA . TRP A 1 264 ? -20.174 -13.188 -14.321 1.00 98.61 264 A 1 ATOM 2141 C C . TRP A 1 264 ? -21.081 -13.075 -15.541 1.00 98.50 264 A 1 ATOM 2142 O O . TRP A 1 264 ? -21.848 -13.991 -15.841 1.00 98.23 264 A 1 ATOM 2143 C CB . TRP A 1 264 ? -18.983 -14.091 -14.609 1.00 98.62 264 A 1 ATOM 2144 C CG . TRP A 1 264 ? -17.838 -13.919 -13.661 1.00 98.74 264 A 1 ATOM 2145 C CD1 . TRP A 1 264 ? -17.521 -14.739 -12.636 1.00 98.59 264 A 1 ATOM 2146 C CD2 . TRP A 1 264 ? -16.857 -12.838 -13.640 1.00 98.76 264 A 1 ATOM 2147 N NE1 . TRP A 1 264 ? -16.397 -14.252 -11.982 1.00 98.58 264 A 1 ATOM 2148 C CE2 . TRP A 1 264 ? -15.960 -13.083 -12.569 1.00 98.70 264 A 1 ATOM 2149 C CE3 . TRP A 1 264 ? -16.649 -11.684 -14.428 1.00 98.74 264 A 1 ATOM 2150 C CZ2 . TRP A 1 264 ? -14.888 -12.208 -12.285 1.00 98.64 264 A 1 ATOM 2151 C CZ3 . TRP A 1 264 ? -15.577 -10.813 -14.142 1.00 98.57 264 A 1 ATOM 2152 C CH2 . TRP A 1 264 ? -14.711 -11.077 -13.080 1.00 98.53 264 A 1 ATOM 2153 N N . HIS A 1 265 ? -20.928 -11.974 -16.256 1.00 98.63 265 A 1 ATOM 2154 C CA . HIS A 1 265 ? -21.700 -11.615 -17.437 1.00 98.62 265 A 1 ATOM 2155 C C . HIS A 1 265 ? -20.784 -11.068 -18.535 1.00 98.60 265 A 1 ATOM 2156 O O . HIS A 1 265 ? -19.785 -10.411 -18.253 1.00 98.38 265 A 1 ATOM 2157 C CB . HIS A 1 265 ? -22.744 -10.571 -17.045 1.00 98.52 265 A 1 ATOM 2158 C CG . HIS A 1 265 ? -23.662 -11.012 -15.938 1.00 98.42 265 A 1 ATOM 2159 N ND1 . HIS A 1 265 ? -24.803 -11.770 -16.086 1.00 92.12 265 A 1 ATOM 2160 C CD2 . HIS A 1 265 ? -23.519 -10.781 -14.588 1.00 92.90 265 A 1 ATOM 2161 C CE1 . HIS A 1 265 ? -25.332 -11.975 -14.869 1.00 93.55 265 A 1 ATOM 2162 N NE2 . HIS A 1 265 ? -24.577 -11.393 -13.931 1.00 95.08 265 A 1 ATOM 2163 N N . TYR A 1 266 ? -21.144 -11.308 -19.796 1.00 98.51 266 A 1 ATOM 2164 C CA . TYR A 1 266 ? -20.538 -10.644 -20.952 1.00 98.34 266 A 1 ATOM 2165 C C . TYR A 1 266 ? -21.568 -10.524 -22.075 1.00 98.25 266 A 1 ATOM 2166 O O . TYR A 1 266 ? -22.594 -11.198 -22.057 1.00 97.95 266 A 1 ATOM 2167 C CB . TYR A 1 266 ? -19.276 -11.392 -21.414 1.00 98.07 266 A 1 ATOM 2168 C CG . TYR A 1 266 ? -19.505 -12.523 -22.396 1.00 97.99 266 A 1 ATOM 2169 C CD1 . TYR A 1 266 ? -20.173 -13.703 -22.000 1.00 97.65 266 A 1 ATOM 2170 C CD2 . TYR A 1 266 ? -19.066 -12.390 -23.726 1.00 97.62 266 A 1 ATOM 2171 C CE1 . TYR A 1 266 ? -20.405 -14.734 -22.924 1.00 97.06 266 A 1 ATOM 2172 C CE2 . TYR A 1 266 ? -19.289 -13.417 -24.660 1.00 97.00 266 A 1 ATOM 2173 C CZ . TYR A 1 266 ? -19.963 -14.587 -24.255 1.00 96.82 266 A 1 ATOM 2174 O OH . TYR A 1 266 ? -20.188 -15.583 -25.165 1.00 95.69 266 A 1 ATOM 2175 N N . VAL A 1 267 ? -21.300 -9.695 -23.075 1.00 98.19 267 A 1 ATOM 2176 C CA . VAL A 1 267 ? -22.111 -9.605 -24.294 1.00 98.07 267 A 1 ATOM 2177 C C . VAL A 1 267 ? -21.282 -10.052 -25.491 1.00 97.87 267 A 1 ATOM 2178 O O . VAL A 1 267 ? -20.234 -9.474 -25.789 1.00 97.48 267 A 1 ATOM 2179 C CB . VAL A 1 267 ? -22.717 -8.201 -24.447 1.00 97.84 267 A 1 ATOM 2180 C CG1 . VAL A 1 267 ? -23.309 -7.951 -25.831 1.00 96.96 267 A 1 ATOM 2181 C CG2 . VAL A 1 267 ? -23.858 -8.019 -23.436 1.00 96.94 267 A 1 ATOM 2182 N N . SER A 1 268 ? -21.736 -11.091 -26.186 1.00 97.40 268 A 1 ATOM 2183 C CA . SER A 1 268 ? -21.041 -11.638 -27.351 1.00 97.07 268 A 1 ATOM 2184 C C . SER A 1 268 ? -21.065 -10.682 -28.546 1.00 97.10 268 A 1 ATOM 2185 O O . SER A 1 268 ? -22.054 -9.983 -28.793 1.00 96.57 268 A 1 ATOM 2186 C CB . SER A 1 268 ? -21.617 -13.004 -27.744 1.00 96.11 268 A 1 ATOM 2187 O OG . SER A 1 268 ? -22.991 -12.904 -28.064 1.00 94.21 268 A 1 ATOM 2188 N N . GLY A 1 269 ? -19.977 -10.665 -29.319 1.00 96.87 269 A 1 ATOM 2189 C CA . GLY A 1 269 ? -19.898 -9.948 -30.592 1.00 96.68 269 A 1 ATOM 2190 C C . GLY A 1 269 ? -20.168 -8.443 -30.507 1.00 97.10 269 A 1 ATOM 2191 O O . GLY A 1 269 ? -20.751 -7.888 -31.438 1.00 96.36 269 A 1 ATOM 2192 N N . MET A 1 270 ? -19.770 -7.789 -29.409 1.00 97.17 270 A 1 ATOM 2193 C CA . MET A 1 270 ? -19.847 -6.327 -29.285 1.00 97.61 270 A 1 ATOM 2194 C C . MET A 1 270 ? -19.162 -5.638 -30.468 1.00 97.62 270 A 1 ATOM 2195 O O . MET A 1 270 ? -18.129 -6.100 -30.955 1.00 97.43 270 A 1 ATOM 2196 C CB . MET A 1 270 ? -19.222 -5.838 -27.975 1.00 97.87 270 A 1 ATOM 2197 C CG . MET A 1 270 ? -20.108 -6.097 -26.755 1.00 97.10 270 A 1 ATOM 2198 S SD . MET A 1 270 ? -19.450 -5.396 -25.211 1.00 97.29 270 A 1 ATOM 2199 C CE . MET A 1 270 ? -19.634 -3.626 -25.536 1.00 94.72 270 A 1 ATOM 2200 N N . THR A 1 271 ? -19.734 -4.528 -30.910 1.00 97.44 271 A 1 ATOM 2201 C CA . THR A 1 271 ? -19.269 -3.744 -32.061 1.00 97.38 271 A 1 ATOM 2202 C C . THR A 1 271 ? -18.741 -2.378 -31.627 1.00 97.80 271 A 1 ATOM 2203 O O . THR A 1 271 ? -18.941 -1.947 -30.493 1.00 97.54 271 A 1 ATOM 2204 C CB . THR A 1 271 ? -20.383 -3.567 -33.107 1.00 96.38 271 A 1 ATOM 2205 O OG1 . THR A 1 271 ? -21.435 -2.800 -32.585 1.00 92.50 271 A 1 ATOM 2206 C CG2 . THR A 1 271 ? -20.957 -4.894 -33.598 1.00 91.71 271 A 1 ATOM 2207 N N . GLU A 1 272 ? -18.107 -1.662 -32.543 1.00 97.60 272 A 1 ATOM 2208 C CA . GLU A 1 272 ? -17.611 -0.297 -32.349 1.00 97.54 272 A 1 ATOM 2209 C C . GLU A 1 272 ? -18.711 0.738 -32.025 1.00 97.76 272 A 1 ATOM 2210 O O . GLU A 1 272 ? -18.424 1.800 -31.473 1.00 96.70 272 A 1 ATOM 2211 C CB . GLU A 1 272 ? -16.796 0.117 -33.588 1.00 96.41 272 A 1 ATOM 2212 C CG . GLU A 1 272 ? -17.558 0.183 -34.926 1.00 90.87 272 A 1 ATOM 2213 C CD . GLU A 1 272 ? -17.726 -1.153 -35.684 1.00 90.94 272 A 1 ATOM 2214 O OE1 . GLU A 1 272 ? -18.072 -1.091 -36.886 1.00 83.63 272 A 1 ATOM 2215 O OE2 . GLU A 1 272 ? -17.531 -2.241 -35.092 1.00 85.09 272 A 1 ATOM 2216 N N . ASP A 1 273 ? -19.979 0.403 -32.293 1.00 97.55 273 A 1 ATOM 2217 C CA . ASP A 1 273 ? -21.157 1.208 -31.939 1.00 97.33 273 A 1 ATOM 2218 C C . ASP A 1 273 ? -21.712 0.892 -30.534 1.00 97.64 273 A 1 ATOM 2219 O O . ASP A 1 273 ? -22.728 1.461 -30.114 1.00 96.30 273 A 1 ATOM 2220 C CB . ASP A 1 273 ? -22.253 1.001 -32.997 1.00 95.96 273 A 1 ATOM 2221 C CG . ASP A 1 273 ? -22.080 1.767 -34.310 1.00 92.23 273 A 1 ATOM 2222 O OD1 . ASP A 1 273 ? -21.329 2.757 -34.381 1.00 87.75 273 A 1 ATOM 2223 O OD2 . ASP A 1 273 ? -22.878 1.505 -35.243 1.00 86.80 273 A 1 ATOM 2224 N N . GLU A 1 274 ? -21.078 -0.032 -29.801 1.00 97.86 274 A 1 ATOM 2225 C CA . GLU A 1 274 ? -21.453 -0.427 -28.443 1.00 97.97 274 A 1 ATOM 2226 C C . GLU A 1 274 ? -20.346 -0.056 -27.446 1.00 98.22 274 A 1 ATOM 2227 O O . GLU A 1 274 ? -19.163 -0.024 -27.772 1.00 97.84 274 A 1 ATOM 2228 C CB . GLU A 1 274 ? -21.777 -1.934 -28.390 1.00 97.29 274 A 1 ATOM 2229 C CG . GLU A 1 274 ? -23.032 -2.309 -29.208 1.00 96.03 274 A 1 ATOM 2230 C CD . GLU A 1 274 ? -23.346 -3.818 -29.169 1.00 96.61 274 A 1 ATOM 2231 O OE1 . GLU A 1 274 ? -24.487 -4.200 -28.828 1.00 92.00 274 A 1 ATOM 2232 O OE2 . GLU A 1 274 ? -22.468 -4.646 -29.491 1.00 92.99 274 A 1 ATOM 2233 N N . ALA A 1 275 ? -20.726 0.202 -26.194 1.00 98.13 275 A 1 ATOM 2234 C CA . ALA A 1 275 ? -19.779 0.359 -25.101 1.00 98.26 275 A 1 ATOM 2235 C C . ALA A 1 275 ? -20.287 -0.333 -23.830 1.00 98.45 275 A 1 ATOM 2236 O O . ALA A 1 275 ? -21.489 -0.417 -23.585 1.00 98.23 275 A 1 ATOM 2237 C CB . ALA A 1 275 ? -19.485 1.848 -24.875 1.00 97.91 275 A 1 ATOM 2238 N N . LEU A 1 276 ? -19.342 -0.803 -23.008 1.00 98.44 276 A 1 ATOM 2239 C CA . LEU A 1 276 ? -19.580 -1.316 -21.669 1.00 98.59 276 A 1 ATOM 2240 C C . LEU A 1 276 ? -19.077 -0.283 -20.660 1.00 98.70 276 A 1 ATOM 2241 O O . LEU A 1 276 ? -17.893 0.041 -20.634 1.00 98.61 276 A 1 ATOM 2242 C CB . LEU A 1 276 ? -18.887 -2.683 -21.546 1.00 98.55 276 A 1 ATOM 2243 C CG . LEU A 1 276 ? -18.860 -3.282 -20.134 1.00 98.18 276 A 1 ATOM 2244 C CD1 . LEU A 1 276 ? -20.259 -3.480 -19.556 1.00 97.81 276 A 1 ATOM 2245 C CD2 . LEU A 1 276 ? -18.158 -4.638 -20.182 1.00 97.77 276 A 1 ATOM 2246 N N . LEU A 1 277 ? -19.983 0.229 -19.844 1.00 98.48 277 A 1 ATOM 2247 C CA . LEU A 1 277 ? -19.674 1.135 -18.748 1.00 98.54 277 A 1 ATOM 2248 C C . LEU A 1 277 ? -19.404 0.297 -17.501 1.00 98.65 277 A 1 ATOM 2249 O O . LEU A 1 277 ? -20.276 -0.471 -17.093 1.00 98.52 277 A 1 ATOM 2250 C CB . LEU A 1 277 ? -20.839 2.107 -18.520 1.00 98.43 277 A 1 ATOM 2251 C CG . LEU A 1 277 ? -21.392 2.805 -19.778 1.00 97.43 277 A 1 ATOM 2252 C CD1 . LEU A 1 277 ? -22.471 3.808 -19.373 1.00 96.52 277 A 1 ATOM 2253 C CD2 . LEU A 1 277 ? -20.307 3.545 -20.555 1.00 96.25 277 A 1 ATOM 2254 N N . ILE A 1 278 ? -18.229 0.440 -16.889 1.00 98.77 278 A 1 ATOM 2255 C CA . ILE A 1 278 ? -17.807 -0.348 -15.728 1.00 98.82 278 A 1 ATOM 2256 C C . ILE A 1 278 ? -17.490 0.605 -14.577 1.00 98.80 278 A 1 ATOM 2257 O O . ILE A 1 278 ? -16.567 1.417 -14.675 1.00 98.61 278 A 1 ATOM 2258 C CB . ILE A 1 278 ? -16.596 -1.247 -16.056 1.00 98.76 278 A 1 ATOM 2259 C CG1 . ILE A 1 278 ? -16.758 -2.019 -17.391 1.00 98.38 278 A 1 ATOM 2260 C CG2 . ILE A 1 278 ? -16.375 -2.228 -14.891 1.00 98.27 278 A 1 ATOM 2261 C CD1 . ILE A 1 278 ? -15.513 -2.815 -17.800 1.00 97.84 278 A 1 ATOM 2262 N N . LYS A 1 279 ? -18.227 0.501 -13.477 1.00 98.68 279 A 1 ATOM 2263 C CA . LYS A 1 279 ? -17.998 1.327 -12.294 1.00 98.64 279 A 1 ATOM 2264 C C . LYS A 1 279 ? -16.800 0.805 -11.509 1.00 98.71 279 A 1 ATOM 2265 O O . LYS A 1 279 ? -16.833 -0.306 -10.990 1.00 98.38 279 A 1 ATOM 2266 C CB . LYS A 1 279 ? -19.283 1.389 -11.459 1.00 98.03 279 A 1 ATOM 2267 C CG . LYS A 1 279 ? -19.225 2.517 -10.417 1.00 95.17 279 A 1 ATOM 2268 C CD . LYS A 1 279 ? -20.456 2.538 -9.505 1.00 94.22 279 A 1 ATOM 2269 C CE . LYS A 1 279 ? -21.745 2.939 -10.235 1.00 93.08 279 A 1 ATOM 2270 N NZ . LYS A 1 279 ? -22.884 3.011 -9.288 1.00 92.79 279 A 1 ATOM 2271 N N . MET A 1 280 ? -15.754 1.631 -11.388 1.00 98.58 280 A 1 ATOM 2272 C CA . MET A 1 280 ? -14.538 1.317 -10.619 1.00 98.44 280 A 1 ATOM 2273 C C . MET A 1 280 ? -14.580 1.870 -9.195 1.00 98.33 280 A 1 ATOM 2274 O O . MET A 1 280 ? -13.911 1.361 -8.308 1.00 97.48 280 A 1 ATOM 2275 C CB . MET A 1 280 ? -13.314 1.843 -11.368 1.00 98.11 280 A 1 ATOM 2276 C CG . MET A 1 280 ? -13.176 1.251 -12.773 1.00 97.27 280 A 1 ATOM 2277 S SD . MET A 1 280 ? -13.152 -0.556 -12.819 1.00 96.33 280 A 1 ATOM 2278 C CE . MET A 1 280 ? -13.087 -0.811 -14.595 1.00 92.41 280 A 1 ATOM 2279 N N . PHE A 1 281 ? -15.385 2.902 -8.987 1.00 98.30 281 A 1 ATOM 2280 C CA . PHE A 1 281 ? -15.660 3.505 -7.683 1.00 98.19 281 A 1 ATOM 2281 C C . PHE A 1 281 ? -17.009 4.233 -7.714 1.00 98.23 281 A 1 ATOM 2282 O O . PHE A 1 281 ? -17.421 4.738 -8.756 1.00 98.07 281 A 1 ATOM 2283 C CB . PHE A 1 281 ? -14.517 4.474 -7.335 1.00 98.00 281 A 1 ATOM 2284 C CG . PHE A 1 281 ? -14.728 5.256 -6.060 1.00 97.96 281 A 1 ATOM 2285 C CD1 . PHE A 1 281 ? -15.152 6.597 -6.109 1.00 97.61 281 A 1 ATOM 2286 C CD2 . PHE A 1 281 ? -14.526 4.640 -4.816 1.00 97.63 281 A 1 ATOM 2287 C CE1 . PHE A 1 281 ? -15.364 7.319 -4.923 1.00 97.18 281 A 1 ATOM 2288 C CE2 . PHE A 1 281 ? -14.735 5.358 -3.627 1.00 97.25 281 A 1 ATOM 2289 C CZ . PHE A 1 281 ? -15.155 6.696 -3.680 1.00 97.16 281 A 1 ATOM 2290 N N . ASP A 1 282 ? -17.682 4.310 -6.575 1.00 97.94 282 A 1 ATOM 2291 C CA . ASP A 1 282 ? -18.767 5.261 -6.305 1.00 97.82 282 A 1 ATOM 2292 C C . ASP A 1 282 ? -18.674 5.677 -4.832 1.00 97.62 282 A 1 ATOM 2293 O O . ASP A 1 282 ? -18.428 4.833 -3.967 1.00 97.11 282 A 1 ATOM 2294 C CB . ASP A 1 282 ? -20.134 4.637 -6.657 1.00 97.68 282 A 1 ATOM 2295 C CG . ASP A 1 282 ? -21.297 5.637 -6.783 1.00 97.57 282 A 1 ATOM 2296 O OD1 . ASP A 1 282 ? -21.355 6.622 -6.022 1.00 96.70 282 A 1 ATOM 2297 O OD2 . ASP A 1 282 ? -22.176 5.423 -7.652 1.00 96.26 282 A 1 ATOM 2298 N N . SER A 1 283 ? -18.830 6.962 -4.536 1.00 97.69 283 A 1 ATOM 2299 C CA . SER A 1 283 ? -18.767 7.475 -3.163 1.00 97.35 283 A 1 ATOM 2300 C C . SER A 1 283 ? -19.965 7.050 -2.307 1.00 96.87 283 A 1 ATOM 2301 O O . SER A 1 283 ? -19.840 6.991 -1.086 1.00 95.83 283 A 1 ATOM 2302 C CB . SER A 1 283 ? -18.622 9.000 -3.169 1.00 97.14 283 A 1 ATOM 2303 O OG . SER A 1 283 ? -19.750 9.624 -3.755 1.00 96.69 283 A 1 ATOM 2304 N N . LYS A 1 284 ? -21.101 6.706 -2.930 1.00 96.52 284 A 1 ATOM 2305 C CA . LYS A 1 284 ? -22.308 6.256 -2.230 1.00 95.95 284 A 1 ATOM 2306 C C . LYS A 1 284 ? -22.080 4.978 -1.429 1.00 96.06 284 A 1 ATOM 2307 O O . LYS A 1 284 ? -21.453 4.038 -1.900 1.00 94.79 284 A 1 ATOM 2308 C CB . LYS A 1 284 ? -23.459 6.047 -3.217 1.00 94.53 284 A 1 ATOM 2309 C CG . LYS A 1 284 ? -24.248 7.342 -3.461 1.00 88.61 284 A 1 ATOM 2310 C CD . LYS A 1 284 ? -25.521 6.999 -4.239 1.00 84.79 284 A 1 ATOM 2311 C CE . LYS A 1 284 ? -26.599 8.064 -4.047 1.00 80.92 284 A 1 ATOM 2312 N NZ . LYS A 1 284 ? -27.930 7.442 -4.192 1.00 73.16 284 A 1 ATOM 2313 N N . LYS A 1 285 ? -22.666 4.939 -0.223 1.00 95.88 285 A 1 ATOM 2314 C CA . LYS A 1 285 ? -22.625 3.804 0.712 1.00 95.21 285 A 1 ATOM 2315 C C . LYS A 1 285 ? -24.027 3.260 1.047 1.00 95.28 285 A 1 ATOM 2316 O O . LYS A 1 285 ? -24.177 2.476 1.966 1.00 93.09 285 A 1 ATOM 2317 C CB . LYS A 1 285 ? -21.854 4.212 1.979 1.00 93.50 285 A 1 ATOM 2318 C CG . LYS A 1 285 ? -20.407 4.665 1.716 1.00 91.34 285 A 1 ATOM 2319 C CD . LYS A 1 285 ? -19.747 5.062 3.040 1.00 87.01 285 A 1 ATOM 2320 C CE . LYS A 1 285 ? -18.332 5.607 2.844 1.00 80.92 285 A 1 ATOM 2321 N NZ . LYS A 1 285 ? -17.752 6.037 4.141 1.00 72.77 285 A 1 ATOM 2322 N N . ASP A 1 286 ? -25.048 3.650 0.283 1.00 95.11 286 A 1 ATOM 2323 C CA . ASP A 1 286 ? -26.469 3.333 0.511 1.00 94.61 286 A 1 ATOM 2324 C C . ASP A 1 286 ? -26.923 1.976 -0.074 1.00 95.11 286 A 1 ATOM 2325 O O . ASP A 1 286 ? -28.119 1.701 -0.178 1.00 92.50 286 A 1 ATOM 2326 C CB . ASP A 1 286 ? -27.325 4.501 -0.025 1.00 92.84 286 A 1 ATOM 2327 C CG . ASP A 1 286 ? -27.258 4.699 -1.552 1.00 92.76 286 A 1 ATOM 2328 O OD1 . ASP A 1 286 ? -26.499 3.977 -2.237 1.00 90.55 286 A 1 ATOM 2329 O OD2 . ASP A 1 286 ? -27.929 5.619 -2.078 1.00 89.44 286 A 1 ATOM 2330 N N . GLY A 1 287 ? -25.979 1.118 -0.468 1.00 95.28 287 A 1 ATOM 2331 C CA . GLY A 1 287 ? -26.242 -0.142 -1.174 1.00 95.41 287 A 1 ATOM 2332 C C . GLY A 1 287 ? -26.142 -0.040 -2.700 1.00 96.55 287 A 1 ATOM 2333 O O . GLY A 1 287 ? -26.178 -1.073 -3.377 1.00 95.34 287 A 1 ATOM 2334 N N . THR A 1 288 ? -25.960 1.156 -3.249 1.00 96.63 288 A 1 ATOM 2335 C CA . THR A 1 288 ? -25.581 1.347 -4.653 1.00 97.00 288 A 1 ATOM 2336 C C . THR A 1 288 ? -24.273 0.605 -4.942 1.00 97.45 288 A 1 ATOM 2337 O O . THR A 1 288 ? -23.329 0.657 -4.152 1.00 96.72 288 A 1 ATOM 2338 C CB . THR A 1 288 ? -25.424 2.843 -4.970 1.00 96.10 288 A 1 ATOM 2339 O OG1 . THR A 1 288 ? -26.659 3.504 -4.792 1.00 90.33 288 A 1 ATOM 2340 C CG2 . THR A 1 288 ? -25.004 3.131 -6.405 1.00 89.84 288 A 1 ATOM 2341 N N . ALA A 1 289 ? -24.185 -0.065 -6.095 1.00 97.77 289 A 1 ATOM 2342 C CA . ALA A 1 289 ? -22.959 -0.732 -6.513 1.00 98.08 289 A 1 ATOM 2343 C C . ALA A 1 289 ? -21.790 0.262 -6.577 1.00 98.14 289 A 1 ATOM 2344 O O . ALA A 1 289 ? -21.896 1.315 -7.206 1.00 97.76 289 A 1 ATOM 2345 C CB . ALA A 1 289 ? -23.191 -1.412 -7.860 1.00 97.97 289 A 1 ATOM 2346 N N . ARG A 1 290 ? -20.661 -0.079 -5.941 1.00 98.16 290 A 1 ATOM 2347 C CA . ARG A 1 290 ? -19.491 0.812 -5.819 1.00 98.04 290 A 1 ATOM 2348 C C . ARG A 1 290 ? -18.323 0.417 -6.715 1.00 98.11 290 A 1 ATOM 2349 O O . ARG A 1 290 ? -17.513 1.274 -7.053 1.00 97.50 290 A 1 ATOM 2350 C CB . ARG A 1 290 ? -19.035 0.887 -4.355 1.00 97.48 290 A 1 ATOM 2351 C CG . ARG A 1 290 ? -20.125 1.437 -3.422 1.00 96.71 290 A 1 ATOM 2352 C CD . ARG A 1 290 ? -19.588 1.681 -2.013 1.00 95.86 290 A 1 ATOM 2353 N NE . ARG A 1 290 ? -18.670 2.833 -1.984 1.00 95.36 290 A 1 ATOM 2354 C CZ . ARG A 1 290 ? -17.846 3.168 -0.999 1.00 95.36 290 A 1 ATOM 2355 N NH1 . ARG A 1 290 ? -17.755 2.464 0.095 1.00 92.08 290 A 1 ATOM 2356 N NH2 . ARG A 1 290 ? -17.103 4.226 -1.101 1.00 91.99 290 A 1 ATOM 2357 N N . ARG A 1 291 ? -18.218 -0.851 -7.086 1.00 97.84 291 A 1 ATOM 2358 C CA . ARG A 1 291 ? -17.094 -1.407 -7.856 1.00 97.89 291 A 1 ATOM 2359 C C . ARG A 1 291 ? -17.512 -2.693 -8.565 1.00 98.29 291 A 1 ATOM 2360 O O . ARG A 1 291 ? -18.385 -3.410 -8.087 1.00 98.02 291 A 1 ATOM 2361 C CB . ARG A 1 291 ? -15.866 -1.624 -6.941 1.00 96.63 291 A 1 ATOM 2362 C CG . ARG A 1 291 ? -15.980 -2.771 -5.916 1.00 95.29 291 A 1 ATOM 2363 C CD . ARG A 1 291 ? -17.027 -2.487 -4.812 1.00 93.87 291 A 1 ATOM 2364 N NE . ARG A 1 291 ? -17.112 -3.565 -3.820 1.00 94.62 291 A 1 ATOM 2365 C CZ . ARG A 1 291 ? -17.846 -4.656 -3.876 1.00 95.52 291 A 1 ATOM 2366 N NH1 . ARG A 1 291 ? -18.562 -4.978 -4.916 1.00 89.95 291 A 1 ATOM 2367 N NH2 . ARG A 1 291 ? -17.883 -5.450 -2.843 1.00 91.63 291 A 1 ATOM 2368 N N . VAL A 1 292 ? -16.824 -2.998 -9.683 1.00 98.59 292 A 1 ATOM 2369 C CA . VAL A 1 292 ? -17.088 -4.177 -10.522 1.00 98.67 292 A 1 ATOM 2370 C C . VAL A 1 292 ? -15.791 -4.939 -10.770 1.00 98.70 292 A 1 ATOM 2371 O O . VAL A 1 292 ? -14.929 -4.426 -11.486 1.00 98.53 292 A 1 ATOM 2372 C CB . VAL A 1 292 ? -17.724 -3.747 -11.854 1.00 98.51 292 A 1 ATOM 2373 C CG1 . VAL A 1 292 ? -17.846 -4.900 -12.851 1.00 97.96 292 A 1 ATOM 2374 C CG2 . VAL A 1 292 ? -19.126 -3.185 -11.625 1.00 97.93 292 A 1 ATOM 2375 N N . PRO A 1 293 ? -15.632 -6.157 -10.240 1.00 98.79 293 A 1 ATOM 2376 C CA . PRO A 1 293 ? -14.590 -7.056 -10.717 1.00 98.79 293 A 1 ATOM 2377 C C . PRO A 1 293 ? -14.796 -7.396 -12.193 1.00 98.80 293 A 1 ATOM 2378 O O . PRO A 1 293 ? -15.918 -7.648 -12.628 1.00 98.68 293 A 1 ATOM 2379 C CB . PRO A 1 293 ? -14.652 -8.294 -9.829 1.00 98.67 293 A 1 ATOM 2380 C CG . PRO A 1 293 ? -15.336 -7.776 -8.565 1.00 98.16 293 A 1 ATOM 2381 C CD . PRO A 1 293 ? -16.310 -6.736 -9.108 1.00 98.67 293 A 1 ATOM 2382 N N . HIS A 1 294 ? -13.709 -7.422 -12.956 1.00 98.88 294 A 1 ATOM 2383 C CA . HIS A 1 294 ? -13.759 -7.718 -14.382 1.00 98.89 294 A 1 ATOM 2384 C C . HIS A 1 294 ? -12.478 -8.409 -14.858 1.00 98.83 294 A 1 ATOM 2385 O O . HIS A 1 294 ? -11.425 -8.297 -14.235 1.00 98.62 294 A 1 ATOM 2386 C CB . HIS A 1 294 ? -14.072 -6.438 -15.175 1.00 98.85 294 A 1 ATOM 2387 C CG . HIS A 1 294 ? -13.106 -5.310 -14.960 1.00 98.86 294 A 1 ATOM 2388 N ND1 . HIS A 1 294 ? -13.009 -4.537 -13.819 1.00 98.53 294 A 1 ATOM 2389 C CD2 . HIS A 1 294 ? -12.168 -4.849 -15.843 1.00 98.40 294 A 1 ATOM 2390 C CE1 . HIS A 1 294 ? -12.036 -3.637 -14.019 1.00 98.36 294 A 1 ATOM 2391 N NE2 . HIS A 1 294 ? -11.510 -3.791 -15.238 1.00 98.41 294 A 1 ATOM 2392 N N . SER A 1 295 ? -12.591 -9.154 -15.966 1.00 98.76 295 A 1 ATOM 2393 C CA . SER A 1 295 ? -11.477 -9.847 -16.618 1.00 98.72 295 A 1 ATOM 2394 C C . SER A 1 295 ? -11.825 -10.153 -18.069 1.00 98.71 295 A 1 ATOM 2395 O O . SER A 1 295 ? -12.963 -10.508 -18.376 1.00 98.52 295 A 1 ATOM 2396 C CB . SER A 1 295 ? -11.167 -11.157 -15.886 1.00 98.58 295 A 1 ATOM 2397 O OG . SER A 1 295 ? -10.055 -11.817 -16.462 1.00 98.24 295 A 1 ATOM 2398 N N . SER A 1 296 ? -10.829 -10.057 -18.959 1.00 98.57 296 A 1 ATOM 2399 C CA . SER A 1 296 ? -10.958 -10.677 -20.275 1.00 98.50 296 A 1 ATOM 2400 C C . SER A 1 296 ? -10.767 -12.189 -20.170 1.00 98.44 296 A 1 ATOM 2401 O O . SER A 1 296 ? -10.133 -12.674 -19.232 1.00 98.07 296 A 1 ATOM 2402 C CB . SER A 1 296 ? -9.971 -10.075 -21.268 1.00 98.17 296 A 1 ATOM 2403 O OG . SER A 1 296 ? -10.275 -8.704 -21.446 1.00 94.40 296 A 1 ATOM 2404 N N . PHE A 1 297 ? -11.281 -12.925 -21.147 1.00 98.02 297 A 1 ATOM 2405 C CA . PHE A 1 297 ? -11.147 -14.379 -21.191 1.00 97.91 297 A 1 ATOM 2406 C C . PHE A 1 297 ? -11.117 -14.903 -22.627 1.00 97.71 297 A 1 ATOM 2407 O O . PHE A 1 297 ? -11.861 -14.404 -23.472 1.00 97.35 297 A 1 ATOM 2408 C CB . PHE A 1 297 ? -12.280 -15.028 -20.387 1.00 97.85 297 A 1 ATOM 2409 C CG . PHE A 1 297 ? -13.678 -14.818 -20.940 1.00 98.05 297 A 1 ATOM 2410 C CD1 . PHE A 1 297 ? -14.343 -13.587 -20.776 1.00 97.65 297 A 1 ATOM 2411 C CD2 . PHE A 1 297 ? -14.335 -15.864 -21.614 1.00 97.64 297 A 1 ATOM 2412 C CE1 . PHE A 1 297 ? -15.642 -13.406 -21.277 1.00 97.27 297 A 1 ATOM 2413 C CE2 . PHE A 1 297 ? -15.636 -15.690 -22.113 1.00 97.24 297 A 1 ATOM 2414 C CZ . PHE A 1 297 ? -16.292 -14.459 -21.945 1.00 97.35 297 A 1 ATOM 2415 N N . PRO A 1 298 ? -10.278 -15.916 -22.933 1.00 97.27 298 A 1 ATOM 2416 C CA . PRO A 1 298 ? -10.376 -16.645 -24.188 1.00 96.68 298 A 1 ATOM 2417 C C . PRO A 1 298 ? -11.610 -17.557 -24.168 1.00 96.74 298 A 1 ATOM 2418 O O . PRO A 1 298 ? -12.054 -18.015 -23.111 1.00 95.84 298 A 1 ATOM 2419 C CB . PRO A 1 298 ? -9.072 -17.433 -24.290 1.00 95.31 298 A 1 ATOM 2420 C CG . PRO A 1 298 ? -8.739 -17.727 -22.831 1.00 92.92 298 A 1 ATOM 2421 C CD . PRO A 1 298 ? -9.249 -16.493 -22.088 1.00 95.85 298 A 1 ATOM 2422 N N . THR A 1 299 ? -12.144 -17.853 -25.349 1.00 96.23 299 A 1 ATOM 2423 C CA . THR A 1 299 ? -13.216 -18.843 -25.518 1.00 96.00 299 A 1 ATOM 2424 C C . THR A 1 299 ? -12.780 -19.951 -26.483 1.00 95.95 299 A 1 ATOM 2425 O O . THR A 1 299 ? -11.895 -19.736 -27.310 1.00 95.47 299 A 1 ATOM 2426 C CB . THR A 1 299 ? -14.543 -18.220 -25.983 1.00 95.32 299 A 1 ATOM 2427 O OG1 . THR A 1 299 ? -14.579 -18.042 -27.375 1.00 91.98 299 A 1 ATOM 2428 C CG2 . THR A 1 299 ? -14.872 -16.887 -25.311 1.00 92.03 299 A 1 ATOM 2429 N N . PRO A 1 300 ? -13.403 -21.136 -26.442 1.00 94.97 300 A 1 ATOM 2430 C CA . PRO A 1 300 ? -13.144 -22.190 -27.429 1.00 94.35 300 A 1 ATOM 2431 C C . PRO A 1 300 ? -13.527 -21.823 -28.866 1.00 94.46 300 A 1 ATOM 2432 O O . PRO A 1 300 ? -13.131 -22.528 -29.794 1.00 93.09 300 A 1 ATOM 2433 C CB . PRO A 1 300 ? -13.963 -23.395 -26.957 1.00 93.20 300 A 1 ATOM 2434 C CG . PRO A 1 300 ? -14.191 -23.132 -25.473 1.00 90.99 300 A 1 ATOM 2435 C CD . PRO A 1 300 ? -14.295 -21.614 -25.408 1.00 94.45 300 A 1 ATOM 2436 N N . ASP A 1 301 ? -14.316 -20.767 -29.059 1.00 95.13 301 A 1 ATOM 2437 C CA . ASP A 1 301 ? -14.822 -20.323 -30.361 1.00 95.02 301 A 1 ATOM 2438 C C . ASP A 1 301 ? -14.119 -19.043 -30.859 1.00 95.31 301 A 1 ATOM 2439 O O . ASP A 1 301 ? -14.571 -18.431 -31.832 1.00 94.11 301 A 1 ATOM 2440 C CB . ASP A 1 301 ? -16.343 -20.131 -30.286 1.00 94.22 301 A 1 ATOM 2441 C CG . ASP A 1 301 ? -17.099 -21.326 -29.694 1.00 93.42 301 A 1 ATOM 2442 O OD1 . ASP A 1 301 ? -17.190 -22.418 -30.296 1.00 90.51 301 A 1 ATOM 2443 O OD2 . ASP A 1 301 ? -17.685 -21.170 -28.604 1.00 90.56 301 A 1 ATOM 2444 N N . ASP A 1 302 ? -13.024 -18.625 -30.207 1.00 95.94 302 A 1 ATOM 2445 C CA . ASP A 1 302 ? -12.245 -17.451 -30.602 1.00 95.81 302 A 1 ATOM 2446 C C . ASP A 1 302 ? -11.665 -17.617 -32.014 1.00 95.61 302 A 1 ATOM 2447 O O . ASP A 1 302 ? -11.114 -18.663 -32.373 1.00 94.42 302 A 1 ATOM 2448 C CB . ASP A 1 302 ? -11.119 -17.178 -29.588 1.00 95.64 302 A 1 ATOM 2449 C CG . ASP A 1 302 ? -11.581 -16.506 -28.287 1.00 95.66 302 A 1 ATOM 2450 O OD1 . ASP A 1 302 ? -12.758 -16.095 -28.181 1.00 94.30 302 A 1 ATOM 2451 O OD2 . ASP A 1 302 ? -10.730 -16.346 -27.387 1.00 94.19 302 A 1 ATOM 2452 N N . PHE A 1 303 ? -11.772 -16.563 -32.832 1.00 95.30 303 A 1 ATOM 2453 C CA . PHE A 1 303 ? -11.262 -16.536 -34.202 1.00 95.24 303 A 1 ATOM 2454 C C . PHE A 1 303 ? -10.925 -15.112 -34.666 1.00 95.56 303 A 1 ATOM 2455 O O . PHE A 1 303 ? -11.255 -14.127 -34.002 1.00 94.92 303 A 1 ATOM 2456 C CB . PHE A 1 303 ? -12.277 -17.198 -35.152 1.00 94.34 303 A 1 ATOM 2457 C CG . PHE A 1 303 ? -13.543 -16.400 -35.398 1.00 93.95 303 A 1 ATOM 2458 C CD1 . PHE A 1 303 ? -14.644 -16.536 -34.532 1.00 92.43 303 A 1 ATOM 2459 C CD2 . PHE A 1 303 ? -13.632 -15.521 -36.493 1.00 92.38 303 A 1 ATOM 2460 C CE1 . PHE A 1 303 ? -15.817 -15.799 -34.755 1.00 91.03 303 A 1 ATOM 2461 C CE2 . PHE A 1 303 ? -14.805 -14.777 -36.721 1.00 91.28 303 A 1 ATOM 2462 C CZ . PHE A 1 303 ? -15.898 -14.916 -35.850 1.00 90.62 303 A 1 ATOM 2463 N N . GLY A 1 304 ? -10.323 -15.003 -35.847 1.00 94.61 304 A 1 ATOM 2464 C CA . GLY A 1 304 ? -10.059 -13.736 -36.520 1.00 94.39 304 A 1 ATOM 2465 C C . GLY A 1 304 ? -8.815 -13.012 -36.020 1.00 95.46 304 A 1 ATOM 2466 O O . GLY A 1 304 ? -7.964 -13.580 -35.339 1.00 94.44 304 A 1 ATOM 2467 N N . GLU A 1 305 ? -8.705 -11.732 -36.375 1.00 95.97 305 A 1 ATOM 2468 C CA . GLU A 1 305 ? -7.601 -10.889 -35.927 1.00 96.17 305 A 1 ATOM 2469 C C . GLU A 1 305 ? -7.628 -10.659 -34.408 1.00 96.93 305 A 1 ATOM 2470 O O . GLU A 1 305 ? -8.697 -10.709 -33.797 1.00 96.41 305 A 1 ATOM 2471 C CB . GLU A 1 305 ? -7.655 -9.526 -36.625 1.00 94.96 305 A 1 ATOM 2472 C CG . GLU A 1 305 ? -7.369 -9.565 -38.128 1.00 85.99 305 A 1 ATOM 2473 C CD . GLU A 1 305 ? -7.240 -8.146 -38.704 1.00 82.61 305 A 1 ATOM 2474 O OE1 . GLU A 1 305 ? -6.780 -8.027 -39.858 1.00 75.98 305 A 1 ATOM 2475 O OE2 . GLU A 1 305 ? -7.591 -7.172 -37.981 1.00 77.28 305 A 1 ATOM 2476 N N . PRO A 1 306 ? -6.477 -10.312 -33.788 1.00 97.10 306 A 1 ATOM 2477 C CA . PRO A 1 306 ? -6.438 -9.936 -32.380 1.00 97.28 306 A 1 ATOM 2478 C C . PRO A 1 306 ? -7.507 -8.900 -32.025 1.00 97.62 306 A 1 ATOM 2479 O O . PRO A 1 306 ? -7.767 -7.968 -32.796 1.00 97.27 306 A 1 ATOM 2480 C CB . PRO A 1 306 ? -5.035 -9.380 -32.144 1.00 96.69 306 A 1 ATOM 2481 C CG . PRO A 1 306 ? -4.195 -10.105 -33.193 1.00 95.18 306 A 1 ATOM 2482 C CD . PRO A 1 306 ? -5.147 -10.234 -34.370 1.00 96.78 306 A 1 ATOM 2483 N N . ARG A 1 307 ? -8.102 -9.022 -30.836 1.00 97.68 307 A 1 ATOM 2484 C CA . ARG A 1 307 ? -9.073 -8.040 -30.344 1.00 98.02 307 A 1 ATOM 2485 C C . ARG A 1 307 ? -8.462 -6.639 -30.363 1.00 98.13 307 A 1 ATOM 2486 O O . ARG A 1 307 ? -7.392 -6.422 -29.807 1.00 97.78 307 A 1 ATOM 2487 C CB . ARG A 1 307 ? -9.527 -8.422 -28.930 1.00 97.72 307 A 1 ATOM 2488 C CG . ARG A 1 307 ? -10.689 -7.551 -28.438 1.00 97.22 307 A 1 ATOM 2489 C CD . ARG A 1 307 ? -11.010 -7.845 -26.970 1.00 96.64 307 A 1 ATOM 2490 N NE . ARG A 1 307 ? -10.141 -7.085 -26.066 1.00 96.32 307 A 1 ATOM 2491 C CZ . ARG A 1 307 ? -10.078 -7.203 -24.747 1.00 97.37 307 A 1 ATOM 2492 N NH1 . ARG A 1 307 ? -10.722 -8.132 -24.106 1.00 94.02 307 A 1 ATOM 2493 N NH2 . ARG A 1 307 ? -9.377 -6.372 -24.041 1.00 94.81 307 A 1 ATOM 2494 N N . ALA A 1 308 ? -9.191 -5.682 -30.937 1.00 98.27 308 A 1 ATOM 2495 C CA . ALA A 1 308 ? -8.897 -4.268 -30.794 1.00 98.26 308 A 1 ATOM 2496 C C . ALA A 1 308 ? -10.007 -3.602 -29.975 1.00 98.39 308 A 1 ATOM 2497 O O . ALA A 1 308 ? -11.189 -3.698 -30.305 1.00 98.03 308 A 1 ATOM 2498 C CB . ALA A 1 308 ? -8.701 -3.634 -32.168 1.00 97.78 308 A 1 ATOM 2499 N N . SER A 1 309 ? -9.621 -2.951 -28.884 1.00 98.55 309 A 1 ATOM 2500 C CA . SER A 1 309 ? -10.540 -2.289 -27.958 1.00 98.66 309 A 1 ATOM 2501 C C . SER A 1 309 ? -9.841 -1.126 -27.267 1.00 98.65 309 A 1 ATOM 2502 O O . SER A 1 309 ? -8.616 -1.103 -27.159 1.00 98.37 309 A 1 ATOM 2503 C CB . SER A 1 309 ? -11.058 -3.279 -26.907 1.00 98.55 309 A 1 ATOM 2504 O OG . SER A 1 309 ? -9.990 -3.779 -26.114 1.00 98.35 309 A 1 ATOM 2505 N N . THR A 1 310 ? -10.621 -0.189 -26.727 1.00 98.71 310 A 1 ATOM 2506 C CA . THR A 1 310 ? -10.126 0.904 -25.900 1.00 98.70 310 A 1 ATOM 2507 C C . THR A 1 310 ? -10.973 1.029 -24.643 1.00 98.75 310 A 1 ATOM 2508 O O . THR A 1 310 ? -12.196 0.888 -24.697 1.00 98.46 310 A 1 ATOM 2509 C CB . THR A 1 310 ? -10.058 2.212 -26.707 1.00 98.19 310 A 1 ATOM 2510 O OG1 . THR A 1 310 ? -9.492 3.237 -25.939 1.00 90.90 310 A 1 ATOM 2511 C CG2 . THR A 1 310 ? -11.415 2.705 -27.203 1.00 91.98 310 A 1 ATOM 2512 N N . GLU A 1 311 ? -10.334 1.295 -23.506 1.00 98.76 311 A 1 ATOM 2513 C CA . GLU A 1 311 ? -11.025 1.744 -22.312 1.00 98.72 311 A 1 ATOM 2514 C C . GLU A 1 311 ? -10.600 3.168 -21.971 1.00 98.75 311 A 1 ATOM 2515 O O . GLU A 1 311 ? -9.430 3.523 -22.039 1.00 98.42 311 A 1 ATOM 2516 C CB . GLU A 1 311 ? -10.863 0.779 -21.128 1.00 98.31 311 A 1 ATOM 2517 C CG . GLU A 1 311 ? -9.443 0.615 -20.589 1.00 96.41 311 A 1 ATOM 2518 C CD . GLU A 1 311 ? -8.658 -0.571 -21.181 1.00 96.99 311 A 1 ATOM 2519 O OE1 . GLU A 1 311 ? -7.657 -0.967 -20.551 1.00 93.53 311 A 1 ATOM 2520 O OE2 . GLU A 1 311 ? -9.041 -1.137 -22.230 1.00 95.14 311 A 1 ATOM 2521 N N . THR A 1 312 ? -11.590 3.991 -21.597 1.00 98.70 312 A 1 ATOM 2522 C CA . THR A 1 312 ? -11.398 5.388 -21.218 1.00 98.72 312 A 1 ATOM 2523 C C . THR A 1 312 ? -11.842 5.571 -19.774 1.00 98.75 312 A 1 ATOM 2524 O O . THR A 1 312 ? -13.020 5.412 -19.464 1.00 98.44 312 A 1 ATOM 2525 C CB . THR A 1 312 ? -12.178 6.315 -22.158 1.00 98.45 312 A 1 ATOM 2526 O OG1 . THR A 1 312 ? -11.828 6.058 -23.497 1.00 96.35 312 A 1 ATOM 2527 C CG2 . THR A 1 312 ? -11.877 7.785 -21.900 1.00 96.40 312 A 1 ATOM 2528 N N . ARG A 1 313 ? -10.899 5.911 -18.885 1.00 98.63 313 A 1 ATOM 2529 C CA . ARG A 1 313 ? -11.174 6.129 -17.462 1.00 98.58 313 A 1 ATOM 2530 C C . ARG A 1 313 ? -11.663 7.552 -17.232 1.00 98.70 313 A 1 ATOM 2531 O O . ARG A 1 313 ? -11.022 8.508 -17.659 1.00 98.52 313 A 1 ATOM 2532 C CB . ARG A 1 313 ? -9.929 5.791 -16.633 1.00 98.00 313 A 1 ATOM 2533 C CG . ARG A 1 313 ? -10.211 5.866 -15.125 1.00 90.34 313 A 1 ATOM 2534 C CD . ARG A 1 313 ? -8.979 5.494 -14.292 1.00 86.05 313 A 1 ATOM 2535 N NE . ARG A 1 313 ? -8.643 4.070 -14.430 1.00 79.29 313 A 1 ATOM 2536 C CZ . ARG A 1 313 ? -7.499 3.489 -14.130 1.00 73.72 313 A 1 ATOM 2537 N NH1 . ARG A 1 313 ? -6.497 4.146 -13.623 1.00 68.36 313 A 1 ATOM 2538 N NH2 . ARG A 1 313 ? -7.357 2.220 -14.331 1.00 66.44 313 A 1 ATOM 2539 N N . CYS A 1 314 ? -12.776 7.682 -16.515 1.00 98.72 314 A 1 ATOM 2540 C CA . CYS A 1 314 ? -13.422 8.963 -16.262 1.00 98.75 314 A 1 ATOM 2541 C C . CYS A 1 314 ? -13.758 9.148 -14.782 1.00 98.79 314 A 1 ATOM 2542 O O . CYS A 1 314 ? -14.334 8.252 -14.167 1.00 98.57 314 A 1 ATOM 2543 C CB . CYS A 1 314 ? -14.701 9.059 -17.097 1.00 98.60 314 A 1 ATOM 2544 S SG . CYS A 1 314 ? -14.348 8.843 -18.872 1.00 98.18 314 A 1 ATOM 2545 N N . PHE A 1 315 ? -13.480 10.340 -14.240 1.00 98.76 315 A 1 ATOM 2546 C CA . PHE A 1 315 ? -14.194 10.825 -13.066 1.00 98.78 315 A 1 ATOM 2547 C C . PHE A 1 315 ? -15.584 11.307 -13.481 1.00 98.77 315 A 1 ATOM 2548 O O . PHE A 1 315 ? -15.730 12.006 -14.484 1.00 98.63 315 A 1 ATOM 2549 C CB . PHE A 1 315 ? -13.440 11.966 -12.382 1.00 98.70 315 A 1 ATOM 2550 C CG . PHE A 1 315 ? -12.102 11.598 -11.797 1.00 98.64 315 A 1 ATOM 2551 C CD1 . PHE A 1 315 ? -12.018 10.630 -10.781 1.00 98.16 315 A 1 ATOM 2552 C CD2 . PHE A 1 315 ? -10.937 12.255 -12.234 1.00 98.08 315 A 1 ATOM 2553 C CE1 . PHE A 1 315 ? -10.776 10.304 -10.218 1.00 97.79 315 A 1 ATOM 2554 C CE2 . PHE A 1 315 ? -9.692 11.933 -11.671 1.00 97.69 315 A 1 ATOM 2555 C CZ . PHE A 1 315 ? -9.611 10.953 -10.665 1.00 97.98 315 A 1 ATOM 2556 N N . VAL A 1 316 ? -16.585 10.954 -12.688 1.00 98.63 316 A 1 ATOM 2557 C CA . VAL A 1 316 ? -17.988 11.319 -12.881 1.00 98.64 316 A 1 ATOM 2558 C C . VAL A 1 316 ? -18.460 11.989 -11.595 1.00 98.60 316 A 1 ATOM 2559 O O . VAL A 1 316 ? -18.337 11.397 -10.529 1.00 98.33 316 A 1 ATOM 2560 C CB . VAL A 1 316 ? -18.822 10.066 -13.207 1.00 98.46 316 A 1 ATOM 2561 C CG1 . VAL A 1 316 ? -20.287 10.409 -13.455 1.00 97.73 316 A 1 ATOM 2562 C CG2 . VAL A 1 316 ? -18.296 9.349 -14.463 1.00 97.73 316 A 1 ATOM 2563 N N . PHE A 1 317 ? -18.968 13.206 -11.682 1.00 98.59 317 A 1 ATOM 2564 C CA . PHE A 1 317 ? -19.363 14.011 -10.531 1.00 98.54 317 A 1 ATOM 2565 C C . PHE A 1 317 ? -20.832 14.420 -10.621 1.00 98.46 317 A 1 ATOM 2566 O O . PHE A 1 317 ? -21.285 14.896 -11.662 1.00 98.13 317 A 1 ATOM 2567 C CB . PHE A 1 317 ? -18.473 15.256 -10.420 1.00 98.40 317 A 1 ATOM 2568 C CG . PHE A 1 317 ? -16.985 14.981 -10.409 1.00 98.48 317 A 1 ATOM 2569 C CD1 . PHE A 1 317 ? -16.365 14.514 -9.240 1.00 98.09 317 A 1 ATOM 2570 C CD2 . PHE A 1 317 ? -16.210 15.192 -11.564 1.00 98.15 317 A 1 ATOM 2571 C CE1 . PHE A 1 317 ? -14.983 14.272 -9.217 1.00 97.91 317 A 1 ATOM 2572 C CE2 . PHE A 1 317 ? -14.824 14.950 -11.549 1.00 97.90 317 A 1 ATOM 2573 C CZ . PHE A 1 317 ? -14.210 14.491 -10.371 1.00 98.05 317 A 1 ATOM 2574 N N . TRP A 1 318 ? -21.545 14.283 -9.498 1.00 98.32 318 A 1 ATOM 2575 C CA . TRP A 1 318 ? -22.877 14.843 -9.289 1.00 98.22 318 A 1 ATOM 2576 C C . TRP A 1 318 ? -22.749 15.983 -8.279 1.00 98.07 318 A 1 ATOM 2577 O O . TRP A 1 318 ? -22.908 15.786 -7.080 1.00 97.34 318 A 1 ATOM 2578 C CB . TRP A 1 318 ? -23.846 13.759 -8.821 1.00 98.02 318 A 1 ATOM 2579 C CG . TRP A 1 318 ? -24.058 12.599 -9.749 1.00 98.08 318 A 1 ATOM 2580 C CD1 . TRP A 1 318 ? -25.098 12.471 -10.601 1.00 97.54 318 A 1 ATOM 2581 C CD2 . TRP A 1 318 ? -23.249 11.390 -9.902 1.00 98.13 318 A 1 ATOM 2582 N NE1 . TRP A 1 318 ? -24.996 11.253 -11.269 1.00 97.52 318 A 1 ATOM 2583 C CE2 . TRP A 1 318 ? -23.883 10.561 -10.869 1.00 97.89 318 A 1 ATOM 2584 C CE3 . TRP A 1 318 ? -22.059 10.918 -9.314 1.00 97.86 318 A 1 ATOM 2585 C CZ2 . TRP A 1 318 ? -23.351 9.302 -11.239 1.00 97.48 318 A 1 ATOM 2586 C CZ3 . TRP A 1 318 ? -21.527 9.663 -9.691 1.00 97.37 318 A 1 ATOM 2587 C CH2 . TRP A 1 318 ? -22.169 8.870 -10.640 1.00 97.29 318 A 1 ATOM 2588 N N . GLU A 1 319 ? -22.390 17.168 -8.774 1.00 97.92 319 A 1 ATOM 2589 C CA . GLU A 1 319 ? -22.079 18.347 -7.942 1.00 97.76 319 A 1 ATOM 2590 C C . GLU A 1 319 ? -23.306 18.878 -7.179 1.00 97.43 319 A 1 ATOM 2591 O O . GLU A 1 319 ? -23.168 19.671 -6.251 1.00 96.00 319 A 1 ATOM 2592 C CB . GLU A 1 319 ? -21.477 19.455 -8.822 1.00 97.48 319 A 1 ATOM 2593 C CG . GLU A 1 319 ? -20.134 19.059 -9.461 1.00 97.04 319 A 1 ATOM 2594 C CD . GLU A 1 319 ? -19.667 20.076 -10.510 1.00 97.30 319 A 1 ATOM 2595 O OE1 . GLU A 1 319 ? -18.807 20.925 -10.189 1.00 94.13 319 A 1 ATOM 2596 O OE2 . GLU A 1 319 ? -20.153 20.009 -11.658 1.00 94.79 319 A 1 ATOM 2597 N N . ASP A 1 320 ? -24.493 18.423 -7.561 1.00 97.44 320 A 1 ATOM 2598 C CA . ASP A 1 320 ? -25.792 18.683 -6.946 1.00 96.94 320 A 1 ATOM 2599 C C . ASP A 1 320 ? -26.161 17.691 -5.824 1.00 96.79 320 A 1 ATOM 2600 O O . ASP A 1 320 ? -27.212 17.831 -5.200 1.00 94.41 320 A 1 ATOM 2601 C CB . ASP A 1 320 ? -26.861 18.691 -8.057 1.00 96.05 320 A 1 ATOM 2602 C CG . ASP A 1 320 ? -26.999 17.365 -8.839 1.00 95.59 320 A 1 ATOM 2603 O OD1 . ASP A 1 320 ? -26.037 16.566 -8.893 1.00 92.67 320 A 1 ATOM 2604 O OD2 . ASP A 1 320 ? -28.070 17.166 -9.458 1.00 92.41 320 A 1 ATOM 2605 N N . GLN A 1 321 ? -25.312 16.692 -5.547 1.00 96.81 321 A 1 ATOM 2606 C CA . GLN A 1 321 ? -25.485 15.725 -4.464 1.00 96.26 321 A 1 ATOM 2607 C C . GLN A 1 321 ? -24.299 15.812 -3.503 1.00 96.07 321 A 1 ATOM 2608 O O . GLN A 1 321 ? -23.149 15.753 -3.925 1.00 94.58 321 A 1 ATOM 2609 C CB . GLN A 1 321 ? -25.628 14.300 -5.020 1.00 95.38 321 A 1 ATOM 2610 C CG . GLN A 1 321 ? -26.848 14.146 -5.942 1.00 92.66 321 A 1 ATOM 2611 C CD . GLN A 1 321 ? -26.930 12.785 -6.624 1.00 90.86 321 A 1 ATOM 2612 O OE1 . GLN A 1 321 ? -26.571 11.739 -6.102 1.00 84.33 321 A 1 ATOM 2613 N NE2 . GLN A 1 321 ? -27.424 12.756 -7.844 1.00 82.43 321 A 1 ATOM 2614 N N . GLU A 1 322 ? -24.568 15.894 -2.196 1.00 94.31 322 A 1 ATOM 2615 C CA . GLU A 1 322 ? -23.516 15.809 -1.184 1.00 93.12 322 A 1 ATOM 2616 C C . GLU A 1 322 ? -22.994 14.371 -1.058 1.00 91.94 322 A 1 ATOM 2617 O O . GLU A 1 322 ? -23.748 13.400 -1.183 1.00 87.49 322 A 1 ATOM 2618 C CB . GLU A 1 322 ? -24.006 16.360 0.165 1.00 90.34 322 A 1 ATOM 2619 C CG . GLU A 1 322 ? -24.272 17.873 0.102 1.00 78.30 322 A 1 ATOM 2620 C CD . GLU A 1 322 ? -24.651 18.505 1.449 1.00 72.67 322 A 1 ATOM 2621 O OE1 . GLU A 1 322 ? -24.683 19.759 1.504 1.00 66.30 322 A 1 ATOM 2622 O OE2 . GLU A 1 322 ? -24.906 17.763 2.423 1.00 69.52 322 A 1 ATOM 2623 N N . ALA A 1 323 ? -21.686 14.222 -0.816 1.00 91.42 323 A 1 ATOM 2624 C CA . ALA A 1 323 ? -21.111 12.940 -0.450 1.00 88.91 323 A 1 ATOM 2625 C C . ALA A 1 323 ? -21.554 12.557 0.964 1.00 86.94 323 A 1 ATOM 2626 O O . ALA A 1 323 ? -21.644 13.393 1.862 1.00 79.91 323 A 1 ATOM 2627 C CB . ALA A 1 323 ? -19.586 12.990 -0.559 1.00 84.67 323 A 1 ATOM 2628 N N . GLU A 1 324 ? -21.764 11.255 1.178 1.00 83.31 324 A 1 ATOM 2629 C CA . GLU A 1 324 ? -21.902 10.713 2.528 1.00 79.29 324 A 1 ATOM 2630 C C . GLU A 1 324 ? -20.623 10.974 3.331 1.00 76.12 324 A 1 ATOM 2631 O O . GLU A 1 324 ? -19.527 11.030 2.776 1.00 68.31 324 A 1 ATOM 2632 C CB . GLU A 1 324 ? -22.234 9.220 2.460 1.00 73.96 324 A 1 ATOM 2633 C CG . GLU A 1 324 ? -23.649 8.990 1.900 1.00 68.50 324 A 1 ATOM 2634 C CD . GLU A 1 324 ? -23.928 7.509 1.622 1.00 64.50 324 A 1 ATOM 2635 O OE1 . GLU A 1 324 ? -24.598 7.235 0.602 1.00 58.13 324 A 1 ATOM 2636 O OE2 . GLU A 1 324 ? -23.441 6.649 2.388 1.00 62.88 324 A 1 ATOM 2637 N N . ALA A 1 325 ? -20.776 11.146 4.660 1.00 62.95 325 A 1 ATOM 2638 C CA . ALA A 1 325 ? -19.643 11.421 5.529 1.00 58.82 325 A 1 ATOM 2639 C C . ALA A 1 325 ? -18.538 10.373 5.316 1.00 58.20 325 A 1 ATOM 2640 O O . ALA A 1 325 ? -18.776 9.168 5.392 1.00 54.60 325 A 1 ATOM 2641 C CB . ALA A 1 325 ? -20.119 11.480 6.982 1.00 52.24 325 A 1 ATOM 2642 N N . LEU A 1 326 ? -17.315 10.852 5.058 1.00 57.59 326 A 1 ATOM 2643 C CA . LEU A 1 326 ? -16.121 10.023 5.051 1.00 55.85 326 A 1 ATOM 2644 C C . LEU A 1 326 ? -15.917 9.497 6.470 1.00 55.52 326 A 1 ATOM 2645 O O . LEU A 1 326 ? -15.405 10.199 7.337 1.00 51.76 326 A 1 ATOM 2646 C CB . LEU A 1 326 ? -14.916 10.850 4.566 1.00 51.18 326 A 1 ATOM 2647 C CG . LEU A 1 326 ? -14.903 11.119 3.048 1.00 47.26 326 A 1 ATOM 2648 C CD1 . LEU A 1 326 ? -13.999 12.304 2.728 1.00 43.35 326 A 1 ATOM 2649 C CD2 . LEU A 1 326 ? -14.395 9.901 2.272 1.00 42.10 326 A 1 ATOM 2650 N N . GLU A 1 327 ? -16.350 8.262 6.713 1.00 50.12 327 A 1 ATOM 2651 C CA . GLU A 1 327 ? -15.944 7.541 7.907 1.00 49.54 327 A 1 ATOM 2652 C C . GLU A 1 327 ? -14.445 7.272 7.783 1.00 50.01 327 A 1 ATOM 2653 O O . GLU A 1 327 ? -14.017 6.390 7.045 1.00 46.59 327 A 1 ATOM 2654 C CB . GLU A 1 327 ? -16.752 6.251 8.073 1.00 45.15 327 A 1 ATOM 2655 C CG . GLU A 1 327 ? -18.211 6.524 8.477 1.00 39.99 327 A 1 ATOM 2656 C CD . GLU A 1 327 ? -19.044 5.242 8.623 1.00 35.78 327 A 1 ATOM 2657 O OE1 . GLU A 1 327 ? -20.123 5.332 9.244 1.00 31.79 327 A 1 ATOM 2658 O OE2 . GLU A 1 327 ? -18.623 4.201 8.069 1.00 32.49 327 A 1 ATOM 2659 N N . HIS A 1 328 ? -13.652 8.060 8.507 1.00 46.68 328 A 1 ATOM 2660 C CA . HIS A 1 328 ? -12.243 7.790 8.739 1.00 46.26 328 A 1 ATOM 2661 C C . HIS A 1 328 ? -12.106 6.606 9.704 1.00 46.02 328 A 1 ATOM 2662 O O . HIS A 1 328 ? -11.639 6.748 10.832 1.00 43.75 328 A 1 ATOM 2663 C CB . HIS A 1 328 ? -11.541 9.054 9.250 1.00 43.37 328 A 1 ATOM 2664 C CG . HIS A 1 328 ? -11.411 10.143 8.224 1.00 40.68 328 A 1 ATOM 2665 N ND1 . HIS A 1 328 ? -10.566 10.132 7.140 1.00 37.26 328 A 1 ATOM 2666 C CD2 . HIS A 1 328 ? -12.067 11.351 8.203 1.00 35.86 328 A 1 ATOM 2667 C CE1 . HIS A 1 328 ? -10.700 11.297 6.488 1.00 33.27 328 A 1 ATOM 2668 N NE2 . HIS A 1 328 ? -11.608 12.070 7.105 1.00 32.96 328 A 1 ATOM 2669 N N . HIS A 1 329 ? -12.564 5.432 9.284 1.00 43.14 329 A 1 ATOM 2670 C CA . HIS A 1 329 ? -12.218 4.208 9.963 1.00 42.47 329 A 1 ATOM 2671 C C . HIS A 1 329 ? -10.818 3.826 9.502 1.00 42.05 329 A 1 ATOM 2672 O O . HIS A 1 329 ? -10.661 3.348 8.386 1.00 39.76 329 A 1 ATOM 2673 C CB . HIS A 1 329 ? -13.271 3.131 9.697 1.00 39.69 329 A 1 ATOM 2674 C CG . HIS A 1 329 ? -14.531 3.339 10.497 1.00 37.11 329 A 1 ATOM 2675 N ND1 . HIS A 1 329 ? -14.607 3.443 11.872 1.00 33.91 329 A 1 ATOM 2676 C CD2 . HIS A 1 329 ? -15.808 3.449 10.017 1.00 32.49 329 A 1 ATOM 2677 C CE1 . HIS A 1 329 ? -15.888 3.617 12.209 1.00 30.28 329 A 1 ATOM 2678 N NE2 . HIS A 1 329 ? -16.651 3.621 11.105 1.00 30.02 329 A 1 ATOM 2679 N N . HIS A 1 330 ? -9.808 4.039 10.337 1.00 46.24 330 A 1 ATOM 2680 C CA . HIS A 1 330 ? -8.517 3.381 10.197 1.00 45.54 330 A 1 ATOM 2681 C C . HIS A 1 330 ? -8.575 2.056 10.950 1.00 44.78 330 A 1 ATOM 2682 O O . HIS A 1 330 ? -8.292 2.013 12.144 1.00 42.26 330 A 1 ATOM 2683 C CB . HIS A 1 330 ? -7.389 4.291 10.694 1.00 42.85 330 A 1 ATOM 2684 C CG . HIS A 1 330 ? -7.085 5.412 9.745 1.00 40.26 330 A 1 ATOM 2685 N ND1 . HIS A 1 330 ? -6.512 5.280 8.499 1.00 36.75 330 A 1 ATOM 2686 C CD2 . HIS A 1 330 ? -7.323 6.751 9.941 1.00 35.47 330 A 1 ATOM 2687 C CE1 . HIS A 1 330 ? -6.416 6.498 7.954 1.00 34.23 330 A 1 ATOM 2688 N NE2 . HIS A 1 330 ? -6.897 7.424 8.806 1.00 33.75 330 A 1 ATOM 2689 N N . HIS A 1 331 ? -8.981 0.973 10.288 1.00 39.53 331 A 1 ATOM 2690 C CA . HIS A 1 331 ? -8.701 -0.362 10.797 1.00 38.26 331 A 1 ATOM 2691 C C . HIS A 1 331 ? -7.387 -0.832 10.163 1.00 37.46 331 A 1 ATOM 2692 O O . HIS A 1 331 ? -7.256 -0.902 8.944 1.00 35.12 331 A 1 ATOM 2693 C CB . HIS A 1 331 ? -9.854 -1.343 10.563 1.00 36.11 331 A 1 ATOM 2694 C CG . HIS A 1 331 ? -11.197 -0.997 11.157 1.00 33.81 331 A 1 ATOM 2695 N ND1 . HIS A 1 331 ? -11.647 -1.333 12.416 1.00 31.00 331 A 1 ATOM 2696 C CD2 . HIS A 1 331 ? -12.266 -0.455 10.492 1.00 30.13 331 A 1 ATOM 2697 C CE1 . HIS A 1 331 ? -12.944 -1.008 12.496 1.00 27.88 331 A 1 ATOM 2698 N NE2 . HIS A 1 331 ? -13.356 -0.476 11.335 1.00 27.49 331 A 1 ATOM 2699 N N . HIS A 1 332 ? -6.415 -1.133 11.001 1.00 42.18 332 A 1 ATOM 2700 C CA . HIS A 1 332 ? -5.172 -1.738 10.535 1.00 40.39 332 A 1 ATOM 2701 C C . HIS A 1 332 ? -5.358 -3.238 10.368 1.00 39.08 332 A 1 ATOM 2702 O O . HIS A 1 332 ? -5.824 -3.908 11.289 1.00 35.92 332 A 1 ATOM 2703 C CB . HIS A 1 332 ? -4.031 -1.405 11.493 1.00 37.56 332 A 1 ATOM 2704 C CG . HIS A 1 332 ? -3.715 0.057 11.407 1.00 35.15 332 A 1 ATOM 2705 N ND1 . HIS A 1 332 ? -3.116 0.661 10.316 1.00 32.13 332 A 1 ATOM 2706 C CD2 . HIS A 1 332 ? -4.141 1.019 12.273 1.00 30.91 332 A 1 ATOM 2707 C CE1 . HIS A 1 332 ? -3.198 1.969 10.509 1.00 30.31 332 A 1 ATOM 2708 N NE2 . HIS A 1 332 ? -3.813 2.232 11.684 1.00 29.97 332 A 1 ATOM 2709 N N . HIS A 1 333 ? -4.993 -3.736 9.171 1.00 38.44 333 A 1 ATOM 2710 C CA . HIS A 1 333 ? -4.779 -5.160 8.928 1.00 35.32 333 A 1 ATOM 2711 C C . HIS A 1 333 ? -3.308 -5.492 8.995 1.00 33.48 333 A 1 ATOM 2712 O O . HIS A 1 333 ? -2.492 -4.718 8.448 1.00 29.95 333 A 1 ATOM 2713 C CB . HIS A 1 333 ? -5.397 -5.601 7.605 1.00 32.20 333 A 1 ATOM 2714 C CG . HIS A 1 333 ? -6.884 -5.577 7.748 1.00 31.08 333 A 1 ATOM 2715 N ND1 . HIS A 1 333 ? -7.541 -6.179 8.792 1.00 28.63 333 A 1 ATOM 2716 C CD2 . HIS A 1 333 ? -7.763 -4.779 7.087 1.00 27.43 333 A 1 ATOM 2717 C CE1 . HIS A 1 333 ? -8.776 -5.692 8.786 1.00 26.48 333 A 1 ATOM 2718 N NE2 . HIS A 1 333 ? -8.957 -4.852 7.767 1.00 27.25 333 A 1 ATOM 2719 O OXT . HIS A 1 333 ? -3.033 -6.594 9.583 1.00 25.44 333 A 1 ATOM 2720 N N . MET B 2 1 ? -19.219 39.877 13.156 1.00 31.81 1 B 1 ATOM 2721 C CA . MET B 2 1 ? -18.439 39.375 12.004 1.00 37.50 1 B 1 ATOM 2722 C C . MET B 2 1 ? -17.043 39.011 12.505 1.00 39.36 1 B 1 ATOM 2723 O O . MET B 2 1 ? -16.116 39.790 12.343 1.00 37.95 1 B 1 ATOM 2724 C CB . MET B 2 1 ? -18.371 40.433 10.892 1.00 37.11 1 B 1 ATOM 2725 C CG . MET B 2 1 ? -19.724 40.711 10.232 1.00 34.49 1 B 1 ATOM 2726 S SD . MET B 2 1 ? -19.633 42.091 9.050 1.00 30.23 1 B 1 ATOM 2727 C CE . MET B 2 1 ? -21.351 42.185 8.499 1.00 25.88 1 B 1 ATOM 2728 N N . THR B 2 2 ? -16.915 37.910 13.239 1.00 32.95 2 B 1 ATOM 2729 C CA . THR B 2 2 ? -15.642 37.478 13.822 1.00 32.74 2 B 1 ATOM 2730 C C . THR B 2 2 ? -14.795 36.877 12.703 1.00 33.40 2 B 1 ATOM 2731 O O . THR B 2 2 ? -15.126 35.821 12.174 1.00 32.00 2 B 1 ATOM 2732 C CB . THR B 2 2 ? -15.874 36.468 14.957 1.00 30.74 2 B 1 ATOM 2733 O OG1 . THR B 2 2 ? -16.970 35.638 14.657 1.00 26.99 2 B 1 ATOM 2734 C CG2 . THR B 2 2 ? -16.220 37.188 16.267 1.00 27.45 2 B 1 ATOM 2735 N N . SER B 2 3 ? -13.745 37.604 12.315 1.00 35.19 3 B 1 ATOM 2736 C CA . SER B 2 3 ? -12.768 37.162 11.324 1.00 36.46 3 B 1 ATOM 2737 C C . SER B 2 3 ? -11.974 36.000 11.928 1.00 37.00 3 B 1 ATOM 2738 O O . SER B 2 3 ? -11.005 36.218 12.647 1.00 36.06 3 B 1 ATOM 2739 C CB . SER B 2 3 ? -11.854 38.337 10.957 1.00 35.98 3 B 1 ATOM 2740 O OG . SER B 2 3 ? -10.856 37.940 10.053 1.00 32.07 3 B 1 ATOM 2741 N N . THR B 2 4 ? -12.411 34.763 11.683 1.00 39.06 4 B 1 ATOM 2742 C CA . THR B 2 4 ? -11.617 33.571 11.963 1.00 38.97 4 B 1 ATOM 2743 C C . THR B 2 4 ? -10.454 33.569 10.975 1.00 38.56 4 B 1 ATOM 2744 O O . THR B 2 4 ? -10.594 33.128 9.836 1.00 37.36 4 B 1 ATOM 2745 C CB . THR B 2 4 ? -12.458 32.289 11.851 1.00 37.95 4 B 1 ATOM 2746 O OG1 . THR B 2 4 ? -13.420 32.402 10.832 1.00 34.04 4 B 1 ATOM 2747 C CG2 . THR B 2 4 ? -13.220 32.017 13.148 1.00 34.83 4 B 1 ATOM 2748 N N . THR B 2 5 ? -9.329 34.126 11.398 1.00 39.86 5 B 1 ATOM 2749 C CA . THR B 2 5 ? -8.055 34.041 10.691 1.00 40.76 5 B 1 ATOM 2750 C C . THR B 2 5 ? -7.626 32.576 10.684 1.00 40.24 5 B 1 ATOM 2751 O O . THR B 2 5 ? -6.993 32.101 11.622 1.00 38.88 5 B 1 ATOM 2752 C CB . THR B 2 5 ? -6.986 34.924 11.366 1.00 40.09 5 B 1 ATOM 2753 O OG1 . THR B 2 5 ? -7.133 34.924 12.764 1.00 35.99 5 B 1 ATOM 2754 C CG2 . THR B 2 5 ? -7.092 36.381 10.914 1.00 36.24 5 B 1 ATOM 2755 N N . THR B 2 6 ? -8.017 31.853 9.645 1.00 38.95 6 B 1 ATOM 2756 C CA . THR B 2 6 ? -7.444 30.556 9.306 1.00 39.29 6 B 1 ATOM 2757 C C . THR B 2 6 ? -5.984 30.803 8.942 1.00 38.61 6 B 1 ATOM 2758 O O . THR B 2 6 ? -5.674 31.202 7.823 1.00 37.35 6 B 1 ATOM 2759 C CB . THR B 2 6 ? -8.202 29.895 8.139 1.00 38.47 6 B 1 ATOM 2760 O OG1 . THR B 2 6 ? -8.764 30.859 7.278 1.00 34.22 6 B 1 ATOM 2761 C CG2 . THR B 2 6 ? -9.366 29.042 8.652 1.00 34.55 6 B 1 ATOM 2762 N N . THR B 2 7 ? -5.102 30.632 9.916 1.00 36.04 7 B 1 ATOM 2763 C CA . THR B 2 7 ? -3.663 30.593 9.691 1.00 36.67 7 B 1 ATOM 2764 C C . THR B 2 7 ? -3.388 29.388 8.798 1.00 35.91 7 B 1 ATOM 2765 O O . THR B 2 7 ? -3.403 28.249 9.255 1.00 35.08 7 B 1 ATOM 2766 C CB . THR B 2 7 ? -2.888 30.495 11.019 1.00 35.68 7 B 1 ATOM 2767 O OG1 . THR B 2 7 ? -3.600 29.726 11.962 1.00 31.84 7 B 1 ATOM 2768 C CG2 . THR B 2 7 ? -2.688 31.876 11.644 1.00 33.10 7 B 1 ATOM 2769 N N . THR B 2 8 ? -3.201 29.650 7.515 1.00 34.92 8 B 1 ATOM 2770 C CA . THR B 2 8 ? -2.629 28.704 6.564 1.00 34.77 8 B 1 ATOM 2771 C C . THR B 2 8 ? -1.196 28.431 7.014 1.00 33.91 8 B 1 ATOM 2772 O O . THR B 2 8 ? -0.287 29.176 6.654 1.00 32.70 8 B 1 ATOM 2773 C CB . THR B 2 8 ? -2.658 29.282 5.133 1.00 34.21 8 B 1 ATOM 2774 O OG1 . THR B 2 8 ? -2.504 30.685 5.147 1.00 30.91 8 B 1 ATOM 2775 C CG2 . THR B 2 8 ? -3.986 28.997 4.434 1.00 31.84 8 B 1 ATOM 2776 N N . GLU B 2 9 ? -1.014 27.411 7.863 1.00 36.16 9 B 1 ATOM 2777 C CA . GLU B 2 9 ? 0.314 26.884 8.163 1.00 36.70 9 B 1 ATOM 2778 C C . GLU B 2 9 ? 0.908 26.418 6.832 1.00 35.74 9 B 1 ATOM 2779 O O . GLU B 2 9 ? 0.428 25.477 6.199 1.00 35.05 9 B 1 ATOM 2780 C CB . GLU B 2 9 ? 0.265 25.765 9.216 1.00 36.80 9 B 1 ATOM 2781 C CG . GLU B 2 9 ? 0.058 26.321 10.640 1.00 34.59 9 B 1 ATOM 2782 C CD . GLU B 2 9 ? 0.121 25.252 11.756 1.00 31.85 9 B 1 ATOM 2783 O OE1 . GLU B 2 9 ? 0.333 25.652 12.922 1.00 28.26 9 B 1 ATOM 2784 O OE2 . GLU B 2 9 ? -0.059 24.047 11.471 1.00 33.65 9 B 1 ATOM 2785 N N . THR B 2 10 ? 1.892 27.168 6.355 1.00 35.68 10 B 1 ATOM 2786 C CA . THR B 2 10 ? 2.599 26.866 5.120 1.00 35.61 10 B 1 ATOM 2787 C C . THR B 2 10 ? 3.338 25.550 5.317 1.00 34.94 10 B 1 ATOM 2788 O O . THR B 2 10 ? 4.295 25.490 6.084 1.00 34.12 10 B 1 ATOM 2789 C CB . THR B 2 10 ? 3.580 27.993 4.743 1.00 34.45 10 B 1 ATOM 2790 O OG1 . THR B 2 10 ? 4.093 28.640 5.887 1.00 31.15 10 B 1 ATOM 2791 C CG2 . THR B 2 10 ? 2.891 29.076 3.909 1.00 31.89 10 B 1 ATOM 2792 N N . LEU B 2 11 ? 2.892 24.516 4.602 1.00 41.38 11 B 1 ATOM 2793 C CA . LEU B 2 11 ? 3.601 23.248 4.464 1.00 40.49 11 B 1 ATOM 2794 C C . LEU B 2 11 ? 4.996 23.545 3.897 1.00 40.90 11 B 1 ATOM 2795 O O . LEU B 2 11 ? 5.153 23.779 2.695 1.00 40.93 11 B 1 ATOM 2796 C CB . LEU B 2 11 ? 2.800 22.329 3.526 1.00 39.67 11 B 1 ATOM 2797 C CG . LEU B 2 11 ? 1.462 21.833 4.108 1.00 36.51 11 B 1 ATOM 2798 C CD1 . LEU B 2 11 ? 0.605 21.223 2.999 1.00 35.29 11 B 1 ATOM 2799 C CD2 . LEU B 2 11 ? 1.687 20.779 5.192 1.00 36.89 11 B 1 ATOM 2800 N N . GLN B 2 12 ? 5.982 23.600 4.781 1.00 38.44 12 B 1 ATOM 2801 C CA . GLN B 2 12 ? 7.360 23.798 4.364 1.00 38.26 12 B 1 ATOM 2802 C C . GLN B 2 12 ? 7.848 22.509 3.696 1.00 37.80 12 B 1 ATOM 2803 O O . GLN B 2 12 ? 7.582 21.402 4.166 1.00 37.33 12 B 1 ATOM 2804 C CB . GLN B 2 12 ? 8.234 24.249 5.545 1.00 38.94 12 B 1 ATOM 2805 C CG . GLN B 2 12 ? 7.899 25.696 5.974 1.00 36.76 12 B 1 ATOM 2806 C CD . GLN B 2 12 ? 8.858 26.269 7.026 1.00 33.21 12 B 1 ATOM 2807 O OE1 . GLN B 2 12 ? 9.671 25.594 7.622 1.00 32.07 12 B 1 ATOM 2808 N NE2 . GLN B 2 12 ? 8.803 27.556 7.282 1.00 31.73 12 B 1 ATOM 2809 N N . GLU B 2 13 ? 8.560 22.658 2.570 1.00 39.77 13 B 1 ATOM 2810 C CA . GLU B 2 13 ? 9.482 21.608 2.135 1.00 40.82 13 B 1 ATOM 2811 C C . GLU B 2 13 ? 10.390 21.270 3.317 1.00 40.19 13 B 1 ATOM 2812 O O . GLU B 2 13 ? 10.647 22.138 4.158 1.00 39.94 13 B 1 ATOM 2813 C CB . GLU B 2 13 ? 10.323 22.075 0.932 1.00 40.92 13 B 1 ATOM 2814 C CG . GLU B 2 13 ? 9.498 22.154 -0.360 1.00 37.69 13 B 1 ATOM 2815 C CD . GLU B 2 13 ? 10.316 22.548 -1.601 1.00 33.90 13 B 1 ATOM 2816 O OE1 . GLU B 2 13 ? 9.833 22.241 -2.718 1.00 30.30 13 B 1 ATOM 2817 O OE2 . GLU B 2 13 ? 11.394 23.162 -1.451 1.00 34.49 13 B 1 ATOM 2818 N N . ALA B 2 14 ? 10.852 20.018 3.400 1.00 48.56 14 B 1 ATOM 2819 C CA . ALA B 2 14 ? 11.816 19.629 4.426 1.00 46.41 14 B 1 ATOM 2820 C C . ALA B 2 14 ? 13.065 20.515 4.274 1.00 47.08 14 B 1 ATOM 2821 O O . ALA B 2 14 ? 13.967 20.206 3.500 1.00 46.63 14 B 1 ATOM 2822 C CB . ALA B 2 14 ? 12.124 18.134 4.289 1.00 44.59 14 B 1 ATOM 2823 N N . VAL B 2 15 ? 13.056 21.665 4.939 1.00 46.11 15 B 1 ATOM 2824 C CA . VAL B 2 15 ? 14.171 22.608 4.892 1.00 46.48 15 B 1 ATOM 2825 C C . VAL B 2 15 ? 15.343 21.858 5.503 1.00 46.09 15 B 1 ATOM 2826 O O . VAL B 2 15 ? 15.209 21.363 6.626 1.00 44.96 15 B 1 ATOM 2827 C CB . VAL B 2 15 ? 13.874 23.919 5.645 1.00 46.03 15 B 1 ATOM 2828 C CG1 . VAL B 2 15 ? 15.034 24.911 5.492 1.00 40.40 15 B 1 ATOM 2829 C CG2 . VAL B 2 15 ? 12.613 24.611 5.105 1.00 42.37 15 B 1 ATOM 2830 N N . PRO B 2 16 ? 16.464 21.708 4.774 1.00 45.43 16 B 1 ATOM 2831 C CA . PRO B 2 16 ? 17.664 21.170 5.381 1.00 46.50 16 B 1 ATOM 2832 C C . PRO B 2 16 ? 17.952 22.048 6.592 1.00 48.35 16 B 1 ATOM 2833 O O . PRO B 2 16 ? 18.206 23.243 6.445 1.00 47.52 16 B 1 ATOM 2834 C CB . PRO B 2 16 ? 18.773 21.244 4.319 1.00 45.31 16 B 1 ATOM 2835 C CG . PRO B 2 16 ? 18.072 21.659 3.027 1.00 45.38 16 B 1 ATOM 2836 C CD . PRO B 2 16 ? 16.726 22.228 3.453 1.00 50.36 16 B 1 ATOM 2837 N N . PHE B 2 17 ? 17.832 21.473 7.787 1.00 49.88 17 B 1 ATOM 2838 C CA . PHE B 2 17 ? 18.178 22.214 8.991 1.00 49.20 17 B 1 ATOM 2839 C C . PHE B 2 17 ? 19.675 22.484 8.881 1.00 49.82 17 B 1 ATOM 2840 O O . PHE B 2 17 ? 20.483 21.571 9.029 1.00 48.20 17 B 1 ATOM 2841 C CB . PHE B 2 17 ? 17.759 21.429 10.245 1.00 47.05 17 B 1 ATOM 2842 C CG . PHE B 2 17 ? 17.145 22.306 11.321 1.00 44.70 17 B 1 ATOM 2843 C CD1 . PHE B 2 17 ? 17.951 22.939 12.280 1.00 40.77 17 B 1 ATOM 2844 C CD2 . PHE B 2 17 ? 15.746 22.490 11.355 1.00 41.19 17 B 1 ATOM 2845 C CE1 . PHE B 2 17 ? 17.365 23.743 13.279 1.00 37.57 17 B 1 ATOM 2846 C CE2 . PHE B 2 17 ? 15.160 23.290 12.347 1.00 38.80 17 B 1 ATOM 2847 C CZ . PHE B 2 17 ? 15.963 23.918 13.314 1.00 38.96 17 B 1 ATOM 2848 N N . VAL B 2 18 ? 20.032 23.702 8.510 1.00 51.59 18 B 1 ATOM 2849 C CA . VAL B 2 18 ? 21.431 24.102 8.372 1.00 54.26 18 B 1 ATOM 2850 C C . VAL B 2 18 ? 21.985 24.127 9.786 1.00 53.76 18 B 1 ATOM 2851 O O . VAL B 2 18 ? 21.849 25.119 10.496 1.00 52.88 18 B 1 ATOM 2852 C CB . VAL B 2 18 ? 21.589 25.454 7.644 1.00 52.91 18 B 1 ATOM 2853 C CG1 . VAL B 2 18 ? 23.066 25.789 7.422 1.00 46.87 18 B 1 ATOM 2854 C CG2 . VAL B 2 18 ? 20.908 25.445 6.265 1.00 48.10 18 B 1 ATOM 2855 N N . ALA B 2 19 ? 22.539 22.989 10.210 1.00 53.86 19 B 1 ATOM 2856 C CA . ALA B 2 19 ? 23.358 22.978 11.408 1.00 55.31 19 B 1 ATOM 2857 C C . ALA B 2 19 ? 24.423 24.073 11.226 1.00 56.00 19 B 1 ATOM 2858 O O . ALA B 2 19 ? 24.949 24.237 10.118 1.00 55.52 19 B 1 ATOM 2859 C CB . ALA B 2 19 ? 23.972 21.587 11.616 1.00 53.70 19 B 1 ATOM 2860 N N . PRO B 2 20 ? 24.705 24.868 12.259 1.00 48.82 20 B 1 ATOM 2861 C CA . PRO B 2 20 ? 25.774 25.847 12.166 1.00 49.97 20 B 1 ATOM 2862 C C . PRO B 2 20 ? 27.056 25.133 11.720 1.00 51.27 20 B 1 ATOM 2863 O O . PRO B 2 20 ? 27.248 23.965 12.080 1.00 50.81 20 B 1 ATOM 2864 C CB . PRO B 2 20 ? 25.885 26.477 13.558 1.00 48.67 20 B 1 ATOM 2865 C CG . PRO B 2 20 ? 25.269 25.423 14.480 1.00 47.88 20 B 1 ATOM 2866 C CD . PRO B 2 20 ? 24.211 24.753 13.612 1.00 51.38 20 B 1 ATOM 2867 N N . PRO B 2 21 ? 27.920 25.789 10.920 1.00 49.29 21 B 1 ATOM 2868 C CA . PRO B 2 21 ? 29.102 25.144 10.361 1.00 51.40 21 B 1 ATOM 2869 C C . PRO B 2 21 ? 29.890 24.470 11.478 1.00 52.67 21 B 1 ATOM 2870 O O . PRO B 2 21 ? 30.185 25.104 12.500 1.00 51.30 21 B 1 ATOM 2871 C CB . PRO B 2 21 ? 29.894 26.254 9.657 1.00 50.17 21 B 1 ATOM 2872 C CG . PRO B 2 21 ? 29.366 27.541 10.296 1.00 49.50 21 B 1 ATOM 2873 C CD . PRO B 2 21 ? 27.916 27.203 10.619 1.00 52.74 21 B 1 ATOM 2874 N N . SER B 2 22 ? 30.197 23.176 11.283 1.00 47.20 22 B 1 ATOM 2875 C CA . SER B 2 22 ? 30.948 22.393 12.262 1.00 48.76 22 B 1 ATOM 2876 C C . SER B 2 22 ? 32.218 23.157 12.643 1.00 49.49 22 B 1 ATOM 2877 O O . SER B 2 22 ? 32.937 23.622 11.758 1.00 47.87 22 B 1 ATOM 2878 C CB . SER B 2 22 ? 31.329 21.025 11.686 1.00 46.72 22 B 1 ATOM 2879 O OG . SER B 2 22 ? 30.159 20.331 11.278 1.00 43.13 22 B 1 ATOM 2880 N N . PRO B 2 23 ? 32.504 23.319 13.939 1.00 46.60 23 B 1 ATOM 2881 C CA . PRO B 2 23 ? 33.768 23.929 14.337 1.00 48.07 23 B 1 ATOM 2882 C C . PRO B 2 23 ? 34.943 23.098 13.790 1.00 49.17 23 B 1 ATOM 2883 O O . PRO B 2 23 ? 34.786 21.896 13.555 1.00 48.22 23 B 1 ATOM 2884 C CB . PRO B 2 23 ? 33.749 23.994 15.869 1.00 46.60 23 B 1 ATOM 2885 C CG . PRO B 2 23 ? 32.325 23.621 16.278 1.00 45.87 23 B 1 ATOM 2886 C CD . PRO B 2 23 ? 31.760 22.860 15.086 1.00 49.18 23 B 1 ATOM 2887 N N . PRO B 2 24 ? 36.125 23.694 13.580 1.00 49.36 24 B 1 ATOM 2888 C CA . PRO B 2 24 ? 37.282 22.994 13.015 1.00 49.93 24 B 1 ATOM 2889 C C . PRO B 2 24 ? 37.752 21.807 13.879 1.00 50.87 24 B 1 ATOM 2890 O O . PRO B 2 24 ? 37.376 21.695 15.043 1.00 49.26 24 B 1 ATOM 2891 C CB . PRO B 2 24 ? 38.360 24.076 12.844 1.00 48.06 24 B 1 ATOM 2892 C CG . PRO B 2 24 ? 37.953 25.163 13.842 1.00 47.92 24 B 1 ATOM 2893 C CD . PRO B 2 24 ? 36.436 25.079 13.862 1.00 52.37 24 B 1 ATOM 2894 N N . GLU B 2 25 ? 38.632 20.956 13.300 1.00 47.93 25 B 1 ATOM 2895 C CA . GLU B 2 25 ? 39.054 19.610 13.751 1.00 48.54 25 B 1 ATOM 2896 C C . GLU B 2 25 ? 39.272 19.394 15.262 1.00 48.48 25 B 1 ATOM 2897 O O . GLU B 2 25 ? 38.991 18.308 15.769 1.00 45.96 25 B 1 ATOM 2898 C CB . GLU B 2 25 ? 40.401 19.258 13.082 1.00 45.85 25 B 1 ATOM 2899 C CG . GLU B 2 25 ? 40.319 18.991 11.569 1.00 41.86 25 B 1 ATOM 2900 C CD . GLU B 2 25 ? 41.685 18.617 10.962 1.00 37.08 25 B 1 ATOM 2901 O OE1 . GLU B 2 25 ? 41.687 17.926 9.917 1.00 33.25 25 B 1 ATOM 2902 O OE2 . GLU B 2 25 ? 42.721 19.036 11.527 1.00 36.70 25 B 1 ATOM 2903 N N . ASP B 2 26 ? 39.797 20.376 15.988 1.00 47.18 26 B 1 ATOM 2904 C CA . ASP B 2 26 ? 40.279 20.202 17.374 1.00 47.35 26 B 1 ATOM 2905 C C . ASP B 2 26 ? 39.149 19.960 18.401 1.00 47.45 26 B 1 ATOM 2906 O O . ASP B 2 26 ? 39.351 19.890 19.611 1.00 45.21 26 B 1 ATOM 2907 C CB . ASP B 2 26 ? 41.169 21.409 17.725 1.00 44.28 26 B 1 ATOM 2908 C CG . ASP B 2 26 ? 42.263 21.128 18.768 1.00 37.19 26 B 1 ATOM 2909 O OD1 . ASP B 2 26 ? 42.540 19.945 19.055 1.00 35.30 26 B 1 ATOM 2910 O OD2 . ASP B 2 26 ? 42.852 22.120 19.252 1.00 34.79 26 B 1 ATOM 2911 N N . VAL B 2 27 ? 37.920 19.820 17.919 1.00 50.36 27 B 1 ATOM 2912 C CA . VAL B 2 27 ? 36.704 19.739 18.729 1.00 49.95 27 B 1 ATOM 2913 C C . VAL B 2 27 ? 36.415 18.323 19.232 1.00 49.44 27 B 1 ATOM 2914 O O . VAL B 2 27 ? 35.476 18.132 20.007 1.00 46.48 27 B 1 ATOM 2915 C CB . VAL B 2 27 ? 35.506 20.346 17.974 1.00 47.69 27 B 1 ATOM 2916 C CG1 . VAL B 2 27 ? 34.407 20.762 18.936 1.00 44.99 27 B 1 ATOM 2917 C CG2 . VAL B 2 27 ? 35.882 21.618 17.194 1.00 44.07 27 B 1 ATOM 2918 N N . ASN B 2 28 ? 37.221 17.323 18.862 1.00 51.84 28 B 1 ATOM 2919 C CA . ASN B 2 28 ? 37.042 15.935 19.314 1.00 51.85 28 B 1 ATOM 2920 C C . ASN B 2 28 ? 37.059 15.775 20.846 1.00 51.53 28 B 1 ATOM 2921 O O . ASN B 2 28 ? 36.479 14.823 21.371 1.00 48.20 28 B 1 ATOM 2922 C CB . ASN B 2 28 ? 38.125 15.051 18.666 1.00 48.97 28 B 1 ATOM 2923 C CG . ASN B 2 28 ? 37.786 14.638 17.244 1.00 45.60 28 B 1 ATOM 2924 O OD1 . ASN B 2 28 ? 36.651 14.659 16.817 1.00 42.90 28 B 1 ATOM 2925 N ND2 . ASN B 2 28 ? 38.763 14.214 16.478 1.00 41.46 28 B 1 ATOM 2926 N N . ASN B 2 29 ? 37.687 16.701 21.567 1.00 49.75 29 B 1 ATOM 2927 C CA . ASN B 2 29 ? 37.725 16.714 23.032 1.00 48.54 29 B 1 ATOM 2928 C C . ASN B 2 29 ? 36.604 17.532 23.685 1.00 49.15 29 B 1 ATOM 2929 O O . ASN B 2 29 ? 36.609 17.675 24.908 1.00 46.08 29 B 1 ATOM 2930 C CB . ASN B 2 29 ? 39.119 17.170 23.501 1.00 43.77 29 B 1 ATOM 2931 C CG . ASN B 2 29 ? 40.123 16.039 23.637 1.00 38.48 29 B 1 ATOM 2932 O OD1 . ASN B 2 29 ? 39.808 14.873 23.725 1.00 36.22 29 B 1 ATOM 2933 N ND2 . ASN B 2 29 ? 41.388 16.372 23.709 1.00 34.66 29 B 1 ATOM 2934 N N . LYS B 2 30 ? 35.643 18.091 22.928 1.00 61.50 30 B 1 ATOM 2935 C CA . LYS B 2 30 ? 34.480 18.699 23.575 1.00 63.01 30 B 1 ATOM 2936 C C . LYS B 2 30 ? 33.606 17.595 24.151 1.00 63.92 30 B 1 ATOM 2937 O O . LYS B 2 30 ? 33.125 16.716 23.433 1.00 59.27 30 B 1 ATOM 2938 C CB . LYS B 2 30 ? 33.698 19.630 22.646 1.00 58.68 30 B 1 ATOM 2939 C CG . LYS B 2 30 ? 34.359 21.012 22.564 1.00 54.85 30 B 1 ATOM 2940 C CD . LYS B 2 30 ? 33.487 21.959 21.741 1.00 50.13 30 B 1 ATOM 2941 C CE . LYS B 2 30 ? 34.141 23.334 21.630 1.00 44.78 30 B 1 ATOM 2942 N NZ . LYS B 2 30 ? 33.401 24.178 20.665 1.00 39.85 30 B 1 ATOM 2943 N N . GLU B 2 31 ? 33.370 17.671 25.456 1.00 67.31 31 B 1 ATOM 2944 C CA . GLU B 2 31 ? 32.290 16.933 26.094 1.00 67.47 31 B 1 ATOM 2945 C C . GLU B 2 31 ? 30.969 17.377 25.461 1.00 68.97 31 B 1 ATOM 2946 O O . GLU B 2 31 ? 30.657 18.569 25.405 1.00 63.58 31 B 1 ATOM 2947 C CB . GLU B 2 31 ? 32.301 17.158 27.613 1.00 60.22 31 B 1 ATOM 2948 C CG . GLU B 2 31 ? 33.493 16.452 28.287 1.00 53.25 31 B 1 ATOM 2949 C CD . GLU B 2 31 ? 33.522 16.597 29.819 1.00 47.40 31 B 1 ATOM 2950 O OE1 . GLU B 2 31 ? 34.189 15.755 30.461 1.00 41.94 31 B 1 ATOM 2951 O OE2 . GLU B 2 31 ? 32.913 17.555 30.341 1.00 44.14 31 B 1 ATOM 2952 N N . LEU B 2 32 ? 30.199 16.399 24.943 1.00 70.77 32 B 1 ATOM 2953 C CA . LEU B 2 32 ? 28.819 16.640 24.543 1.00 71.56 32 B 1 ATOM 2954 C C . LEU B 2 32 ? 28.070 17.174 25.760 1.00 72.96 32 B 1 ATOM 2955 O O . LEU B 2 32 ? 28.074 16.507 26.798 1.00 69.54 32 B 1 ATOM 2956 C CB . LEU B 2 32 ? 28.182 15.326 24.058 1.00 67.80 32 B 1 ATOM 2957 C CG . LEU B 2 32 ? 28.377 15.088 22.553 1.00 64.18 32 B 1 ATOM 2958 C CD1 . LEU B 2 32 ? 28.298 13.599 22.241 1.00 61.57 32 B 1 ATOM 2959 C CD2 . LEU B 2 32 ? 27.288 15.800 21.745 1.00 61.42 32 B 1 ATOM 2960 N N . PRO B 2 33 ? 27.423 18.346 25.670 1.00 71.06 33 B 1 ATOM 2961 C CA . PRO B 2 33 ? 26.618 18.828 26.772 1.00 70.28 33 B 1 ATOM 2962 C C . PRO B 2 33 ? 25.487 17.829 27.022 1.00 73.93 33 B 1 ATOM 2963 O O . PRO B 2 33 ? 24.653 17.587 26.146 1.00 69.55 33 B 1 ATOM 2964 C CB . PRO B 2 33 ? 26.138 20.221 26.352 1.00 62.68 33 B 1 ATOM 2965 C CG . PRO B 2 33 ? 26.200 20.193 24.827 1.00 60.81 33 B 1 ATOM 2966 C CD . PRO B 2 33 ? 27.351 19.237 24.525 1.00 63.93 33 B 1 ATOM 2967 N N . GLU B 2 34 ? 25.437 17.247 28.221 1.00 80.45 34 B 1 ATOM 2968 C CA . GLU B 2 34 ? 24.352 16.362 28.642 1.00 82.43 34 B 1 ATOM 2969 C C . GLU B 2 34 ? 23.098 17.184 28.950 1.00 86.54 34 B 1 ATOM 2970 O O . GLU B 2 34 ? 22.695 17.365 30.099 1.00 82.18 34 B 1 ATOM 2971 C CB . GLU B 2 34 ? 24.771 15.477 29.826 1.00 73.07 34 B 1 ATOM 2972 C CG . GLU B 2 34 ? 25.823 14.425 29.451 1.00 63.66 34 B 1 ATOM 2973 C CD . GLU B 2 34 ? 25.925 13.300 30.490 1.00 57.65 34 B 1 ATOM 2974 O OE1 . GLU B 2 34 ? 26.369 12.196 30.100 1.00 51.23 34 B 1 ATOM 2975 O OE2 . GLU B 2 34 ? 25.524 13.518 31.658 1.00 53.44 34 B 1 ATOM 2976 N N . LYS B 2 35 ? 22.457 17.718 27.905 1.00 90.87 35 B 1 ATOM 2977 C CA . LYS B 2 35 ? 21.150 18.348 28.048 1.00 93.29 35 B 1 ATOM 2978 C C . LYS B 2 35 ? 20.111 17.274 28.367 1.00 95.17 35 B 1 ATOM 2979 O O . LYS B 2 35 ? 20.127 16.214 27.747 1.00 94.36 35 B 1 ATOM 2980 C CB . LYS B 2 35 ? 20.786 19.153 26.796 1.00 90.92 35 B 1 ATOM 2981 C CG . LYS B 2 35 ? 21.642 20.422 26.679 1.00 87.83 35 B 1 ATOM 2982 C CD . LYS B 2 35 ? 21.238 21.237 25.451 1.00 83.89 35 B 1 ATOM 2983 C CE . LYS B 2 35 ? 22.123 22.478 25.323 1.00 78.46 35 B 1 ATOM 2984 N NZ . LYS B 2 35 ? 21.971 23.112 23.995 1.00 71.06 35 B 1 ATOM 2985 N N . PRO B 2 36 ? 19.175 17.545 29.306 1.00 95.78 36 B 1 ATOM 2986 C CA . PRO B 2 36 ? 18.173 16.557 29.711 1.00 95.98 36 B 1 ATOM 2987 C C . PRO B 2 36 ? 17.140 16.262 28.617 1.00 96.83 36 B 1 ATOM 2988 O O . PRO B 2 36 ? 16.514 15.207 28.622 1.00 96.06 36 B 1 ATOM 2989 C CB . PRO B 2 36 ? 17.529 17.150 30.967 1.00 94.37 36 B 1 ATOM 2990 C CG . PRO B 2 36 ? 17.706 18.657 30.789 1.00 90.99 36 B 1 ATOM 2991 C CD . PRO B 2 36 ? 19.051 18.765 30.083 1.00 94.29 36 B 1 ATOM 2992 N N . TYR B 2 37 ? 16.940 17.194 27.691 1.00 97.04 37 B 1 ATOM 2993 C CA . TYR B 2 37 ? 16.085 17.033 26.517 1.00 97.23 37 B 1 ATOM 2994 C C . TYR B 2 37 ? 16.443 18.064 25.439 1.00 97.32 37 B 1 ATOM 2995 O O . TYR B 2 37 ? 17.063 19.093 25.721 1.00 96.70 37 B 1 ATOM 2996 C CB . TYR B 2 37 ? 14.601 17.165 26.908 1.00 96.75 37 B 1 ATOM 2997 C CG . TYR B 2 37 ? 14.200 18.519 27.461 1.00 96.35 37 B 1 ATOM 2998 C CD1 . TYR B 2 37 ? 14.184 18.746 28.851 1.00 94.13 37 B 1 ATOM 2999 C CD2 . TYR B 2 37 ? 13.852 19.572 26.591 1.00 93.90 37 B 1 ATOM 3000 C CE1 . TYR B 2 37 ? 13.831 20.000 29.367 1.00 93.02 37 B 1 ATOM 3001 C CE2 . TYR B 2 37 ? 13.500 20.835 27.095 1.00 92.81 37 B 1 ATOM 3002 C CZ . TYR B 2 37 ? 13.492 21.044 28.483 1.00 93.18 37 B 1 ATOM 3003 O OH . TYR B 2 37 ? 13.149 22.275 28.976 1.00 91.50 37 B 1 ATOM 3004 N N . TYR B 2 38 ? 15.973 17.804 24.216 1.00 97.54 38 B 1 ATOM 3005 C CA . TYR B 2 38 ? 15.825 18.793 23.149 1.00 97.44 38 B 1 ATOM 3006 C C . TYR B 2 38 ? 14.354 18.898 22.740 1.00 97.63 38 B 1 ATOM 3007 O O . TYR B 2 38 ? 13.639 17.896 22.717 1.00 97.20 38 B 1 ATOM 3008 C CB . TYR B 2 38 ? 16.702 18.415 21.952 1.00 96.98 38 B 1 ATOM 3009 C CG . TYR B 2 38 ? 18.186 18.544 22.214 1.00 96.76 38 B 1 ATOM 3010 C CD1 . TYR B 2 38 ? 18.801 19.808 22.171 1.00 95.27 38 B 1 ATOM 3011 C CD2 . TYR B 2 38 ? 18.966 17.406 22.502 1.00 95.52 38 B 1 ATOM 3012 C CE1 . TYR B 2 38 ? 20.179 19.942 22.410 1.00 94.53 38 B 1 ATOM 3013 C CE2 . TYR B 2 38 ? 20.350 17.527 22.746 1.00 94.70 38 B 1 ATOM 3014 C CZ . TYR B 2 38 ? 20.950 18.800 22.700 1.00 95.17 38 B 1 ATOM 3015 O OH . TYR B 2 38 ? 22.292 18.922 22.938 1.00 93.89 38 B 1 ATOM 3016 N N . ASP B 2 39 ? 13.902 20.098 22.389 1.00 97.61 39 B 1 ATOM 3017 C CA . ASP B 2 39 ? 12.663 20.304 21.642 1.00 97.44 39 B 1 ATOM 3018 C C . ASP B 2 39 ? 13.052 20.488 20.165 1.00 97.15 39 B 1 ATOM 3019 O O . ASP B 2 39 ? 13.790 21.414 19.829 1.00 95.94 39 B 1 ATOM 3020 C CB . ASP B 2 39 ? 11.867 21.490 22.219 1.00 97.08 39 B 1 ATOM 3021 C CG . ASP B 2 39 ? 11.290 21.228 23.628 1.00 96.40 39 B 1 ATOM 3022 O OD1 . ASP B 2 39 ? 10.912 20.080 23.955 1.00 94.07 39 B 1 ATOM 3023 O OD2 . ASP B 2 39 ? 11.170 22.171 24.445 1.00 93.91 39 B 1 ATOM 3024 N N . VAL B 2 40 ? 12.623 19.562 19.302 1.00 97.57 40 B 1 ATOM 3025 C CA . VAL B 2 40 ? 13.096 19.424 17.916 1.00 97.24 40 B 1 ATOM 3026 C C . VAL B 2 40 ? 11.904 19.340 16.974 1.00 97.81 40 B 1 ATOM 3027 O O . VAL B 2 40 ? 10.874 18.764 17.321 1.00 97.30 40 B 1 ATOM 3028 C CB . VAL B 2 40 ? 13.995 18.182 17.753 1.00 95.17 40 B 1 ATOM 3029 C CG1 . VAL B 2 40 ? 14.610 18.088 16.352 1.00 88.52 40 B 1 ATOM 3030 C CG2 . VAL B 2 40 ? 15.160 18.187 18.752 1.00 88.84 40 B 1 ATOM 3031 N N . GLU B 2 41 ? 12.043 19.879 15.774 1.00 97.77 41 B 1 ATOM 3032 C CA . GLU B 2 41 ? 11.046 19.723 14.719 1.00 97.60 41 B 1 ATOM 3033 C C . GLU B 2 41 ? 11.233 18.369 14.024 1.00 97.80 41 B 1 ATOM 3034 O O . GLU B 2 41 ? 12.283 18.089 13.444 1.00 97.09 41 B 1 ATOM 3035 C CB . GLU B 2 41 ? 11.134 20.920 13.762 1.00 96.64 41 B 1 ATOM 3036 C CG . GLU B 2 41 ? 9.913 20.970 12.836 1.00 85.04 41 B 1 ATOM 3037 C CD . GLU B 2 41 ? 9.870 22.225 11.962 1.00 77.70 41 B 1 ATOM 3038 O OE1 . GLU B 2 41 ? 8.739 22.598 11.574 1.00 70.66 41 B 1 ATOM 3039 O OE2 . GLU B 2 41 ? 10.940 22.800 11.675 1.00 70.73 41 B 1 ATOM 3040 N N . PHE B 2 42 ? 10.221 17.494 14.103 1.00 97.95 42 B 1 ATOM 3041 C CA . PHE B 2 42 ? 10.204 16.187 13.451 1.00 98.18 42 B 1 ATOM 3042 C C . PHE B 2 42 ? 9.302 16.175 12.224 1.00 98.17 42 B 1 ATOM 3043 O O . PHE B 2 42 ? 8.242 16.797 12.198 1.00 97.60 42 B 1 ATOM 3044 C CB . PHE B 2 42 ? 9.805 15.095 14.448 1.00 97.96 42 B 1 ATOM 3045 C CG . PHE B 2 42 ? 10.926 14.401 15.200 1.00 97.88 42 B 1 ATOM 3046 C CD1 . PHE B 2 42 ? 12.275 14.783 15.065 1.00 96.48 42 B 1 ATOM 3047 C CD2 . PHE B 2 42 ? 10.609 13.294 16.008 1.00 96.26 42 B 1 ATOM 3048 C CE1 . PHE B 2 42 ? 13.292 14.061 15.719 1.00 95.20 42 B 1 ATOM 3049 C CE2 . PHE B 2 42 ? 11.621 12.569 16.662 1.00 95.29 42 B 1 ATOM 3050 C CZ . PHE B 2 42 ? 12.961 12.950 16.515 1.00 96.40 42 B 1 ATOM 3051 N N . ASN B 2 43 ? 9.710 15.374 11.234 1.00 98.39 43 B 1 ATOM 3052 C CA . ASN B 2 43 ? 8.984 15.133 9.998 1.00 98.34 43 B 1 ATOM 3053 C C . ASN B 2 43 ? 7.995 13.973 10.182 1.00 98.46 43 B 1 ATOM 3054 O O . ASN B 2 43 ? 8.389 12.801 10.208 1.00 98.19 43 B 1 ATOM 3055 C CB . ASN B 2 43 ? 10.009 14.850 8.895 1.00 98.01 43 B 1 ATOM 3056 C CG . ASN B 2 43 ? 10.876 16.054 8.552 1.00 97.53 43 B 1 ATOM 3057 O OD1 . ASN B 2 43 ? 10.429 17.180 8.498 1.00 94.74 43 B 1 ATOM 3058 N ND2 . ASN B 2 43 ? 12.145 15.836 8.282 1.00 94.45 43 B 1 ATOM 3059 N N . TYR B 2 44 ? 6.705 14.291 10.276 1.00 98.24 44 B 1 ATOM 3060 C CA . TYR B 2 44 ? 5.605 13.329 10.336 1.00 98.29 44 B 1 ATOM 3061 C C . TYR B 2 44 ? 4.939 13.149 8.964 1.00 98.22 44 B 1 ATOM 3062 O O . TYR B 2 44 ? 5.242 13.859 8.000 1.00 98.00 44 B 1 ATOM 3063 C CB . TYR B 2 44 ? 4.612 13.770 11.411 1.00 98.27 44 B 1 ATOM 3064 C CG . TYR B 2 44 ? 5.083 13.504 12.827 1.00 98.49 44 B 1 ATOM 3065 C CD1 . TYR B 2 44 ? 4.780 12.279 13.452 1.00 98.28 44 B 1 ATOM 3066 C CD2 . TYR B 2 44 ? 5.823 14.473 13.534 1.00 98.25 44 B 1 ATOM 3067 C CE1 . TYR B 2 44 ? 5.191 12.030 14.774 1.00 98.22 44 B 1 ATOM 3068 C CE2 . TYR B 2 44 ? 6.242 14.231 14.857 1.00 98.24 44 B 1 ATOM 3069 C CZ . TYR B 2 44 ? 5.917 13.009 15.474 1.00 98.51 44 B 1 ATOM 3070 O OH . TYR B 2 44 ? 6.305 12.773 16.764 1.00 98.38 44 B 1 ATOM 3071 N N . ARG B 2 45 ? 4.005 12.203 8.875 1.00 98.33 45 B 1 ATOM 3072 C CA . ARG B 2 45 ? 3.223 11.964 7.661 1.00 98.34 45 B 1 ATOM 3073 C C . ARG B 2 45 ? 2.415 13.206 7.294 1.00 98.34 45 B 1 ATOM 3074 O O . ARG B 2 45 ? 1.629 13.692 8.105 1.00 98.03 45 B 1 ATOM 3075 C CB . ARG B 2 45 ? 2.300 10.761 7.875 1.00 98.08 45 B 1 ATOM 3076 C CG . ARG B 2 45 ? 1.483 10.410 6.623 1.00 97.60 45 B 1 ATOM 3077 C CD . ARG B 2 45 ? 0.583 9.205 6.886 1.00 96.66 45 B 1 ATOM 3078 N NE . ARG B 2 45 ? -0.242 8.850 5.720 1.00 95.71 45 B 1 ATOM 3079 C CZ . ARG B 2 45 ? -1.463 9.286 5.433 1.00 95.31 45 B 1 ATOM 3080 N NH1 . ARG B 2 45 ? -2.089 10.165 6.157 1.00 92.39 45 B 1 ATOM 3081 N NH2 . ARG B 2 45 ? -2.086 8.818 4.391 1.00 93.00 45 B 1 ATOM 3082 N N . LEU B 2 46 ? 2.544 13.640 6.050 1.00 98.12 46 B 1 ATOM 3083 C CA . LEU B 2 46 ? 1.623 14.572 5.404 1.00 97.95 46 B 1 ATOM 3084 C C . LEU B 2 46 ? 0.476 13.768 4.776 1.00 97.86 46 B 1 ATOM 3085 O O . LEU B 2 46 ? 0.732 12.785 4.075 1.00 97.49 46 B 1 ATOM 3086 C CB . LEU B 2 46 ? 2.415 15.385 4.367 1.00 97.76 46 B 1 ATOM 3087 C CG . LEU B 2 46 ? 1.581 16.414 3.591 1.00 97.31 46 B 1 ATOM 3088 C CD1 . LEU B 2 46 ? 0.959 17.465 4.509 1.00 96.62 46 B 1 ATOM 3089 C CD2 . LEU B 2 46 ? 2.476 17.129 2.579 1.00 96.45 46 B 1 ATOM 3090 N N . ASP B 2 47 ? -0.777 14.168 5.009 1.00 97.90 47 B 1 ATOM 3091 C CA . ASP B 2 47 ? -1.915 13.494 4.385 1.00 97.59 47 B 1 ATOM 3092 C C . ASP B 2 47 ? -1.808 13.585 2.848 1.00 97.65 47 B 1 ATOM 3093 O O . ASP B 2 47 ? -1.521 14.667 2.319 1.00 97.21 47 B 1 ATOM 3094 C CB . ASP B 2 47 ? -3.247 14.078 4.893 1.00 96.89 47 B 1 ATOM 3095 C CG . ASP B 2 47 ? -4.429 13.169 4.517 1.00 95.02 47 B 1 ATOM 3096 O OD1 . ASP B 2 47 ? -4.710 13.030 3.309 1.00 92.18 47 B 1 ATOM 3097 O OD2 . ASP B 2 47 ? -5.007 12.526 5.420 1.00 90.44 47 B 1 ATOM 3098 N N . PRO B 2 48 ? -2.057 12.499 2.092 1.00 97.48 48 B 1 ATOM 3099 C CA . PRO B 2 48 ? -2.063 12.551 0.625 1.00 97.17 48 B 1 ATOM 3100 C C . PRO B 2 48 ? -2.983 13.630 0.036 1.00 97.03 48 B 1 ATOM 3101 O O . PRO B 2 48 ? -2.645 14.222 -0.988 1.00 96.42 48 B 1 ATOM 3102 C CB . PRO B 2 48 ? -2.488 11.151 0.189 1.00 96.68 48 B 1 ATOM 3103 C CG . PRO B 2 48 ? -1.950 10.269 1.311 1.00 95.89 48 B 1 ATOM 3104 C CD . PRO B 2 48 ? -2.173 11.132 2.551 1.00 97.19 48 B 1 ATOM 3105 N N . ARG B 2 49 ? -4.096 13.955 0.700 1.00 97.01 49 B 1 ATOM 3106 C CA . ARG B 2 49 ? -5.003 15.057 0.311 1.00 96.81 49 B 1 ATOM 3107 C C . ARG B 2 49 ? -4.342 16.439 0.393 1.00 96.68 49 B 1 ATOM 3108 O O . ARG B 2 49 ? -4.767 17.363 -0.296 1.00 95.40 49 B 1 ATOM 3109 C CB . ARG B 2 49 ? -6.250 15.048 1.206 1.00 96.14 49 B 1 ATOM 3110 C CG . ARG B 2 49 ? -7.151 13.839 0.950 1.00 94.85 49 B 1 ATOM 3111 C CD . ARG B 2 49 ? -8.365 13.901 1.885 1.00 93.05 49 B 1 ATOM 3112 N NE . ARG B 2 49 ? -9.297 12.797 1.642 1.00 91.42 49 B 1 ATOM 3113 C CZ . ARG B 2 49 ? -9.167 11.545 2.057 1.00 90.40 49 B 1 ATOM 3114 N NH1 . ARG B 2 49 ? -8.153 11.147 2.791 1.00 85.34 49 B 1 ATOM 3115 N NH2 . ARG B 2 49 ? -10.072 10.678 1.729 1.00 87.26 49 B 1 ATOM 3116 N N . ASP B 2 50 ? -3.299 16.570 1.219 1.00 97.21 50 B 1 ATOM 3117 C CA . ASP B 2 50 ? -2.524 17.799 1.397 1.00 97.00 50 B 1 ATOM 3118 C C . ASP B 2 50 ? -1.217 17.799 0.582 1.00 97.05 50 B 1 ATOM 3119 O O . ASP B 2 50 ? -0.426 18.741 0.650 1.00 96.06 50 B 1 ATOM 3120 C CB . ASP B 2 50 ? -2.302 18.037 2.897 1.00 96.69 50 B 1 ATOM 3121 C CG . ASP B 2 50 ? -3.624 18.208 3.667 1.00 95.87 50 B 1 ATOM 3122 O OD1 . ASP B 2 50 ? -4.596 18.730 3.066 1.00 93.78 50 B 1 ATOM 3123 O OD2 . ASP B 2 50 ? -3.663 17.855 4.860 1.00 93.44 50 B 1 ATOM 3124 N N . GLY B 2 51 ? -1.007 16.767 -0.241 1.00 97.13 51 B 1 ATOM 3125 C CA . GLY B 2 51 ? 0.162 16.615 -1.114 1.00 96.90 51 B 1 ATOM 3126 C C . GLY B 2 51 ? 1.226 15.647 -0.595 1.00 97.41 51 B 1 ATOM 3127 O O . GLY B 2 51 ? 2.337 15.634 -1.129 1.00 96.60 51 B 1 ATOM 3128 N N . GLY B 2 52 ? 0.905 14.853 0.426 1.00 97.37 52 B 1 ATOM 3129 C CA . GLY B 2 52 ? 1.741 13.746 0.881 1.00 97.63 52 B 1 ATOM 3130 C C . GLY B 2 52 ? 1.782 12.577 -0.108 1.00 97.82 52 B 1 ATOM 3131 O O . GLY B 2 52 ? 1.111 12.569 -1.145 1.00 97.44 52 B 1 ATOM 3132 N N . ASP B 2 53 ? 2.592 11.580 0.214 1.00 97.89 53 B 1 ATOM 3133 C CA . ASP B 2 53 ? 2.804 10.385 -0.602 1.00 97.98 53 B 1 ATOM 3134 C C . ASP B 2 53 ? 2.227 9.121 0.060 1.00 98.20 53 B 1 ATOM 3135 O O . ASP B 2 53 ? 1.952 9.070 1.257 1.00 97.80 53 B 1 ATOM 3136 C CB . ASP B 2 53 ? 4.306 10.248 -0.930 1.00 97.52 53 B 1 ATOM 3137 C CG . ASP B 2 53 ? 5.195 10.262 0.318 1.00 97.21 53 B 1 ATOM 3138 O OD1 . ASP B 2 53 ? 4.972 9.452 1.243 1.00 95.46 53 B 1 ATOM 3139 O OD2 . ASP B 2 53 ? 6.114 11.104 0.407 1.00 95.08 53 B 1 ATOM 3140 N N . GLU B 2 54 ? 2.053 8.078 -0.757 1.00 97.93 54 B 1 ATOM 3141 C CA . GLU B 2 54 ? 1.713 6.712 -0.330 1.00 97.92 54 B 1 ATOM 3142 C C . GLU B 2 54 ? 2.795 5.702 -0.751 1.00 98.15 54 B 1 ATOM 3143 O O . GLU B 2 54 ? 2.834 4.579 -0.254 1.00 97.54 54 B 1 ATOM 3144 C CB . GLU B 2 54 ? 0.346 6.309 -0.902 1.00 97.40 54 B 1 ATOM 3145 C CG . GLU B 2 54 ? -0.810 7.185 -0.385 1.00 95.53 54 B 1 ATOM 3146 C CD . GLU B 2 54 ? -2.194 6.755 -0.899 1.00 94.59 54 B 1 ATOM 3147 O OE1 . GLU B 2 54 ? -3.203 7.180 -0.287 1.00 87.95 54 B 1 ATOM 3148 O OE2 . GLU B 2 54 ? -2.278 6.013 -1.906 1.00 89.92 54 B 1 ATOM 3149 N N . VAL B 2 55 ? 3.691 6.117 -1.654 1.00 98.35 55 B 1 ATOM 3150 C CA . VAL B 2 55 ? 4.829 5.338 -2.151 1.00 98.38 55 B 1 ATOM 3151 C C . VAL B 2 55 ? 6.082 6.205 -2.090 1.00 98.37 55 B 1 ATOM 3152 O O . VAL B 2 55 ? 6.099 7.317 -2.615 1.00 98.00 55 B 1 ATOM 3153 C CB . VAL B 2 55 ? 4.598 4.844 -3.592 1.00 98.16 55 B 1 ATOM 3154 C CG1 . VAL B 2 55 ? 5.747 3.948 -4.065 1.00 97.25 55 B 1 ATOM 3155 C CG2 . VAL B 2 55 ? 3.299 4.038 -3.720 1.00 97.34 55 B 1 ATOM 3156 N N . ILE B 2 56 ? 7.145 5.691 -1.481 1.00 98.65 56 B 1 ATOM 3157 C CA . ILE B 2 56 ? 8.447 6.357 -1.409 1.00 98.61 56 B 1 ATOM 3158 C C . ILE B 2 56 ? 9.545 5.484 -2.022 1.00 98.64 56 B 1 ATOM 3159 O O . ILE B 2 56 ? 9.498 4.253 -1.969 1.00 98.41 56 B 1 ATOM 3160 C CB . ILE B 2 56 ? 8.785 6.817 0.028 1.00 98.34 56 B 1 ATOM 3161 C CG1 . ILE B 2 56 ? 8.948 5.633 1.010 1.00 97.35 56 B 1 ATOM 3162 C CG2 . ILE B 2 56 ? 7.728 7.821 0.510 1.00 96.80 56 B 1 ATOM 3163 C CD1 . ILE B 2 56 ? 9.426 6.049 2.411 1.00 95.90 56 B 1 ATOM 3164 N N . TRP B 2 57 ? 10.565 6.136 -2.589 1.00 98.46 57 B 1 ATOM 3165 C CA . TRP B 2 57 ? 11.645 5.489 -3.332 1.00 98.37 57 B 1 ATOM 3166 C C . TRP B 2 57 ? 12.951 5.541 -2.534 1.00 98.20 57 B 1 ATOM 3167 O O . TRP B 2 57 ? 13.711 6.511 -2.611 1.00 97.52 57 B 1 ATOM 3168 C CB . TRP B 2 57 ? 11.742 6.135 -4.710 1.00 98.20 57 B 1 ATOM 3169 C CG . TRP B 2 57 ? 10.514 5.931 -5.558 1.00 98.15 57 B 1 ATOM 3170 C CD1 . TRP B 2 57 ? 9.439 6.751 -5.609 1.00 97.47 57 B 1 ATOM 3171 C CD2 . TRP B 2 57 ? 10.186 4.770 -6.388 1.00 97.99 57 B 1 ATOM 3172 N NE1 . TRP B 2 57 ? 8.461 6.192 -6.423 1.00 97.12 57 B 1 ATOM 3173 C CE2 . TRP B 2 57 ? 8.874 4.967 -6.910 1.00 97.46 57 B 1 ATOM 3174 C CE3 . TRP B 2 57 ? 10.864 3.579 -6.723 1.00 97.30 57 B 1 ATOM 3175 C CZ2 . TRP B 2 57 ? 8.241 3.998 -7.719 1.00 96.73 57 B 1 ATOM 3176 C CZ3 . TRP B 2 57 ? 10.236 2.619 -7.541 1.00 96.75 57 B 1 ATOM 3177 C CH2 . TRP B 2 57 ? 8.933 2.823 -8.019 1.00 96.56 57 B 1 ATOM 3178 N N . GLY B 2 58 ? 13.198 4.505 -1.744 1.00 98.12 58 B 1 ATOM 3179 C CA . GLY B 2 58 ? 14.351 4.408 -0.856 1.00 97.91 58 B 1 ATOM 3180 C C . GLY B 2 58 ? 15.683 4.402 -1.613 1.00 97.88 58 B 1 ATOM 3181 O O . GLY B 2 58 ? 15.811 3.798 -2.675 1.00 97.05 58 B 1 ATOM 3182 N N . GLY B 2 59 ? 16.684 5.073 -1.040 1.00 97.55 59 B 1 ATOM 3183 C CA . GLY B 2 59 ? 18.005 5.217 -1.656 1.00 97.27 59 B 1 ATOM 3184 C C . GLY B 2 59 ? 18.049 6.176 -2.853 1.00 97.48 59 B 1 ATOM 3185 O O . GLY B 2 59 ? 19.104 6.294 -3.473 1.00 96.55 59 B 1 ATOM 3186 N N . THR B 2 60 ? 16.956 6.861 -3.183 1.00 97.60 60 B 1 ATOM 3187 C CA . THR B 2 60 ? 16.910 7.856 -4.267 1.00 97.81 60 B 1 ATOM 3188 C C . THR B 2 60 ? 17.062 9.285 -3.744 1.00 97.76 60 B 1 ATOM 3189 O O . THR B 2 60 ? 16.719 9.584 -2.600 1.00 97.38 60 B 1 ATOM 3190 C CB . THR B 2 60 ? 15.637 7.747 -5.118 1.00 97.67 60 B 1 ATOM 3191 O OG1 . THR B 2 60 ? 14.494 8.099 -4.374 1.00 96.72 60 B 1 ATOM 3192 C CG2 . THR B 2 60 ? 15.428 6.350 -5.703 1.00 96.54 60 B 1 ATOM 3193 N N . VAL B 2 61 ? 17.517 10.189 -4.618 1.00 97.66 61 B 1 ATOM 3194 C CA . VAL B 2 61 ? 17.580 11.635 -4.327 1.00 97.54 61 B 1 ATOM 3195 C C . VAL B 2 61 ? 16.185 12.206 -4.038 1.00 97.43 61 B 1 ATOM 3196 O O . VAL B 2 61 ? 16.029 13.021 -3.129 1.00 96.46 61 B 1 ATOM 3197 C CB . VAL B 2 61 ? 18.241 12.379 -5.504 1.00 96.79 61 B 1 ATOM 3198 C CG1 . VAL B 2 61 ? 18.234 13.899 -5.308 1.00 93.67 61 B 1 ATOM 3199 C CG2 . VAL B 2 61 ? 19.703 11.942 -5.672 1.00 93.95 61 B 1 ATOM 3200 N N . GLY B 2 62 ? 15.156 11.736 -4.732 1.00 97.48 62 B 1 ATOM 3201 C CA . GLY B 2 62 ? 13.768 12.163 -4.523 1.00 97.33 62 B 1 ATOM 3202 C C . GLY B 2 62 ? 13.250 11.934 -3.097 1.00 97.57 62 B 1 ATOM 3203 O O . GLY B 2 62 ? 12.436 12.720 -2.613 1.00 97.05 62 B 1 ATOM 3204 N N . LEU B 2 63 ? 13.764 10.931 -2.377 1.00 97.72 63 B 1 ATOM 3205 C CA . LEU B 2 63 ? 13.399 10.704 -0.969 1.00 97.70 63 B 1 ATOM 3206 C C . LEU B 2 63 ? 13.785 11.892 -0.072 1.00 97.61 63 B 1 ATOM 3207 O O . LEU B 2 63 ? 13.061 12.206 0.871 1.00 96.97 63 B 1 ATOM 3208 C CB . LEU B 2 63 ? 14.034 9.393 -0.473 1.00 97.42 63 B 1 ATOM 3209 C CG . LEU B 2 63 ? 13.635 9.007 0.970 1.00 95.23 63 B 1 ATOM 3210 C CD1 . LEU B 2 63 ? 12.130 8.771 1.115 1.00 92.82 63 B 1 ATOM 3211 C CD2 . LEU B 2 63 ? 14.354 7.726 1.387 1.00 92.15 63 B 1 ATOM 3212 N N . MET B 2 64 ? 14.881 12.591 -0.388 1.00 96.97 64 B 1 ATOM 3213 C CA . MET B 2 64 ? 15.325 13.787 0.347 1.00 96.23 64 B 1 ATOM 3214 C C . MET B 2 64 ? 14.429 15.009 0.075 1.00 96.58 64 B 1 ATOM 3215 O O . MET B 2 64 ? 14.454 15.975 0.827 1.00 95.09 64 B 1 ATOM 3216 C CB . MET B 2 64 ? 16.787 14.104 -0.012 1.00 94.67 64 B 1 ATOM 3217 C CG . MET B 2 64 ? 17.725 12.898 0.144 1.00 86.83 64 B 1 ATOM 3218 S SD . MET B 2 64 ? 17.814 12.183 1.809 1.00 76.25 64 B 1 ATOM 3219 C CE . MET B 2 64 ? 19.155 13.186 2.474 1.00 65.64 64 B 1 ATOM 3220 N N . ARG B 2 65 ? 13.606 14.952 -0.974 1.00 97.30 65 B 1 ATOM 3221 C CA . ARG B 2 65 ? 12.626 15.981 -1.382 1.00 97.07 65 B 1 ATOM 3222 C C . ARG B 2 65 ? 11.199 15.676 -0.909 1.00 97.21 65 B 1 ATOM 3223 O O . ARG B 2 65 ? 10.275 16.430 -1.217 1.00 96.23 65 B 1 ATOM 3224 C CB . ARG B 2 65 ? 12.673 16.151 -2.910 1.00 96.40 65 B 1 ATOM 3225 C CG . ARG B 2 65 ? 14.072 16.552 -3.406 1.00 95.84 65 B 1 ATOM 3226 C CD . ARG B 2 65 ? 14.112 16.591 -4.933 1.00 94.76 65 B 1 ATOM 3227 N NE . ARG B 2 65 ? 15.473 16.892 -5.399 1.00 94.93 65 B 1 ATOM 3228 C CZ . ARG B 2 65 ? 16.066 16.453 -6.492 1.00 95.34 65 B 1 ATOM 3229 N NH1 . ARG B 2 65 ? 15.465 15.716 -7.378 1.00 92.74 65 B 1 ATOM 3230 N NH2 . ARG B 2 65 ? 17.306 16.748 -6.716 1.00 92.87 65 B 1 ATOM 3231 N N . ARG B 2 66 ? 11.012 14.578 -0.182 1.00 97.47 66 B 1 ATOM 3232 C CA . ARG B 2 66 ? 9.713 14.157 0.351 1.00 97.58 66 B 1 ATOM 3233 C C . ARG B 2 66 ? 9.101 15.258 1.216 1.00 97.65 66 B 1 ATOM 3234 O O . ARG B 2 66 ? 9.801 15.902 1.998 1.00 97.09 66 B 1 ATOM 3235 C CB . ARG B 2 66 ? 9.900 12.852 1.130 1.00 97.08 66 B 1 ATOM 3236 C CG . ARG B 2 66 ? 8.569 12.258 1.604 1.00 95.63 66 B 1 ATOM 3237 C CD . ARG B 2 66 ? 8.797 10.970 2.391 1.00 94.62 66 B 1 ATOM 3238 N NE . ARG B 2 66 ? 7.515 10.339 2.699 1.00 94.77 66 B 1 ATOM 3239 C CZ . ARG B 2 66 ? 7.216 9.509 3.669 1.00 95.25 66 B 1 ATOM 3240 N NH1 . ARG B 2 66 ? 8.088 9.129 4.556 1.00 92.13 66 B 1 ATOM 3241 N NH2 . ARG B 2 66 ? 6.008 9.039 3.743 1.00 91.78 66 B 1 ATOM 3242 N N . LYS B 2 67 ? 7.784 15.441 1.100 1.00 97.99 67 B 1 ATOM 3243 C CA . LYS B 2 67 ? 7.035 16.412 1.897 1.00 97.88 67 B 1 ATOM 3244 C C . LYS B 2 67 ? 6.528 15.765 3.183 1.00 98.21 67 B 1 ATOM 3245 O O . LYS B 2 67 ? 6.086 14.615 3.184 1.00 97.81 67 B 1 ATOM 3246 C CB . LYS B 2 67 ? 5.885 17.002 1.080 1.00 97.04 67 B 1 ATOM 3247 C CG . LYS B 2 67 ? 6.395 17.780 -0.143 1.00 93.31 67 B 1 ATOM 3248 C CD . LYS B 2 67 ? 5.218 18.390 -0.901 1.00 86.27 67 B 1 ATOM 3249 C CE . LYS B 2 67 ? 5.733 19.130 -2.138 1.00 78.17 67 B 1 ATOM 3250 N NZ . LYS B 2 67 ? 4.616 19.739 -2.884 1.00 67.67 67 B 1 ATOM 3251 N N . TYR B 2 68 ? 6.554 16.541 4.261 1.00 98.26 68 B 1 ATOM 3252 C CA . TYR B 2 68 ? 6.105 16.120 5.586 1.00 98.27 68 B 1 ATOM 3253 C C . TYR B 2 68 ? 5.172 17.165 6.185 1.00 98.24 68 B 1 ATOM 3254 O O . TYR B 2 68 ? 5.153 18.320 5.759 1.00 97.73 68 B 1 ATOM 3255 C CB . TYR B 2 68 ? 7.323 15.894 6.489 1.00 98.10 68 B 1 ATOM 3256 C CG . TYR B 2 68 ? 8.282 14.846 5.966 1.00 98.00 68 B 1 ATOM 3257 C CD1 . TYR B 2 68 ? 8.011 13.480 6.157 1.00 97.20 68 B 1 ATOM 3258 C CD2 . TYR B 2 68 ? 9.441 15.229 5.261 1.00 97.20 68 B 1 ATOM 3259 C CE1 . TYR B 2 68 ? 8.891 12.502 5.664 1.00 96.54 68 B 1 ATOM 3260 C CE2 . TYR B 2 68 ? 10.330 14.259 4.761 1.00 96.55 68 B 1 ATOM 3261 C CZ . TYR B 2 68 ? 10.051 12.894 4.969 1.00 96.60 68 B 1 ATOM 3262 O OH . TYR B 2 68 ? 10.920 11.943 4.496 1.00 95.29 68 B 1 ATOM 3263 N N . GLU B 2 69 ? 4.431 16.757 7.214 1.00 98.05 69 B 1 ATOM 3264 C CA . GLU B 2 69 ? 3.857 17.684 8.173 1.00 97.97 69 B 1 ATOM 3265 C C . GLU B 2 69 ? 4.780 17.726 9.392 1.00 98.09 69 B 1 ATOM 3266 O O . GLU B 2 69 ? 5.016 16.707 10.041 1.00 97.68 69 B 1 ATOM 3267 C CB . GLU B 2 69 ? 2.420 17.284 8.505 1.00 97.51 69 B 1 ATOM 3268 C CG . GLU B 2 69 ? 1.755 18.393 9.321 1.00 94.11 69 B 1 ATOM 3269 C CD . GLU B 2 69 ? 0.239 18.232 9.488 1.00 93.49 69 B 1 ATOM 3270 O OE1 . GLU B 2 69 ? -0.319 19.051 10.257 1.00 87.23 69 B 1 ATOM 3271 O OE2 . GLU B 2 69 ? -0.363 17.312 8.903 1.00 88.63 69 B 1 ATOM 3272 N N . THR B 2 70 ? 5.357 18.886 9.690 1.00 98.05 70 B 1 ATOM 3273 C CA . THR B 2 70 ? 6.322 19.019 10.779 1.00 97.89 70 B 1 ATOM 3274 C C . THR B 2 70 ? 5.633 19.308 12.108 1.00 98.00 70 B 1 ATOM 3275 O O . THR B 2 70 ? 4.583 19.956 12.176 1.00 97.30 70 B 1 ATOM 3276 C CB . THR B 2 70 ? 7.424 20.042 10.472 1.00 96.70 70 B 1 ATOM 3277 O OG1 . THR B 2 70 ? 6.883 21.328 10.322 1.00 87.37 70 B 1 ATOM 3278 C CG2 . THR B 2 70 ? 8.194 19.689 9.199 1.00 84.96 70 B 1 ATOM 3279 N N . ARG B 2 71 ? 6.218 18.801 13.206 1.00 98.01 71 B 1 ATOM 3280 C CA . ARG B 2 71 ? 5.777 19.091 14.578 1.00 97.84 71 B 1 ATOM 3281 C C . ARG B 2 71 ? 6.965 19.178 15.512 1.00 97.96 71 B 1 ATOM 3282 O O . ARG B 2 71 ? 7.820 18.294 15.510 1.00 97.42 71 B 1 ATOM 3283 C CB . ARG B 2 71 ? 4.813 18.013 15.091 1.00 97.41 71 B 1 ATOM 3284 C CG . ARG B 2 71 ? 3.424 18.036 14.451 1.00 95.46 71 B 1 ATOM 3285 C CD . ARG B 2 71 ? 2.623 19.297 14.841 1.00 94.50 71 B 1 ATOM 3286 N NE . ARG B 2 71 ? 1.255 19.244 14.319 1.00 93.63 71 B 1 ATOM 3287 C CZ . ARG B 2 71 ? 0.863 19.569 13.090 1.00 93.38 71 B 1 ATOM 3288 N NH1 . ARG B 2 71 ? 1.669 20.057 12.198 1.00 88.63 71 B 1 ATOM 3289 N NH2 . ARG B 2 71 ? -0.368 19.387 12.739 1.00 88.83 71 B 1 ATOM 3290 N N . THR B 2 72 ? 6.966 20.174 16.384 1.00 97.69 72 B 1 ATOM 3291 C CA . THR B 2 72 ? 7.901 20.212 17.508 1.00 97.72 72 B 1 ATOM 3292 C C . THR B 2 72 ? 7.544 19.121 18.509 1.00 97.93 72 B 1 ATOM 3293 O O . THR B 2 72 ? 6.400 19.026 18.963 1.00 97.45 72 B 1 ATOM 3294 C CB . THR B 2 72 ? 7.912 21.578 18.195 1.00 96.97 72 B 1 ATOM 3295 O OG1 . THR B 2 72 ? 8.102 22.594 17.247 1.00 92.33 72 B 1 ATOM 3296 C CG2 . THR B 2 72 ? 9.049 21.700 19.213 1.00 91.66 72 B 1 ATOM 3297 N N . VAL B 2 73 ? 8.538 18.307 18.887 1.00 97.91 73 B 1 ATOM 3298 C CA . VAL B 2 73 ? 8.426 17.255 19.900 1.00 97.84 73 B 1 ATOM 3299 C C . VAL B 2 73 ? 9.545 17.386 20.926 1.00 97.88 73 B 1 ATOM 3300 O O . VAL B 2 73 ? 10.643 17.841 20.614 1.00 97.52 73 B 1 ATOM 3301 C CB . VAL B 2 73 ? 8.426 15.843 19.282 1.00 97.33 73 B 1 ATOM 3302 C CG1 . VAL B 2 73 ? 7.225 15.643 18.356 1.00 95.05 73 B 1 ATOM 3303 C CG2 . VAL B 2 73 ? 9.710 15.515 18.505 1.00 94.89 73 B 1 ATOM 3304 N N . ARG B 2 74 ? 9.280 16.942 22.168 1.00 97.83 74 B 1 ATOM 3305 C CA . ARG B 2 74 ? 10.309 16.823 23.206 1.00 97.78 74 B 1 ATOM 3306 C C . ARG B 2 74 ? 10.954 15.444 23.150 1.00 97.91 74 B 1 ATOM 3307 O O . ARG B 2 74 ? 10.255 14.440 23.284 1.00 97.43 74 B 1 ATOM 3308 C CB . ARG B 2 74 ? 9.714 17.135 24.576 1.00 97.32 74 B 1 ATOM 3309 C CG . ARG B 2 74 ? 10.783 17.033 25.678 1.00 95.62 74 B 1 ATOM 3310 C CD . ARG B 2 74 ? 10.376 17.815 26.926 1.00 93.50 74 B 1 ATOM 3311 N NE . ARG B 2 74 ? 10.411 19.252 26.632 1.00 91.76 74 B 1 ATOM 3312 C CZ . ARG B 2 74 ? 10.057 20.253 27.414 1.00 91.30 74 B 1 ATOM 3313 N NH1 . ARG B 2 74 ? 9.629 20.060 28.633 1.00 85.66 74 B 1 ATOM 3314 N NH2 . ARG B 2 74 ? 10.145 21.467 26.947 1.00 88.08 74 B 1 ATOM 3315 N N . ILE B 2 75 ? 12.276 15.413 23.019 1.00 98.18 75 B 1 ATOM 3316 C CA . ILE B 2 75 ? 13.084 14.192 23.020 1.00 98.17 75 B 1 ATOM 3317 C C . ILE B 2 75 ? 13.918 14.184 24.298 1.00 98.08 75 B 1 ATOM 3318 O O . ILE B 2 75 ? 14.790 15.039 24.467 1.00 97.80 75 B 1 ATOM 3319 C CB . ILE B 2 75 ? 13.976 14.104 21.767 1.00 98.04 75 B 1 ATOM 3320 C CG1 . ILE B 2 75 ? 13.172 14.377 20.475 1.00 96.90 75 B 1 ATOM 3321 C CG2 . ILE B 2 75 ? 14.634 12.711 21.724 1.00 96.94 75 B 1 ATOM 3322 C CD1 . ILE B 2 75 ? 14.042 14.400 19.220 1.00 94.22 75 B 1 ATOM 3323 N N . ASN B 2 76 ? 13.656 13.249 25.218 1.00 98.10 76 B 1 ATOM 3324 C CA . ASN B 2 76 ? 14.341 13.175 26.506 1.00 97.95 76 B 1 ATOM 3325 C C . ASN B 2 76 ? 15.657 12.407 26.361 1.00 98.05 76 B 1 ATOM 3326 O O . ASN B 2 76 ? 15.701 11.363 25.708 1.00 97.71 76 B 1 ATOM 3327 C CB . ASN B 2 76 ? 13.427 12.535 27.559 1.00 97.56 76 B 1 ATOM 3328 C CG . ASN B 2 76 ? 12.073 13.222 27.660 1.00 95.01 76 B 1 ATOM 3329 O OD1 . ASN B 2 76 ? 11.914 14.315 28.186 1.00 86.44 76 B 1 ATOM 3330 N ND2 . ASN B 2 76 ? 11.046 12.595 27.127 1.00 84.13 76 B 1 ATOM 3331 N N . ASN B 2 77 ? 16.722 12.904 26.996 1.00 97.56 77 B 1 ATOM 3332 C CA . ASN B 2 77 ? 18.002 12.213 27.057 1.00 97.47 77 B 1 ATOM 3333 C C . ASN B 2 77 ? 18.002 11.216 28.217 1.00 97.45 77 B 1 ATOM 3334 O O . ASN B 2 77 ? 17.958 11.614 29.379 1.00 97.02 77 B 1 ATOM 3335 C CB . ASN B 2 77 ? 19.129 13.246 27.168 1.00 96.99 77 B 1 ATOM 3336 C CG . ASN B 2 77 ? 20.513 12.620 27.134 1.00 96.74 77 B 1 ATOM 3337 O OD1 . ASN B 2 77 ? 20.714 11.450 26.852 1.00 94.88 77 B 1 ATOM 3338 N ND2 . ASN B 2 77 ? 21.527 13.414 27.397 1.00 94.20 77 B 1 ATOM 3339 N N . GLU B 2 78 ? 18.089 9.937 27.901 1.00 97.51 78 B 1 ATOM 3340 C CA . GLU B 2 78 ? 18.049 8.836 28.867 1.00 97.42 78 B 1 ATOM 3341 C C . GLU B 2 78 ? 19.444 8.300 29.229 1.00 97.20 78 B 1 ATOM 3342 O O . GLU B 2 78 ? 19.570 7.211 29.797 1.00 96.55 78 B 1 ATOM 3343 C CB . GLU B 2 78 ? 17.128 7.726 28.346 1.00 97.54 78 B 1 ATOM 3344 C CG . GLU B 2 78 ? 15.712 8.207 27.990 1.00 97.12 78 B 1 ATOM 3345 C CD . GLU B 2 78 ? 14.947 8.874 29.144 1.00 97.44 78 B 1 ATOM 3346 O OE1 . GLU B 2 78 ? 13.982 9.618 28.849 1.00 93.96 78 B 1 ATOM 3347 O OE2 . GLU B 2 78 ? 15.289 8.635 30.329 1.00 95.07 78 B 1 ATOM 3348 N N . ARG B 2 79 ? 20.513 9.043 28.927 1.00 97.06 79 B 1 ATOM 3349 C CA . ARG B 2 79 ? 21.869 8.685 29.373 1.00 96.80 79 B 1 ATOM 3350 C C . ARG B 2 79 ? 21.886 8.536 30.896 1.00 96.71 79 B 1 ATOM 3351 O O . ARG B 2 79 ? 21.523 9.460 31.615 1.00 95.95 79 B 1 ATOM 3352 C CB . ARG B 2 79 ? 22.877 9.729 28.862 1.00 96.35 79 B 1 ATOM 3353 C CG . ARG B 2 79 ? 24.318 9.486 29.311 1.00 95.17 79 B 1 ATOM 3354 C CD . ARG B 2 79 ? 24.886 8.113 28.900 1.00 94.03 79 B 1 ATOM 3355 N NE . ARG B 2 79 ? 25.128 8.000 27.448 1.00 93.55 79 B 1 ATOM 3356 C CZ . ARG B 2 79 ? 25.431 6.870 26.810 1.00 94.63 79 B 1 ATOM 3357 N NH1 . ARG B 2 79 ? 25.416 5.707 27.401 1.00 90.00 79 B 1 ATOM 3358 N NH2 . ARG B 2 79 ? 25.780 6.878 25.567 1.00 91.03 79 B 1 ATOM 3359 N N . GLY B 2 80 ? 22.296 7.364 31.371 1.00 95.45 80 B 1 ATOM 3360 C CA . GLY B 2 80 ? 22.253 6.964 32.786 1.00 95.20 80 B 1 ATOM 3361 C C . GLY B 2 80 ? 20.967 6.245 33.207 1.00 95.98 80 B 1 ATOM 3362 O O . GLY B 2 80 ? 20.962 5.570 34.238 1.00 94.71 80 B 1 ATOM 3363 N N . ASN B 2 81 ? 19.887 6.318 32.400 1.00 96.53 81 B 1 ATOM 3364 C CA . ASN B 2 81 ? 18.603 5.653 32.640 1.00 96.66 81 B 1 ATOM 3365 C C . ASN B 2 81 ? 18.334 4.487 31.679 1.00 97.43 81 B 1 ATOM 3366 O O . ASN B 2 81 ? 17.223 3.949 31.673 1.00 96.69 81 B 1 ATOM 3367 C CB . ASN B 2 81 ? 17.466 6.678 32.542 1.00 94.92 81 B 1 ATOM 3368 C CG . ASN B 2 81 ? 17.540 7.789 33.570 1.00 88.14 81 B 1 ATOM 3369 O OD1 . ASN B 2 81 ? 17.958 7.613 34.705 1.00 79.65 81 B 1 ATOM 3370 N ND2 . ASN B 2 81 ? 17.079 8.959 33.187 1.00 78.37 81 B 1 ATOM 3371 N N . GLU B 2 82 ? 19.311 4.064 30.883 1.00 97.15 82 B 1 ATOM 3372 C CA . GLU B 2 82 ? 19.135 3.070 29.812 1.00 97.12 82 B 1 ATOM 3373 C C . GLU B 2 82 ? 18.479 1.767 30.303 1.00 97.29 82 B 1 ATOM 3374 O O . GLU B 2 82 ? 17.676 1.151 29.607 1.00 96.17 82 B 1 ATOM 3375 C CB . GLU B 2 82 ? 20.498 2.737 29.176 1.00 95.93 82 B 1 ATOM 3376 C CG . GLU B 2 82 ? 21.265 3.928 28.577 1.00 93.37 82 B 1 ATOM 3377 C CD . GLU B 2 82 ? 22.273 4.592 29.530 1.00 94.59 82 B 1 ATOM 3378 O OE1 . GLU B 2 82 ? 23.306 5.101 29.035 1.00 88.60 82 B 1 ATOM 3379 O OE2 . GLU B 2 82 ? 22.049 4.595 30.762 1.00 90.31 82 B 1 ATOM 3380 N N . HIS B 2 83 ? 18.781 1.372 31.543 1.00 97.09 83 B 1 ATOM 3381 C CA . HIS B 2 83 ? 18.261 0.163 32.185 1.00 96.54 83 B 1 ATOM 3382 C C . HIS B 2 83 ? 16.756 0.211 32.511 1.00 97.09 83 B 1 ATOM 3383 O O . HIS B 2 83 ? 16.170 -0.830 32.816 1.00 95.98 83 B 1 ATOM 3384 C CB . HIS B 2 83 ? 19.077 -0.097 33.458 1.00 95.20 83 B 1 ATOM 3385 C CG . HIS B 2 83 ? 18.939 0.993 34.498 1.00 89.95 83 B 1 ATOM 3386 N ND1 . HIS B 2 83 ? 19.657 2.172 34.563 1.00 78.22 83 B 1 ATOM 3387 C CD2 . HIS B 2 83 ? 18.062 1.010 35.562 1.00 78.84 83 B 1 ATOM 3388 C CE1 . HIS B 2 83 ? 19.230 2.872 35.626 1.00 77.95 83 B 1 ATOM 3389 N NE2 . HIS B 2 83 ? 18.263 2.200 36.261 1.00 79.65 83 B 1 ATOM 3390 N N . ASN B 2 84 ? 16.117 1.377 32.447 1.00 97.06 84 B 1 ATOM 3391 C CA . ASN B 2 84 ? 14.682 1.534 32.692 1.00 97.27 84 B 1 ATOM 3392 C C . ASN B 2 84 ? 13.819 1.208 31.462 1.00 97.74 84 B 1 ATOM 3393 O O . ASN B 2 84 ? 12.593 1.151 31.577 1.00 96.81 84 B 1 ATOM 3394 C CB . ASN B 2 84 ? 14.410 2.957 33.203 1.00 96.56 84 B 1 ATOM 3395 C CG . ASN B 2 84 ? 15.019 3.214 34.574 1.00 93.92 84 B 1 ATOM 3396 O OD1 . ASN B 2 84 ? 15.037 2.367 35.451 1.00 86.67 84 B 1 ATOM 3397 N ND2 . ASN B 2 84 ? 15.517 4.408 34.804 1.00 84.71 84 B 1 ATOM 3398 N N . PHE B 2 85 ? 14.427 0.990 30.305 1.00 97.94 85 B 1 ATOM 3399 C CA . PHE B 2 85 ? 13.745 0.701 29.047 1.00 98.06 85 B 1 ATOM 3400 C C . PHE B 2 85 ? 13.937 -0.759 28.632 1.00 97.93 85 B 1 ATOM 3401 O O . PHE B 2 85 ? 15.023 -1.323 28.757 1.00 97.09 85 B 1 ATOM 3402 C CB . PHE B 2 85 ? 14.223 1.677 27.968 1.00 98.03 85 B 1 ATOM 3403 C CG . PHE B 2 85 ? 13.939 3.122 28.314 1.00 98.29 85 B 1 ATOM 3404 C CD1 . PHE B 2 85 ? 12.690 3.692 28.014 1.00 97.46 85 B 1 ATOM 3405 C CD2 . PHE B 2 85 ? 14.900 3.882 29.011 1.00 97.61 85 B 1 ATOM 3406 C CE1 . PHE B 2 85 ? 12.399 5.009 28.400 1.00 97.11 85 B 1 ATOM 3407 C CE2 . PHE B 2 85 ? 14.612 5.200 29.405 1.00 97.26 85 B 1 ATOM 3408 C CZ . PHE B 2 85 ? 13.358 5.760 29.102 1.00 97.67 85 B 1 ATOM 3409 N N . ASN B 2 86 ? 12.878 -1.386 28.137 1.00 98.25 86 B 1 ATOM 3410 C CA . ASN B 2 86 ? 12.906 -2.778 27.697 1.00 98.12 86 B 1 ATOM 3411 C C . ASN B 2 86 ? 12.021 -3.013 26.466 1.00 98.45 86 B 1 ATOM 3412 O O . ASN B 2 86 ? 11.051 -2.294 26.211 1.00 98.14 86 B 1 ATOM 3413 C CB . ASN B 2 86 ? 12.549 -3.702 28.878 1.00 96.94 86 B 1 ATOM 3414 C CG . ASN B 2 86 ? 11.095 -3.566 29.290 1.00 95.74 86 B 1 ATOM 3415 O OD1 . ASN B 2 86 ? 10.198 -4.100 28.660 1.00 90.08 86 B 1 ATOM 3416 N ND2 . ASN B 2 86 ? 10.818 -2.836 30.347 1.00 87.80 86 B 1 ATOM 3417 N N . LEU B 2 87 ? 12.354 -4.071 25.726 1.00 98.19 87 B 1 ATOM 3418 C CA . LEU B 2 87 ? 11.712 -4.428 24.459 1.00 98.26 87 B 1 ATOM 3419 C C . LEU B 2 87 ? 10.220 -4.772 24.592 1.00 98.23 87 B 1 ATOM 3420 O O . LEU B 2 87 ? 9.472 -4.555 23.646 1.00 97.71 87 B 1 ATOM 3421 C CB . LEU B 2 87 ? 12.457 -5.628 23.851 1.00 98.18 87 B 1 ATOM 3422 C CG . LEU B 2 87 ? 13.822 -5.280 23.228 1.00 97.87 87 B 1 ATOM 3423 C CD1 . LEU B 2 87 ? 14.608 -6.562 22.973 1.00 97.27 87 B 1 ATOM 3424 C CD2 . LEU B 2 87 ? 13.649 -4.554 21.890 1.00 96.84 87 B 1 ATOM 3425 N N . ASP B 2 88 ? 9.775 -5.319 25.726 1.00 98.13 88 B 1 ATOM 3426 C CA . ASP B 2 88 ? 8.383 -5.760 25.864 1.00 97.82 88 B 1 ATOM 3427 C C . ASP B 2 88 ? 7.451 -4.626 26.305 1.00 98.15 88 B 1 ATOM 3428 O O . ASP B 2 88 ? 6.299 -4.563 25.869 1.00 97.38 88 B 1 ATOM 3429 C CB . ASP B 2 88 ? 8.303 -6.967 26.804 1.00 96.35 88 B 1 ATOM 3430 C CG . ASP B 2 88 ? 8.908 -8.241 26.195 1.00 92.51 88 B 1 ATOM 3431 O OD1 . ASP B 2 88 ? 8.937 -8.363 24.944 1.00 88.99 88 B 1 ATOM 3432 O OD2 . ASP B 2 88 ? 9.319 -9.115 26.986 1.00 87.60 88 B 1 ATOM 3433 N N . THR B 2 89 ? 7.946 -3.686 27.121 1.00 98.10 89 B 1 ATOM 3434 C CA . THR B 2 89 ? 7.149 -2.556 27.624 1.00 98.30 89 B 1 ATOM 3435 C C . THR B 2 89 ? 7.186 -1.347 26.691 1.00 98.51 89 B 1 ATOM 3436 O O . THR B 2 89 ? 6.141 -0.762 26.399 1.00 98.22 89 B 1 ATOM 3437 C CB . THR B 2 89 ? 7.619 -2.141 29.028 1.00 97.94 89 B 1 ATOM 3438 O OG1 . THR B 2 89 ? 7.639 -3.250 29.889 1.00 95.77 89 B 1 ATOM 3439 C CG2 . THR B 2 89 ? 6.692 -1.107 29.672 1.00 95.11 89 B 1 ATOM 3440 N N . HIS B 2 90 ? 8.384 -0.955 26.250 1.00 98.54 90 B 1 ATOM 3441 C CA . HIS B 2 90 ? 8.616 0.269 25.474 1.00 98.60 90 B 1 ATOM 3442 C C . HIS B 2 90 ? 8.789 -0.016 23.978 1.00 98.66 90 B 1 ATOM 3443 O O . HIS B 2 90 ? 8.557 0.862 23.153 1.00 98.44 90 B 1 ATOM 3444 C CB . HIS B 2 90 ? 9.845 0.997 26.030 1.00 98.53 90 B 1 ATOM 3445 C CG . HIS B 2 90 ? 9.813 1.195 27.522 1.00 98.42 90 B 1 ATOM 3446 N ND1 . HIS B 2 90 ? 10.261 0.296 28.467 1.00 93.65 90 B 1 ATOM 3447 C CD2 . HIS B 2 90 ? 9.322 2.278 28.215 1.00 93.74 90 B 1 ATOM 3448 C CE1 . HIS B 2 90 ? 10.049 0.830 29.683 1.00 94.21 90 B 1 ATOM 3449 N NE2 . HIS B 2 90 ? 9.480 2.030 29.574 1.00 95.55 90 B 1 ATOM 3450 N N . GLY B 2 91 ? 9.183 -1.237 23.629 1.00 98.53 91 B 1 ATOM 3451 C CA . GLY B 2 91 ? 9.519 -1.672 22.275 1.00 98.58 91 B 1 ATOM 3452 C C . GLY B 2 91 ? 10.996 -1.510 21.906 1.00 98.69 91 B 1 ATOM 3453 O O . GLY B 2 91 ? 11.405 -1.948 20.837 1.00 98.46 91 B 1 ATOM 3454 N N . PHE B 2 92 ? 11.803 -0.922 22.787 1.00 98.65 92 B 1 ATOM 3455 C CA . PHE B 2 92 ? 13.236 -0.721 22.566 1.00 98.67 92 B 1 ATOM 3456 C C . PHE B 2 92 ? 14.045 -0.943 23.847 1.00 98.64 92 B 1 ATOM 3457 O O . PHE B 2 92 ? 13.515 -0.888 24.955 1.00 98.44 92 B 1 ATOM 3458 C CB . PHE B 2 92 ? 13.487 0.672 21.968 1.00 98.64 92 B 1 ATOM 3459 C CG . PHE B 2 92 ? 13.002 1.818 22.833 1.00 98.74 92 B 1 ATOM 3460 C CD1 . PHE B 2 92 ? 11.742 2.401 22.589 1.00 98.24 92 B 1 ATOM 3461 C CD2 . PHE B 2 92 ? 13.788 2.299 23.895 1.00 98.26 92 B 1 ATOM 3462 C CE1 . PHE B 2 92 ? 11.277 3.445 23.402 1.00 98.06 92 B 1 ATOM 3463 C CE2 . PHE B 2 92 ? 13.324 3.342 24.715 1.00 98.03 92 B 1 ATOM 3464 C CZ . PHE B 2 92 ? 12.067 3.912 24.466 1.00 98.37 92 B 1 ATOM 3465 N N . ALA B 2 93 ? 15.344 -1.180 23.687 1.00 98.54 93 B 1 ATOM 3466 C CA . ALA B 2 93 ? 16.288 -1.267 24.791 1.00 98.47 93 B 1 ATOM 3467 C C . ALA B 2 93 ? 17.696 -0.883 24.328 1.00 98.58 93 B 1 ATOM 3468 O O . ALA B 2 93 ? 18.118 -1.268 23.235 1.00 98.33 93 B 1 ATOM 3469 C CB . ALA B 2 93 ? 16.275 -2.694 25.357 1.00 98.04 93 B 1 ATOM 3470 N N . TRP B 2 94 ? 18.432 -0.168 25.170 1.00 98.49 94 B 1 ATOM 3471 C CA . TRP B 2 94 ? 19.872 0.013 24.989 1.00 98.48 94 B 1 ATOM 3472 C C . TRP B 2 94 ? 20.635 -1.129 25.660 1.00 98.34 94 B 1 ATOM 3473 O O . TRP B 2 94 ? 20.285 -1.581 26.749 1.00 98.00 94 B 1 ATOM 3474 C CB . TRP B 2 94 ? 20.327 1.376 25.510 1.00 98.34 94 B 1 ATOM 3475 C CG . TRP B 2 94 ? 19.793 2.536 24.731 1.00 98.43 94 B 1 ATOM 3476 C CD1 . TRP B 2 94 ? 20.335 3.051 23.606 1.00 97.83 94 B 1 ATOM 3477 C CD2 . TRP B 2 94 ? 18.589 3.321 24.996 1.00 98.42 94 B 1 ATOM 3478 N NE1 . TRP B 2 94 ? 19.555 4.114 23.160 1.00 97.89 94 B 1 ATOM 3479 C CE2 . TRP B 2 94 ? 18.478 4.310 23.983 1.00 98.23 94 B 1 ATOM 3480 C CE3 . TRP B 2 94 ? 17.597 3.294 25.997 1.00 98.20 94 B 1 ATOM 3481 C CZ2 . TRP B 2 94 ? 17.418 5.247 23.958 1.00 97.92 94 B 1 ATOM 3482 C CZ3 . TRP B 2 94 ? 16.536 4.225 25.975 1.00 97.62 94 B 1 ATOM 3483 C CH2 . TRP B 2 94 ? 16.453 5.189 24.962 1.00 97.51 94 B 1 ATOM 3484 N N . VAL B 2 95 ? 21.698 -1.585 25.010 1.00 98.25 95 B 1 ATOM 3485 C CA . VAL B 2 95 ? 22.569 -2.644 25.528 1.00 98.04 95 B 1 ATOM 3486 C C . VAL B 2 95 ? 24.035 -2.265 25.339 1.00 98.10 95 B 1 ATOM 3487 O O . VAL B 2 95 ? 24.406 -1.632 24.352 1.00 97.83 95 B 1 ATOM 3488 C CB . VAL B 2 95 ? 22.274 -4.013 24.880 1.00 97.37 95 B 1 ATOM 3489 C CG1 . VAL B 2 95 ? 20.847 -4.478 25.177 1.00 94.58 95 B 1 ATOM 3490 C CG2 . VAL B 2 95 ? 22.487 -4.042 23.357 1.00 94.37 95 B 1 ATOM 3491 N N . LYS B 2 96 ? 24.892 -2.708 26.266 1.00 97.75 96 B 1 ATOM 3492 C CA . LYS B 2 96 ? 26.335 -2.757 26.026 1.00 97.46 96 B 1 ATOM 3493 C C . LYS B 2 96 ? 26.668 -4.063 25.321 1.00 97.54 96 B 1 ATOM 3494 O O . LYS B 2 96 ? 26.343 -5.142 25.824 1.00 96.41 96 B 1 ATOM 3495 C CB . LYS B 2 96 ? 27.129 -2.584 27.325 1.00 96.43 96 B 1 ATOM 3496 C CG . LYS B 2 96 ? 26.978 -1.151 27.858 1.00 88.63 96 B 1 ATOM 3497 C CD . LYS B 2 96 ? 27.938 -0.876 29.017 1.00 79.51 96 B 1 ATOM 3498 C CE . LYS B 2 96 ? 27.765 0.594 29.421 1.00 69.76 96 B 1 ATOM 3499 N NZ . LYS B 2 96 ? 28.754 1.028 30.427 1.00 59.68 96 B 1 ATOM 3500 N N . HIS B 2 97 ? 27.301 -3.970 24.173 1.00 97.68 97 B 1 ATOM 3501 C CA . HIS B 2 97 ? 27.661 -5.120 23.353 1.00 97.52 97 B 1 ATOM 3502 C C . HIS B 2 97 ? 28.890 -4.786 22.506 1.00 97.45 97 B 1 ATOM 3503 O O . HIS B 2 97 ? 28.784 -4.101 21.489 1.00 96.60 97 B 1 ATOM 3504 C CB . HIS B 2 97 ? 26.456 -5.510 22.483 1.00 96.89 97 B 1 ATOM 3505 C CG . HIS B 2 97 ? 26.775 -6.613 21.514 1.00 96.23 97 B 1 ATOM 3506 N ND1 . HIS B 2 97 ? 26.982 -6.473 20.159 1.00 89.28 97 B 1 ATOM 3507 C CD2 . HIS B 2 97 ? 26.961 -7.938 21.815 1.00 88.38 97 B 1 ATOM 3508 C CE1 . HIS B 2 97 ? 27.274 -7.680 19.655 1.00 88.97 97 B 1 ATOM 3509 N NE2 . HIS B 2 97 ? 27.273 -8.596 20.627 1.00 90.28 97 B 1 ATOM 3510 N N . LYS B 2 98 ? 30.053 -5.262 22.914 1.00 96.86 98 B 1 ATOM 3511 C CA . LYS B 2 98 ? 31.274 -5.133 22.114 1.00 96.66 98 B 1 ATOM 3512 C C . LYS B 2 98 ? 31.169 -5.956 20.834 1.00 97.02 98 B 1 ATOM 3513 O O . LYS B 2 98 ? 30.568 -7.029 20.840 1.00 95.23 98 B 1 ATOM 3514 C CB . LYS B 2 98 ? 32.508 -5.532 22.932 1.00 95.21 98 B 1 ATOM 3515 C CG . LYS B 2 98 ? 32.844 -4.478 23.999 1.00 87.87 98 B 1 ATOM 3516 C CD . LYS B 2 98 ? 34.161 -4.816 24.717 1.00 81.72 98 B 1 ATOM 3517 C CE . LYS B 2 98 ? 34.614 -3.664 25.623 1.00 72.28 98 B 1 ATOM 3518 N NZ . LYS B 2 98 ? 35.224 -2.556 24.838 1.00 62.48 98 B 1 ATOM 3519 N N . THR B 2 99 ? 31.786 -5.460 19.762 1.00 97.07 99 B 1 ATOM 3520 C CA . THR B 2 99 ? 31.951 -6.187 18.502 1.00 97.21 99 B 1 ATOM 3521 C C . THR B 2 99 ? 33.430 -6.281 18.139 1.00 97.22 99 B 1 ATOM 3522 O O . THR B 2 99 ? 34.224 -5.415 18.502 1.00 96.35 99 B 1 ATOM 3523 C CB . THR B 2 99 ? 31.119 -5.550 17.374 1.00 96.71 99 B 1 ATOM 3524 O OG1 . THR B 2 99 ? 31.343 -6.247 16.173 1.00 94.17 99 B 1 ATOM 3525 C CG2 . THR B 2 99 ? 31.440 -4.076 17.111 1.00 93.66 99 B 1 ATOM 3526 N N . SER B 2 100 ? 33.795 -7.337 17.423 1.00 96.48 100 B 1 ATOM 3527 C CA . SER B 2 100 ? 35.121 -7.468 16.805 1.00 96.04 100 B 1 ATOM 3528 C C . SER B 2 100 ? 35.246 -6.679 15.492 1.00 96.30 100 B 1 ATOM 3529 O O . SER B 2 100 ? 36.352 -6.499 14.991 1.00 94.53 100 B 1 ATOM 3530 C CB . SER B 2 100 ? 35.425 -8.948 16.567 1.00 95.40 100 B 1 ATOM 3531 O OG . SER B 2 100 ? 34.536 -9.535 15.638 1.00 93.05 100 B 1 ATOM 3532 N N . VAL B 2 101 ? 34.123 -6.212 14.937 1.00 97.26 101 B 1 ATOM 3533 C CA . VAL B 2 101 ? 34.056 -5.519 13.647 1.00 97.22 101 B 1 ATOM 3534 C C . VAL B 2 101 ? 34.089 -4.007 13.863 1.00 97.03 101 B 1 ATOM 3535 O O . VAL B 2 101 ? 33.293 -3.459 14.624 1.00 95.79 101 B 1 ATOM 3536 C CB . VAL B 2 101 ? 32.814 -5.951 12.850 1.00 96.75 101 B 1 ATOM 3537 C CG1 . VAL B 2 101 ? 32.796 -5.313 11.458 1.00 94.40 101 B 1 ATOM 3538 C CG2 . VAL B 2 101 ? 32.790 -7.479 12.659 1.00 94.54 101 B 1 ATOM 3539 N N . THR B 2 102 ? 35.000 -3.332 13.164 1.00 96.27 102 B 1 ATOM 3540 C CA . THR B 2 102 ? 35.213 -1.875 13.255 1.00 95.36 102 B 1 ATOM 3541 C C . THR B 2 102 ? 34.948 -1.140 11.939 1.00 95.69 102 B 1 ATOM 3542 O O . THR B 2 102 ? 34.649 0.048 11.946 1.00 93.21 102 B 1 ATOM 3543 C CB . THR B 2 102 ? 36.649 -1.576 13.714 1.00 93.21 102 B 1 ATOM 3544 O OG1 . THR B 2 102 ? 37.584 -2.208 12.860 1.00 87.01 102 B 1 ATOM 3545 C CG2 . THR B 2 102 ? 36.923 -2.088 15.132 1.00 84.91 102 B 1 ATOM 3546 N N . GLU B 2 103 ? 35.041 -1.836 10.812 1.00 95.60 103 B 1 ATOM 3547 C CA . GLU B 2 103 ? 34.813 -1.322 9.459 1.00 95.35 103 B 1 ATOM 3548 C C . GLU B 2 103 ? 33.487 -1.867 8.906 1.00 96.47 103 B 1 ATOM 3549 O O . GLU B 2 103 ? 33.277 -3.078 8.905 1.00 95.00 103 B 1 ATOM 3550 C CB . GLU B 2 103 ? 35.994 -1.730 8.561 1.00 92.97 103 B 1 ATOM 3551 C CG . GLU B 2 103 ? 37.045 -0.616 8.410 1.00 82.83 103 B 1 ATOM 3552 C CD . GLU B 2 103 ? 36.610 0.478 7.418 1.00 74.49 103 B 1 ATOM 3553 O OE1 . GLU B 2 103 ? 37.183 1.583 7.499 1.00 66.88 103 B 1 ATOM 3554 O OE2 . GLU B 2 103 ? 35.724 0.199 6.578 1.00 67.56 103 B 1 ATOM 3555 N N . PHE B 2 104 ? 32.601 -0.977 8.431 1.00 96.92 104 B 1 ATOM 3556 C CA . PHE B 2 104 ? 31.253 -1.327 7.952 1.00 97.27 104 B 1 ATOM 3557 C C . PHE B 2 104 ? 30.953 -0.852 6.517 1.00 97.08 104 B 1 ATOM 3558 O O . PHE B 2 104 ? 29.821 -0.999 6.053 1.00 95.42 104 B 1 ATOM 3559 C CB . PHE B 2 104 ? 30.203 -0.810 8.945 1.00 97.28 104 B 1 ATOM 3560 C CG . PHE B 2 104 ? 30.132 -1.591 10.242 1.00 97.64 104 B 1 ATOM 3561 C CD1 . PHE B 2 104 ? 29.239 -2.671 10.363 1.00 96.67 104 B 1 ATOM 3562 C CD2 . PHE B 2 104 ? 30.957 -1.252 11.332 1.00 96.80 104 B 1 ATOM 3563 C CE1 . PHE B 2 104 ? 29.159 -3.401 11.560 1.00 96.08 104 B 1 ATOM 3564 C CE2 . PHE B 2 104 ? 30.890 -1.982 12.533 1.00 96.13 104 B 1 ATOM 3565 C CZ . PHE B 2 104 ? 29.989 -3.057 12.647 1.00 96.62 104 B 1 ATOM 3566 N N . ALA B 2 105 ? 31.931 -0.292 5.813 1.00 96.81 105 B 1 ATOM 3567 C CA . ALA B 2 105 ? 31.719 0.273 4.478 1.00 96.09 105 B 1 ATOM 3568 C C . ALA B 2 105 ? 31.470 -0.800 3.398 1.00 96.22 105 B 1 ATOM 3569 O O . ALA B 2 105 ? 30.662 -0.588 2.493 1.00 94.34 105 B 1 ATOM 3570 C CB . ALA B 2 105 ? 32.928 1.149 4.131 1.00 94.40 105 B 1 ATOM 3571 N N . ASP B 2 106 ? 32.129 -1.953 3.498 1.00 96.50 106 B 1 ATOM 3572 C CA . ASP B 2 106 ? 31.957 -3.063 2.554 1.00 96.69 106 B 1 ATOM 3573 C C . ASP B 2 106 ? 30.788 -3.966 2.976 1.00 96.93 106 B 1 ATOM 3574 O O . ASP B 2 106 ? 30.873 -4.775 3.906 1.00 96.39 106 B 1 ATOM 3575 C CB . ASP B 2 106 ? 33.278 -3.830 2.386 1.00 96.13 106 B 1 ATOM 3576 C CG . ASP B 2 106 ? 33.217 -4.942 1.324 1.00 94.80 106 B 1 ATOM 3577 O OD1 . ASP B 2 106 ? 32.102 -5.389 0.958 1.00 91.98 106 B 1 ATOM 3578 O OD2 . ASP B 2 106 ? 34.299 -5.392 0.896 1.00 90.31 106 B 1 ATOM 3579 N N . TYR B 2 107 ? 29.671 -3.851 2.244 1.00 96.93 107 B 1 ATOM 3580 C CA . TYR B 2 107 ? 28.459 -4.632 2.493 1.00 96.65 107 B 1 ATOM 3581 C C . TYR B 2 107 ? 28.705 -6.149 2.482 1.00 97.20 107 B 1 ATOM 3582 O O . TYR B 2 107 ? 28.201 -6.871 3.347 1.00 96.93 107 B 1 ATOM 3583 C CB . TYR B 2 107 ? 27.397 -4.265 1.448 1.00 95.56 107 B 1 ATOM 3584 C CG . TYR B 2 107 ? 26.091 -5.014 1.629 1.00 93.83 107 B 1 ATOM 3585 C CD1 . TYR B 2 107 ? 25.814 -6.175 0.878 1.00 91.23 107 B 1 ATOM 3586 C CD2 . TYR B 2 107 ? 25.162 -4.579 2.595 1.00 90.79 107 B 1 ATOM 3587 C CE1 . TYR B 2 107 ? 24.620 -6.893 1.093 1.00 89.53 107 B 1 ATOM 3588 C CE2 . TYR B 2 107 ? 23.968 -5.291 2.815 1.00 88.80 107 B 1 ATOM 3589 C CZ . TYR B 2 107 ? 23.704 -6.450 2.064 1.00 89.26 107 B 1 ATOM 3590 O OH . TYR B 2 107 ? 22.546 -7.151 2.295 1.00 86.91 107 B 1 ATOM 3591 N N . LEU B 2 108 ? 29.465 -6.646 1.494 1.00 96.98 108 B 1 ATOM 3592 C CA . LEU B 2 108 ? 29.730 -8.078 1.357 1.00 96.79 108 B 1 ATOM 3593 C C . LEU B 2 108 ? 30.637 -8.592 2.477 1.00 97.15 108 B 1 ATOM 3594 O O . LEU B 2 108 ? 30.364 -9.664 3.020 1.00 96.65 108 B 1 ATOM 3595 C CB . LEU B 2 108 ? 30.342 -8.374 -0.023 1.00 96.12 108 B 1 ATOM 3596 C CG . LEU B 2 108 ? 29.321 -8.384 -1.172 1.00 87.58 108 B 1 ATOM 3597 C CD1 . LEU B 2 108 ? 30.056 -8.414 -2.512 1.00 83.43 108 B 1 ATOM 3598 C CD2 . LEU B 2 108 ? 28.409 -9.620 -1.112 1.00 83.00 108 B 1 ATOM 3599 N N . ALA B 2 109 ? 31.650 -7.819 2.864 1.00 97.50 109 B 1 ATOM 3600 C CA . ALA B 2 109 ? 32.537 -8.173 3.970 1.00 97.40 109 B 1 ATOM 3601 C C . ALA B 2 109 ? 31.760 -8.315 5.290 1.00 97.50 109 B 1 ATOM 3602 O O . ALA B 2 109 ? 31.954 -9.291 6.015 1.00 96.62 109 B 1 ATOM 3603 C CB . ALA B 2 109 ? 33.647 -7.125 4.078 1.00 96.87 109 B 1 ATOM 3604 N N . ILE B 2 110 ? 30.818 -7.402 5.575 1.00 97.82 110 B 1 ATOM 3605 C CA . ILE B 2 110 ? 29.961 -7.508 6.766 1.00 97.88 110 B 1 ATOM 3606 C C . ILE B 2 110 ? 29.030 -8.720 6.680 1.00 97.76 110 B 1 ATOM 3607 O O . ILE B 2 110 ? 28.906 -9.479 7.642 1.00 97.25 110 B 1 ATOM 3608 C CB . ILE B 2 110 ? 29.181 -6.203 7.006 1.00 97.80 110 B 1 ATOM 3609 C CG1 . ILE B 2 110 ? 30.115 -4.999 7.245 1.00 96.92 110 B 1 ATOM 3610 C CG2 . ILE B 2 110 ? 28.208 -6.345 8.195 1.00 97.10 110 B 1 ATOM 3611 C CD1 . ILE B 2 110 ? 31.074 -5.127 8.432 1.00 94.91 110 B 1 ATOM 3612 N N . ARG B 2 111 ? 28.400 -8.937 5.517 1.00 97.60 111 B 1 ATOM 3613 C CA . ARG B 2 111 ? 27.456 -10.045 5.314 1.00 97.02 111 B 1 ATOM 3614 C C . ARG B 2 111 ? 28.108 -11.424 5.451 1.00 97.01 111 B 1 ATOM 3615 O O . ARG B 2 111 ? 27.443 -12.372 5.860 1.00 95.48 111 B 1 ATOM 3616 C CB . ARG B 2 111 ? 26.771 -9.874 3.952 1.00 95.67 111 B 1 ATOM 3617 C CG . ARG B 2 111 ? 25.552 -10.785 3.815 1.00 87.56 111 B 1 ATOM 3618 C CD . ARG B 2 111 ? 24.824 -10.547 2.487 1.00 85.60 111 B 1 ATOM 3619 N NE . ARG B 2 111 ? 23.601 -11.367 2.390 1.00 81.53 111 B 1 ATOM 3620 C CZ . ARG B 2 111 ? 22.352 -10.978 2.630 1.00 77.04 111 B 1 ATOM 3621 N NH1 . ARG B 2 111 ? 22.054 -9.749 2.931 1.00 69.46 111 B 1 ATOM 3622 N NH2 . ARG B 2 111 ? 21.375 -11.833 2.563 1.00 71.65 111 B 1 ATOM 3623 N N . GLN B 2 112 ? 29.381 -11.537 5.107 1.00 97.23 112 B 1 ATOM 3624 C CA . GLN B 2 112 ? 30.160 -12.781 5.178 1.00 96.66 112 B 1 ATOM 3625 C C . GLN B 2 112 ? 31.017 -12.885 6.451 1.00 96.77 112 B 1 ATOM 3626 O O . GLN B 2 112 ? 31.513 -13.962 6.775 1.00 95.18 112 B 1 ATOM 3627 C CB . GLN B 2 112 ? 31.047 -12.879 3.929 1.00 95.66 112 B 1 ATOM 3628 C CG . GLN B 2 112 ? 30.222 -13.015 2.633 1.00 91.96 112 B 1 ATOM 3629 C CD . GLN B 2 112 ? 31.085 -13.012 1.365 1.00 86.77 112 B 1 ATOM 3630 O OE1 . GLN B 2 112 ? 32.300 -12.934 1.382 1.00 79.95 112 B 1 ATOM 3631 N NE2 . GLN B 2 112 ? 30.477 -13.098 0.203 1.00 77.30 112 B 1 ATOM 3632 N N . GLY B 2 113 ? 31.193 -11.775 7.153 1.00 97.14 113 B 1 ATOM 3633 C CA . GLY B 2 113 ? 32.017 -11.669 8.347 1.00 97.11 113 B 1 ATOM 3634 C C . GLY B 2 113 ? 31.326 -12.136 9.639 1.00 97.75 113 B 1 ATOM 3635 O O . GLY B 2 113 ? 30.215 -12.669 9.617 1.00 96.77 113 B 1 ATOM 3636 N N . PRO B 2 114 ? 31.966 -11.911 10.798 1.00 97.76 114 B 1 ATOM 3637 C CA . PRO B 2 114 ? 31.449 -12.383 12.087 1.00 97.79 114 B 1 ATOM 3638 C C . PRO B 2 114 ? 30.271 -11.570 12.632 1.00 98.06 114 B 1 ATOM 3639 O O . PRO B 2 114 ? 29.533 -12.066 13.479 1.00 97.35 114 B 1 ATOM 3640 C CB . PRO B 2 114 ? 32.659 -12.334 13.029 1.00 97.11 114 B 1 ATOM 3641 C CG . PRO B 2 114 ? 33.502 -11.189 12.459 1.00 96.07 114 B 1 ATOM 3642 C CD . PRO B 2 114 ? 33.291 -11.326 10.956 1.00 97.40 114 B 1 ATOM 3643 N N . TYR B 2 115 ? 30.055 -10.329 12.159 1.00 97.92 115 B 1 ATOM 3644 C CA . TYR B 2 115 ? 29.113 -9.380 12.766 1.00 98.23 115 B 1 ATOM 3645 C C . TYR B 2 115 ? 27.677 -9.909 12.879 1.00 98.42 115 B 1 ATOM 3646 O O . TYR B 2 115 ? 27.038 -9.766 13.922 1.00 98.20 115 B 1 ATOM 3647 C CB . TYR B 2 115 ? 29.123 -8.062 11.979 1.00 98.18 115 B 1 ATOM 3648 C CG . TYR B 2 115 ? 28.333 -6.969 12.672 1.00 98.35 115 B 1 ATOM 3649 C CD1 . TYR B 2 115 ? 27.128 -6.484 12.134 1.00 97.95 115 B 1 ATOM 3650 C CD2 . TYR B 2 115 ? 28.795 -6.460 13.905 1.00 98.03 115 B 1 ATOM 3651 C CE1 . TYR B 2 115 ? 26.393 -5.497 12.813 1.00 97.80 115 B 1 ATOM 3652 C CE2 . TYR B 2 115 ? 28.063 -5.478 14.595 1.00 97.84 115 B 1 ATOM 3653 C CZ . TYR B 2 115 ? 26.859 -5.001 14.047 1.00 98.13 115 B 1 ATOM 3654 O OH . TYR B 2 115 ? 26.142 -4.058 14.728 1.00 97.67 115 B 1 ATOM 3655 N N . TYR B 2 116 ? 27.165 -10.559 11.835 1.00 98.40 116 B 1 ATOM 3656 C CA . TYR B 2 116 ? 25.819 -11.130 11.864 1.00 98.45 116 B 1 ATOM 3657 C C . TYR B 2 116 ? 25.678 -12.217 12.941 1.00 98.43 116 B 1 ATOM 3658 O O . TYR B 2 116 ? 24.650 -12.295 13.605 1.00 97.95 116 B 1 ATOM 3659 C CB . TYR B 2 116 ? 25.458 -11.690 10.478 1.00 98.24 116 B 1 ATOM 3660 C CG . TYR B 2 116 ? 25.067 -10.691 9.397 1.00 98.38 116 B 1 ATOM 3661 C CD1 . TYR B 2 116 ? 25.412 -9.324 9.450 1.00 97.57 116 B 1 ATOM 3662 C CD2 . TYR B 2 116 ? 24.327 -11.162 8.293 1.00 97.56 116 B 1 ATOM 3663 C CE1 . TYR B 2 116 ? 25.031 -8.441 8.423 1.00 97.21 116 B 1 ATOM 3664 C CE2 . TYR B 2 116 ? 23.940 -10.293 7.260 1.00 97.23 116 B 1 ATOM 3665 C CZ . TYR B 2 116 ? 24.294 -8.932 7.326 1.00 97.83 116 B 1 ATOM 3666 O OH . TYR B 2 116 ? 23.916 -8.087 6.316 1.00 97.11 116 B 1 ATOM 3667 N N . GLY B 2 117 ? 26.716 -13.024 13.142 1.00 98.32 117 B 1 ATOM 3668 C CA . GLY B 2 117 ? 26.762 -14.021 14.213 1.00 98.20 117 B 1 ATOM 3669 C C . GLY B 2 117 ? 26.777 -13.380 15.601 1.00 98.32 117 B 1 ATOM 3670 O O . GLY B 2 117 ? 25.999 -13.785 16.465 1.00 97.88 117 B 1 ATOM 3671 N N . GLU B 2 118 ? 27.580 -12.331 15.797 1.00 98.17 118 B 1 ATOM 3672 C CA . GLU B 2 118 ? 27.631 -11.568 17.052 1.00 98.08 118 B 1 ATOM 3673 C C . GLU B 2 118 ? 26.268 -10.939 17.398 1.00 98.24 118 B 1 ATOM 3674 O O . GLU B 2 118 ? 25.806 -11.021 18.540 1.00 97.86 118 B 1 ATOM 3675 C CB . GLU B 2 118 ? 28.675 -10.445 16.957 1.00 97.64 118 B 1 ATOM 3676 C CG . GLU B 2 118 ? 30.137 -10.910 16.864 1.00 95.77 118 B 1 ATOM 3677 C CD . GLU B 2 118 ? 31.120 -9.723 16.780 1.00 96.07 118 B 1 ATOM 3678 O OE1 . GLU B 2 118 ? 32.345 -9.959 16.714 1.00 91.20 118 B 1 ATOM 3679 O OE2 . GLU B 2 118 ? 30.674 -8.549 16.800 1.00 93.00 118 B 1 ATOM 3680 N N . VAL B 2 119 ? 25.595 -10.341 16.397 1.00 98.31 119 B 1 ATOM 3681 C CA . VAL B 2 119 ? 24.258 -9.751 16.556 1.00 98.37 119 B 1 ATOM 3682 C C . VAL B 2 119 ? 23.222 -10.825 16.904 1.00 98.46 119 B 1 ATOM 3683 O O . VAL B 2 119 ? 22.433 -10.636 17.831 1.00 98.30 119 B 1 ATOM 3684 C CB . VAL B 2 119 ? 23.856 -8.971 15.282 1.00 98.06 119 B 1 ATOM 3685 C CG1 . VAL B 2 119 ? 22.380 -8.562 15.280 1.00 97.05 119 B 1 ATOM 3686 C CG2 . VAL B 2 119 ? 24.681 -7.684 15.157 1.00 97.19 119 B 1 ATOM 3687 N N . ALA B 2 120 ? 23.233 -11.956 16.203 1.00 98.37 120 B 1 ATOM 3688 C CA . ALA B 2 120 ? 22.301 -13.052 16.458 1.00 98.35 120 B 1 ATOM 3689 C C . ALA B 2 120 ? 22.475 -13.648 17.866 1.00 98.35 120 B 1 ATOM 3690 O O . ALA B 2 120 ? 21.491 -13.831 18.584 1.00 98.07 120 B 1 ATOM 3691 C CB . ALA B 2 120 ? 22.480 -14.109 15.359 1.00 98.13 120 B 1 ATOM 3692 N N . GLU B 2 121 ? 23.714 -13.897 18.289 1.00 98.26 121 B 1 ATOM 3693 C CA . GLU B 2 121 ? 24.031 -14.376 19.643 1.00 98.11 121 B 1 ATOM 3694 C C . GLU B 2 121 ? 23.568 -13.392 20.726 1.00 98.28 121 B 1 ATOM 3695 O O . GLU B 2 121 ? 22.950 -13.789 21.718 1.00 97.89 121 B 1 ATOM 3696 C CB . GLU B 2 121 ? 25.554 -14.585 19.764 1.00 97.56 121 B 1 ATOM 3697 C CG . GLU B 2 121 ? 26.003 -16.013 19.426 1.00 86.33 121 B 1 ATOM 3698 C CD . GLU B 2 121 ? 25.776 -16.989 20.598 1.00 72.87 121 B 1 ATOM 3699 O OE1 . GLU B 2 121 ? 25.212 -18.076 20.353 1.00 65.07 121 B 1 ATOM 3700 O OE2 . GLU B 2 121 ? 26.143 -16.626 21.741 1.00 65.80 121 B 1 ATOM 3701 N N . MET B 2 122 ? 23.814 -12.093 20.524 1.00 98.00 122 B 1 ATOM 3702 C CA . MET B 2 122 ? 23.378 -11.052 21.450 1.00 98.00 122 B 1 ATOM 3703 C C . MET B 2 122 ? 21.855 -11.010 21.559 1.00 98.28 122 B 1 ATOM 3704 O O . MET B 2 122 ? 21.326 -11.046 22.677 1.00 98.06 122 B 1 ATOM 3705 C CB . MET B 2 122 ? 23.987 -9.710 21.019 1.00 97.57 122 B 1 ATOM 3706 C CG . MET B 2 122 ? 23.592 -8.542 21.934 1.00 96.51 122 B 1 ATOM 3707 S SD . MET B 2 122 ? 21.981 -7.771 21.602 1.00 95.90 122 B 1 ATOM 3708 C CE . MET B 2 122 ? 22.340 -7.004 20.005 1.00 90.57 122 B 1 ATOM 3709 N N . LEU B 2 123 ? 21.133 -10.996 20.438 1.00 98.08 123 B 1 ATOM 3710 C CA . LEU B 2 123 ? 19.669 -10.982 20.433 1.00 98.19 123 B 1 ATOM 3711 C C . LEU B 2 123 ? 19.078 -12.210 21.123 1.00 98.22 123 B 1 ATOM 3712 O O . LEU B 2 123 ? 18.174 -12.057 21.941 1.00 97.92 123 B 1 ATOM 3713 C CB . LEU B 2 123 ? 19.137 -10.863 18.995 1.00 98.03 123 B 1 ATOM 3714 C CG . LEU B 2 123 ? 19.185 -9.440 18.414 1.00 97.23 123 B 1 ATOM 3715 C CD1 . LEU B 2 123 ? 18.710 -9.495 16.962 1.00 96.52 123 B 1 ATOM 3716 C CD2 . LEU B 2 123 ? 18.271 -8.469 19.168 1.00 96.37 123 B 1 ATOM 3717 N N . LYS B 2 124 ? 19.605 -13.412 20.869 1.00 98.38 124 B 1 ATOM 3718 C CA . LYS B 2 124 ? 19.167 -14.629 21.568 1.00 98.25 124 B 1 ATOM 3719 C C . LYS B 2 124 ? 19.329 -14.494 23.081 1.00 98.18 124 B 1 ATOM 3720 O O . LYS B 2 124 ? 18.404 -14.797 23.825 1.00 97.61 124 B 1 ATOM 3721 C CB . LYS B 2 124 ? 19.941 -15.855 21.065 1.00 97.82 124 B 1 ATOM 3722 C CG . LYS B 2 124 ? 19.473 -16.291 19.666 1.00 93.99 124 B 1 ATOM 3723 C CD . LYS B 2 124 ? 20.230 -17.527 19.164 1.00 91.57 124 B 1 ATOM 3724 C CE . LYS B 2 124 ? 19.817 -18.768 19.968 1.00 83.77 124 B 1 ATOM 3725 N NZ . LYS B 2 124 ? 20.414 -19.999 19.410 1.00 77.45 124 B 1 ATOM 3726 N N . ARG B 2 125 ? 20.479 -13.982 23.536 1.00 98.15 125 B 1 ATOM 3727 C CA . ARG B 2 125 ? 20.762 -13.802 24.966 1.00 97.90 125 B 1 ATOM 3728 C C . ARG B 2 125 ? 19.861 -12.747 25.617 1.00 97.97 125 B 1 ATOM 3729 O O . ARG B 2 125 ? 19.432 -12.938 26.749 1.00 97.07 125 B 1 ATOM 3730 C CB . ARG B 2 125 ? 22.252 -13.472 25.126 1.00 97.05 125 B 1 ATOM 3731 C CG . ARG B 2 125 ? 22.683 -13.380 26.596 1.00 85.88 125 B 1 ATOM 3732 C CD . ARG B 2 125 ? 24.205 -13.196 26.715 1.00 84.24 125 B 1 ATOM 3733 N NE . ARG B 2 125 ? 24.672 -11.984 26.008 1.00 74.79 125 B 1 ATOM 3734 C CZ . ARG B 2 125 ? 25.624 -11.901 25.081 1.00 67.83 125 B 1 ATOM 3735 N NH1 . ARG B 2 125 ? 26.335 -12.928 24.721 1.00 60.83 125 B 1 ATOM 3736 N NH2 . ARG B 2 125 ? 25.874 -10.763 24.501 1.00 60.16 125 B 1 ATOM 3737 N N . VAL B 2 126 ? 19.575 -11.637 24.920 1.00 98.09 126 B 1 ATOM 3738 C CA . VAL B 2 126 ? 18.763 -10.526 25.455 1.00 97.86 126 B 1 ATOM 3739 C C . VAL B 2 126 ? 17.270 -10.865 25.467 1.00 97.97 126 B 1 ATOM 3740 O O . VAL B 2 126 ? 16.568 -10.484 26.400 1.00 97.24 126 B 1 ATOM 3741 C CB . VAL B 2 126 ? 19.037 -9.230 24.661 1.00 97.14 126 B 1 ATOM 3742 C CG1 . VAL B 2 126 ? 18.083 -8.085 25.027 1.00 94.12 126 B 1 ATOM 3743 C CG2 . VAL B 2 126 ? 20.464 -8.725 24.937 1.00 94.69 126 B 1 ATOM 3744 N N . THR B 2 127 ? 16.775 -11.566 24.448 1.00 97.97 127 B 1 ATOM 3745 C CA . THR B 2 127 ? 15.331 -11.804 24.258 1.00 97.95 127 B 1 ATOM 3746 C C . THR B 2 127 ? 14.857 -13.184 24.712 1.00 97.91 127 B 1 ATOM 3747 O O . THR B 2 127 ? 13.652 -13.409 24.827 1.00 97.21 127 B 1 ATOM 3748 C CB . THR B 2 127 ? 14.926 -11.604 22.792 1.00 97.71 127 B 1 ATOM 3749 O OG1 . THR B 2 127 ? 15.533 -12.573 21.968 1.00 96.62 127 B 1 ATOM 3750 C CG2 . THR B 2 127 ? 15.288 -10.220 22.249 1.00 96.55 127 B 1 ATOM 3751 N N . GLY B 2 128 ? 15.773 -14.124 24.920 1.00 97.75 128 B 1 ATOM 3752 C CA . GLY B 2 128 ? 15.441 -15.537 25.129 1.00 97.72 128 B 1 ATOM 3753 C C . GLY B 2 128 ? 14.982 -16.270 23.861 1.00 98.10 128 B 1 ATOM 3754 O O . GLY B 2 128 ? 14.487 -17.392 23.956 1.00 97.20 128 B 1 ATOM 3755 N N . ALA B 2 129 ? 15.144 -15.665 22.679 1.00 98.14 129 B 1 ATOM 3756 C CA . ALA B 2 129 ? 14.784 -16.295 21.416 1.00 98.25 129 B 1 ATOM 3757 C C . ALA B 2 129 ? 15.570 -17.595 21.177 1.00 98.38 129 B 1 ATOM 3758 O O . ALA B 2 129 ? 16.761 -17.703 21.486 1.00 98.03 129 B 1 ATOM 3759 C CB . ALA B 2 129 ? 15.008 -15.301 20.274 1.00 97.84 129 B 1 ATOM 3760 N N . THR B 2 130 ? 14.910 -18.568 20.554 1.00 98.27 130 B 1 ATOM 3761 C CA . THR B 2 130 ? 15.524 -19.854 20.186 1.00 98.24 130 B 1 ATOM 3762 C C . THR B 2 130 ? 16.302 -19.761 18.873 1.00 98.27 130 B 1 ATOM 3763 O O . THR B 2 130 ? 17.316 -20.448 18.703 1.00 97.79 130 B 1 ATOM 3764 C CB . THR B 2 130 ? 14.464 -20.957 20.081 1.00 98.01 130 B 1 ATOM 3765 O OG1 . THR B 2 130 ? 13.524 -20.623 19.086 1.00 96.81 130 B 1 ATOM 3766 C CG2 . THR B 2 130 ? 13.717 -21.175 21.399 1.00 96.29 130 B 1 ATOM 3767 N N . LYS B 2 131 ? 15.869 -18.865 17.965 1.00 98.46 131 B 1 ATOM 3768 C CA . LYS B 2 131 ? 16.471 -18.647 16.649 1.00 98.44 131 B 1 ATOM 3769 C C . LYS B 2 131 ? 16.479 -17.163 16.284 1.00 98.61 131 B 1 ATOM 3770 O O . LYS B 2 131 ? 15.516 -16.447 16.528 1.00 98.35 131 B 1 ATOM 3771 C CB . LYS B 2 131 ? 15.691 -19.495 15.621 1.00 97.94 131 B 1 ATOM 3772 C CG . LYS B 2 131 ? 16.250 -19.441 14.189 1.00 95.73 131 B 1 ATOM 3773 C CD . LYS B 2 131 ? 15.450 -20.380 13.275 1.00 93.59 131 B 1 ATOM 3774 C CE . LYS B 2 131 ? 16.026 -20.397 11.860 1.00 86.57 131 B 1 ATOM 3775 N NZ . LYS B 2 131 ? 15.314 -21.371 11.001 1.00 79.48 131 B 1 ATOM 3776 N N . VAL B 2 132 ? 17.559 -16.709 15.657 1.00 98.52 132 B 1 ATOM 3777 C CA . VAL B 2 132 ? 17.656 -15.383 15.030 1.00 98.59 132 B 1 ATOM 3778 C C . VAL B 2 132 ? 18.150 -15.565 13.600 1.00 98.53 132 B 1 ATOM 3779 O O . VAL B 2 132 ? 19.126 -16.275 13.370 1.00 98.14 132 B 1 ATOM 3780 C CB . VAL B 2 132 ? 18.567 -14.436 15.832 1.00 98.43 132 B 1 ATOM 3781 C CG1 . VAL B 2 132 ? 18.753 -13.085 15.127 1.00 97.79 132 B 1 ATOM 3782 C CG2 . VAL B 2 132 ? 17.982 -14.154 17.223 1.00 97.73 132 B 1 ATOM 3783 N N . HIS B 2 133 ? 17.482 -14.914 12.644 1.00 98.54 133 B 1 ATOM 3784 C CA . HIS B 2 133 ? 17.906 -14.857 11.248 1.00 98.43 133 B 1 ATOM 3785 C C . HIS B 2 133 ? 18.185 -13.400 10.873 1.00 98.51 133 B 1 ATOM 3786 O O . HIS B 2 133 ? 17.270 -12.581 10.850 1.00 98.22 133 B 1 ATOM 3787 C CB . HIS B 2 133 ? 16.831 -15.491 10.354 1.00 98.14 133 B 1 ATOM 3788 C CG . HIS B 2 133 ? 17.180 -15.441 8.891 1.00 96.74 133 B 1 ATOM 3789 N ND1 . HIS B 2 133 ? 17.806 -16.438 8.168 1.00 86.41 133 B 1 ATOM 3790 C CD2 . HIS B 2 133 ? 16.963 -14.399 8.023 1.00 87.02 133 B 1 ATOM 3791 C CE1 . HIS B 2 133 ? 17.955 -16.009 6.907 1.00 87.96 133 B 1 ATOM 3792 N NE2 . HIS B 2 133 ? 17.456 -14.776 6.782 1.00 90.07 133 B 1 ATOM 3793 N N . VAL B 2 134 ? 19.433 -13.071 10.580 1.00 98.47 134 B 1 ATOM 3794 C CA . VAL B 2 134 ? 19.808 -11.725 10.133 1.00 98.47 134 B 1 ATOM 3795 C C . VAL B 2 134 ? 19.423 -11.565 8.660 1.00 98.37 134 B 1 ATOM 3796 O O . VAL B 2 134 ? 19.915 -12.294 7.803 1.00 97.86 134 B 1 ATOM 3797 C CB . VAL B 2 134 ? 21.299 -11.442 10.373 1.00 98.29 134 B 1 ATOM 3798 C CG1 . VAL B 2 134 ? 21.642 -10.022 9.931 1.00 97.64 134 B 1 ATOM 3799 C CG2 . VAL B 2 134 ? 21.665 -11.585 11.858 1.00 97.69 134 B 1 ATOM 3800 N N . ILE B 2 135 ? 18.544 -10.594 8.370 1.00 98.31 135 B 1 ATOM 3801 C CA . ILE B 2 135 ? 18.044 -10.303 7.018 1.00 98.08 135 B 1 ATOM 3802 C C . ILE B 2 135 ? 19.109 -9.550 6.210 1.00 97.78 135 B 1 ATOM 3803 O O . ILE B 2 135 ? 19.432 -9.906 5.077 1.00 96.90 135 B 1 ATOM 3804 C CB . ILE B 2 135 ? 16.726 -9.493 7.103 1.00 97.90 135 B 1 ATOM 3805 C CG1 . ILE B 2 135 ? 15.661 -10.213 7.965 1.00 97.24 135 B 1 ATOM 3806 C CG2 . ILE B 2 135 ? 16.181 -9.215 5.689 1.00 96.80 135 B 1 ATOM 3807 C CD1 . ILE B 2 135 ? 14.427 -9.351 8.274 1.00 96.03 135 B 1 ATOM 3808 N N . GLY B 2 136 ? 19.663 -8.506 6.813 1.00 97.93 136 B 1 ATOM 3809 C CA . GLY B 2 136 ? 20.637 -7.612 6.201 1.00 97.79 136 B 1 ATOM 3810 C C . GLY B 2 136 ? 20.972 -6.439 7.117 1.00 98.23 136 B 1 ATOM 3811 O O . GLY B 2 136 ? 20.462 -6.340 8.233 1.00 97.95 136 B 1 ATOM 3812 N N . HIS B 2 137 ? 21.827 -5.551 6.633 1.00 98.03 137 B 1 ATOM 3813 C CA . HIS B 2 137 ? 22.207 -4.331 7.338 1.00 98.23 137 B 1 ATOM 3814 C C . HIS B 2 137 ? 22.282 -3.148 6.373 1.00 98.09 137 B 1 ATOM 3815 O O . HIS B 2 137 ? 22.353 -3.324 5.157 1.00 97.69 137 B 1 ATOM 3816 C CB . HIS B 2 137 ? 23.538 -4.541 8.085 1.00 98.22 137 B 1 ATOM 3817 C CG . HIS B 2 137 ? 24.727 -4.628 7.172 1.00 98.25 137 B 1 ATOM 3818 N ND1 . HIS B 2 137 ? 25.037 -5.680 6.338 1.00 95.78 137 B 1 ATOM 3819 C CD2 . HIS B 2 137 ? 25.676 -3.656 6.953 1.00 95.50 137 B 1 ATOM 3820 C CE1 . HIS B 2 137 ? 26.137 -5.347 5.641 1.00 96.32 137 B 1 ATOM 3821 N NE2 . HIS B 2 137 ? 26.555 -4.128 5.989 1.00 96.62 137 B 1 ATOM 3822 N N . LEU B 2 138 ? 22.273 -1.936 6.933 1.00 98.12 138 B 1 ATOM 3823 C CA . LEU B 2 138 ? 22.497 -0.680 6.228 1.00 98.11 138 B 1 ATOM 3824 C C . LEU B 2 138 ? 23.574 0.109 6.977 1.00 98.43 138 B 1 ATOM 3825 O O . LEU B 2 138 ? 23.528 0.212 8.202 1.00 98.15 138 B 1 ATOM 3826 C CB . LEU B 2 138 ? 21.159 0.072 6.148 1.00 97.17 138 B 1 ATOM 3827 C CG . LEU B 2 138 ? 21.176 1.290 5.214 1.00 91.15 138 B 1 ATOM 3828 C CD1 . LEU B 2 138 ? 21.282 0.872 3.745 1.00 86.41 138 B 1 ATOM 3829 C CD2 . LEU B 2 138 ? 19.878 2.074 5.375 1.00 86.10 138 B 1 ATOM 3830 N N . HIS B 2 139 ? 24.542 0.664 6.248 1.00 98.32 139 B 1 ATOM 3831 C CA . HIS B 2 139 ? 25.575 1.541 6.800 1.00 98.30 139 B 1 ATOM 3832 C C . HIS B 2 139 ? 25.290 2.989 6.398 1.00 98.21 139 B 1 ATOM 3833 O O . HIS B 2 139 ? 25.078 3.280 5.223 1.00 97.65 139 B 1 ATOM 3834 C CB . HIS B 2 139 ? 26.954 1.069 6.321 1.00 98.01 139 B 1 ATOM 3835 C CG . HIS B 2 139 ? 28.079 1.950 6.794 1.00 97.02 139 B 1 ATOM 3836 N ND1 . HIS B 2 139 ? 28.482 2.141 8.103 1.00 87.62 139 B 1 ATOM 3837 C CD2 . HIS B 2 139 ? 28.903 2.718 6.007 1.00 88.13 139 B 1 ATOM 3838 C CE1 . HIS B 2 139 ? 29.523 2.992 8.095 1.00 89.50 139 B 1 ATOM 3839 N NE2 . HIS B 2 139 ? 29.805 3.364 6.846 1.00 91.44 139 B 1 ATOM 3840 N N . ARG B 2 140 ? 25.279 3.895 7.372 1.00 98.58 140 B 1 ATOM 3841 C CA . ARG B 2 140 ? 25.069 5.338 7.181 1.00 98.54 140 B 1 ATOM 3842 C C . ARG B 2 140 ? 26.327 6.083 7.622 1.00 98.53 140 B 1 ATOM 3843 O O . ARG B 2 140 ? 26.714 5.958 8.778 1.00 98.13 140 B 1 ATOM 3844 C CB . ARG B 2 140 ? 23.857 5.826 7.981 1.00 98.38 140 B 1 ATOM 3845 C CG . ARG B 2 140 ? 22.577 5.034 7.686 1.00 97.75 140 B 1 ATOM 3846 C CD . ARG B 2 140 ? 21.423 5.578 8.531 1.00 97.45 140 B 1 ATOM 3847 N NE . ARG B 2 140 ? 20.232 4.744 8.382 1.00 97.32 140 B 1 ATOM 3848 C CZ . ARG B 2 140 ? 19.234 4.893 7.532 1.00 97.68 140 B 1 ATOM 3849 N NH1 . ARG B 2 140 ? 19.140 5.903 6.716 1.00 95.81 140 B 1 ATOM 3850 N NH2 . ARG B 2 140 ? 18.300 3.997 7.505 1.00 96.07 140 B 1 ATOM 3851 N N . SER B 2 141 ? 26.930 6.839 6.723 1.00 98.34 141 B 1 ATOM 3852 C CA . SER B 2 141 ? 28.196 7.537 6.999 1.00 98.19 141 B 1 ATOM 3853 C C . SER B 2 141 ? 28.306 8.925 6.369 1.00 98.23 141 B 1 ATOM 3854 O O . SER B 2 141 ? 29.341 9.573 6.510 1.00 97.33 141 B 1 ATOM 3855 C CB . SER B 2 141 ? 29.373 6.665 6.557 1.00 97.45 141 B 1 ATOM 3856 O OG . SER B 2 141 ? 29.299 6.407 5.165 1.00 95.13 141 B 1 ATOM 3857 N N . LEU B 2 142 ? 27.264 9.383 5.666 1.00 98.08 142 B 1 ATOM 3858 C CA . LEU B 2 142 ? 27.259 10.687 5.009 1.00 98.02 142 B 1 ATOM 3859 C C . LEU B 2 142 ? 26.479 11.716 5.829 1.00 98.08 142 B 1 ATOM 3860 O O . LEU B 2 142 ? 25.474 11.393 6.465 1.00 97.70 142 B 1 ATOM 3861 C CB . LEU B 2 142 ? 26.708 10.567 3.584 1.00 97.77 142 B 1 ATOM 3862 C CG . LEU B 2 142 ? 27.457 9.577 2.676 1.00 96.75 142 B 1 ATOM 3863 C CD1 . LEU B 2 142 ? 26.847 9.642 1.281 1.00 95.19 142 B 1 ATOM 3864 C CD2 . LEU B 2 142 ? 28.952 9.878 2.561 1.00 94.75 142 B 1 ATOM 3865 N N . ASN B 2 143 ? 26.921 12.976 5.758 1.00 97.47 143 B 1 ATOM 3866 C CA . ASN B 2 143 ? 26.175 14.091 6.321 1.00 97.12 143 B 1 ATOM 3867 C C . ASN B 2 143 ? 24.923 14.367 5.474 1.00 97.26 143 B 1 ATOM 3868 O O . ASN B 2 143 ? 24.985 14.390 4.244 1.00 96.74 143 B 1 ATOM 3869 C CB . ASN B 2 143 ? 27.098 15.312 6.422 1.00 96.01 143 B 1 ATOM 3870 C CG . ASN B 2 143 ? 26.362 16.486 7.039 1.00 93.35 143 B 1 ATOM 3871 O OD1 . ASN B 2 143 ? 25.650 17.209 6.373 1.00 86.24 143 B 1 ATOM 3872 N ND2 . ASN B 2 143 ? 26.450 16.662 8.337 1.00 84.81 143 B 1 ATOM 3873 N N . TYR B 2 144 ? 23.786 14.593 6.136 1.00 97.10 144 B 1 ATOM 3874 C CA . TYR B 2 144 ? 22.509 14.828 5.462 1.00 96.84 144 B 1 ATOM 3875 C C . TYR B 2 144 ? 22.545 16.097 4.602 1.00 96.63 144 B 1 ATOM 3876 O O . TYR B 2 144 ? 22.236 16.045 3.416 1.00 95.85 144 B 1 ATOM 3877 C CB . TYR B 2 144 ? 21.394 14.889 6.517 1.00 96.53 144 B 1 ATOM 3878 C CG . TYR B 2 144 ? 19.999 15.043 5.945 1.00 96.42 144 B 1 ATOM 3879 C CD1 . TYR B 2 144 ? 19.516 16.309 5.570 1.00 95.14 144 B 1 ATOM 3880 C CD2 . TYR B 2 144 ? 19.172 13.912 5.785 1.00 95.16 144 B 1 ATOM 3881 C CE1 . TYR B 2 144 ? 18.229 16.448 5.019 1.00 94.20 144 B 1 ATOM 3882 C CE2 . TYR B 2 144 ? 17.882 14.039 5.241 1.00 94.00 144 B 1 ATOM 3883 C CZ . TYR B 2 144 ? 17.418 15.313 4.850 1.00 94.05 144 B 1 ATOM 3884 O OH . TYR B 2 144 ? 16.173 15.442 4.296 1.00 92.60 144 B 1 ATOM 3885 N N . ASN B 2 145 ? 22.946 17.226 5.189 1.00 96.73 145 B 1 ATOM 3886 C CA . ASN B 2 145 ? 22.925 18.532 4.523 1.00 96.07 145 B 1 ATOM 3887 C C . ASN B 2 145 ? 23.924 18.590 3.360 1.00 96.35 145 B 1 ATOM 3888 O O . ASN B 2 145 ? 23.563 19.032 2.274 1.00 95.59 145 B 1 ATOM 3889 C CB . ASN B 2 145 ? 23.205 19.637 5.551 1.00 94.93 145 B 1 ATOM 3890 C CG . ASN B 2 145 ? 22.122 19.774 6.616 1.00 92.48 145 B 1 ATOM 3891 O OD1 . ASN B 2 145 ? 20.983 19.366 6.476 1.00 87.04 145 B 1 ATOM 3892 N ND2 . ASN B 2 145 ? 22.462 20.373 7.739 1.00 85.22 145 B 1 ATOM 3893 N N . ASP B 2 146 ? 25.136 18.068 3.556 1.00 96.70 146 B 1 ATOM 3894 C CA . ASP B 2 146 ? 26.158 18.031 2.504 1.00 96.46 146 B 1 ATOM 3895 C C . ASP B 2 146 ? 25.689 17.182 1.316 1.00 96.86 146 B 1 ATOM 3896 O O . ASP B 2 146 ? 25.826 17.581 0.163 1.00 96.22 146 B 1 ATOM 3897 C CB . ASP B 2 146 ? 27.474 17.453 3.048 1.00 95.58 146 B 1 ATOM 3898 C CG . ASP B 2 146 ? 28.128 18.258 4.176 1.00 92.54 146 B 1 ATOM 3899 O OD1 . ASP B 2 146 ? 27.754 19.431 4.388 1.00 90.29 146 B 1 ATOM 3900 O OD2 . ASP B 2 146 ? 29.001 17.663 4.849 1.00 89.94 146 B 1 ATOM 3901 N N . THR B 2 147 ? 25.080 16.021 1.592 1.00 97.00 147 B 1 ATOM 3902 C CA . THR B 2 147 ? 24.592 15.110 0.549 1.00 97.04 147 B 1 ATOM 3903 C C . THR B 2 147 ? 23.422 15.720 -0.224 1.00 97.17 147 B 1 ATOM 3904 O O . THR B 2 147 ? 23.407 15.664 -1.449 1.00 96.68 147 B 1 ATOM 3905 C CB . THR B 2 147 ? 24.190 13.749 1.139 1.00 96.81 147 B 1 ATOM 3906 O OG1 . THR B 2 147 ? 25.260 13.201 1.880 1.00 94.74 147 B 1 ATOM 3907 C CG2 . THR B 2 147 ? 23.833 12.725 0.061 1.00 94.59 147 B 1 ATOM 3908 N N . THR B 2 148 ? 22.458 16.343 0.465 1.00 96.98 148 B 1 ATOM 3909 C CA . THR B 2 148 ? 21.328 17.006 -0.199 1.00 96.41 148 B 1 ATOM 3910 C C . THR B 2 148 ? 21.769 18.193 -1.047 1.00 96.66 148 B 1 ATOM 3911 O O . THR B 2 148 ? 21.243 18.381 -2.143 1.00 95.86 148 B 1 ATOM 3912 C CB . THR B 2 148 ? 20.259 17.485 0.794 1.00 95.12 148 B 1 ATOM 3913 O OG1 . THR B 2 148 ? 20.797 18.279 1.829 1.00 86.16 148 B 1 ATOM 3914 C CG2 . THR B 2 148 ? 19.536 16.319 1.457 1.00 85.10 148 B 1 ATOM 3915 N N . GLU B 2 149 ? 22.744 18.975 -0.587 1.00 96.65 149 B 1 ATOM 3916 C CA . GLU B 2 149 ? 23.273 20.122 -1.326 1.00 96.44 149 B 1 ATOM 3917 C C . GLU B 2 149 ? 24.049 19.682 -2.574 1.00 96.64 149 B 1 ATOM 3918 O O . GLU B 2 149 ? 23.878 20.257 -3.648 1.00 96.30 149 B 1 ATOM 3919 C CB . GLU B 2 149 ? 24.143 20.974 -0.383 1.00 96.19 149 B 1 ATOM 3920 C CG . GLU B 2 149 ? 24.754 22.237 -1.022 1.00 90.31 149 B 1 ATOM 3921 C CD . GLU B 2 149 ? 23.735 23.228 -1.615 1.00 88.23 149 B 1 ATOM 3922 O OE1 . GLU B 2 149 ? 24.155 24.051 -2.465 1.00 81.12 149 B 1 ATOM 3923 O OE2 . GLU B 2 149 ? 22.528 23.183 -1.287 1.00 83.86 149 B 1 ATOM 3924 N N . GLU B 2 150 ? 24.856 18.619 -2.458 1.00 97.20 150 B 1 ATOM 3925 C CA . GLU B 2 150 ? 25.628 18.078 -3.582 1.00 97.05 150 B 1 ATOM 3926 C C . GLU B 2 150 ? 24.722 17.461 -4.662 1.00 97.21 150 B 1 ATOM 3927 O O . GLU B 2 150 ? 24.971 17.618 -5.855 1.00 96.49 150 B 1 ATOM 3928 C CB . GLU B 2 150 ? 26.640 17.070 -3.019 1.00 96.32 150 B 1 ATOM 3929 C CG . GLU B 2 150 ? 27.689 16.627 -4.050 1.00 85.09 150 B 1 ATOM 3930 C CD . GLU B 2 150 ? 28.745 15.694 -3.431 1.00 82.11 150 B 1 ATOM 3931 O OE1 . GLU B 2 150 ? 29.847 15.556 -4.003 1.00 76.27 150 B 1 ATOM 3932 O OE2 . GLU B 2 150 ? 28.470 15.069 -2.383 1.00 79.55 150 B 1 ATOM 3933 N N . GLU B 2 151 ? 23.627 16.815 -4.257 1.00 97.46 151 B 1 ATOM 3934 C CA . GLU B 2 151 ? 22.691 16.117 -5.151 1.00 97.34 151 B 1 ATOM 3935 C C . GLU B 2 151 ? 21.468 16.964 -5.566 1.00 97.23 151 B 1 ATOM 3936 O O . GLU B 2 151 ? 20.589 16.471 -6.273 1.00 96.13 151 B 1 ATOM 3937 C CB . GLU B 2 151 ? 22.273 14.780 -4.520 1.00 97.09 151 B 1 ATOM 3938 C CG . GLU B 2 151 ? 23.462 13.802 -4.359 1.00 96.50 151 B 1 ATOM 3939 C CD . GLU B 2 151 ? 23.046 12.434 -3.803 1.00 96.71 151 B 1 ATOM 3940 O OE1 . GLU B 2 151 ? 23.647 11.414 -4.205 1.00 93.04 151 B 1 ATOM 3941 O OE2 . GLU B 2 151 ? 22.109 12.367 -2.973 1.00 94.12 151 B 1 ATOM 3942 N N . LYS B 2 152 ? 21.398 18.254 -5.193 1.00 97.01 152 B 1 ATOM 3943 C CA . LYS B 2 152 ? 20.207 19.115 -5.380 1.00 96.58 152 B 1 ATOM 3944 C C . LYS B 2 152 ? 19.691 19.223 -6.817 1.00 96.69 152 B 1 ATOM 3945 O O . LYS B 2 152 ? 18.509 19.477 -7.030 1.00 95.85 152 B 1 ATOM 3946 C CB . LYS B 2 152 ? 20.486 20.510 -4.805 1.00 95.71 152 B 1 ATOM 3947 C CG . LYS B 2 152 ? 21.505 21.322 -5.628 1.00 92.55 152 B 1 ATOM 3948 C CD . LYS B 2 152 ? 21.834 22.615 -4.885 1.00 89.99 152 B 1 ATOM 3949 C CE . LYS B 2 152 ? 22.938 23.384 -5.611 1.00 82.45 152 B 1 ATOM 3950 N NZ . LYS B 2 152 ? 23.349 24.544 -4.801 1.00 75.76 152 B 1 ATOM 3951 N N . ASN B 2 153 ? 20.573 19.045 -7.803 1.00 97.01 153 B 1 ATOM 3952 C CA . ASN B 2 153 ? 20.242 19.135 -9.228 1.00 96.63 153 B 1 ATOM 3953 C C . ASN B 2 153 ? 20.003 17.765 -9.885 1.00 96.44 153 B 1 ATOM 3954 O O . ASN B 2 153 ? 19.650 17.718 -11.062 1.00 94.99 153 B 1 ATOM 3955 C CB . ASN B 2 153 ? 21.357 19.910 -9.946 1.00 96.38 153 B 1 ATOM 3956 C CG . ASN B 2 153 ? 21.483 21.352 -9.478 1.00 95.18 153 B 1 ATOM 3957 O OD1 . ASN B 2 153 ? 20.525 22.063 -9.256 1.00 89.48 153 B 1 ATOM 3958 N ND2 . ASN B 2 153 ? 22.697 21.837 -9.329 1.00 88.78 153 B 1 ATOM 3959 N N . ALA B 2 154 ? 20.211 16.653 -9.173 1.00 96.66 154 B 1 ATOM 3960 C CA . ALA B 2 154 ? 19.972 15.321 -9.711 1.00 96.37 154 B 1 ATOM 3961 C C . ALA B 2 154 ? 18.461 15.050 -9.860 1.00 96.43 154 B 1 ATOM 3962 O O . ALA B 2 154 ? 17.664 15.521 -9.043 1.00 95.76 154 B 1 ATOM 3963 C CB . ALA B 2 154 ? 20.670 14.283 -8.832 1.00 95.67 154 B 1 ATOM 3964 N N . PRO B 2 155 ? 18.033 14.275 -10.880 1.00 96.17 155 B 1 ATOM 3965 C CA . PRO B 2 155 ? 16.651 13.809 -10.992 1.00 95.89 155 B 1 ATOM 3966 C C . PRO B 2 155 ? 16.228 12.952 -9.792 1.00 96.47 155 B 1 ATOM 3967 O O . PRO B 2 155 ? 17.044 12.239 -9.212 1.00 96.28 155 B 1 ATOM 3968 C CB . PRO B 2 155 ? 16.585 13.009 -12.299 1.00 94.83 155 B 1 ATOM 3969 C CG . PRO B 2 155 ? 17.761 13.545 -13.115 1.00 93.49 155 B 1 ATOM 3970 C CD . PRO B 2 155 ? 18.800 13.865 -12.041 1.00 95.26 155 B 1 ATOM 3971 N N . ASP B 2 156 ? 14.936 12.961 -9.462 1.00 96.66 156 B 1 ATOM 3972 C CA . ASP B 2 156 ? 14.383 12.274 -8.284 1.00 96.98 156 B 1 ATOM 3973 C C . ASP B 2 156 ? 14.715 10.774 -8.225 1.00 97.30 156 B 1 ATOM 3974 O O . ASP B 2 156 ? 15.016 10.251 -7.155 1.00 96.87 156 B 1 ATOM 3975 C CB . ASP B 2 156 ? 12.855 12.449 -8.248 1.00 96.51 156 B 1 ATOM 3976 C CG . ASP B 2 156 ? 12.378 13.837 -7.821 1.00 95.64 156 B 1 ATOM 3977 O OD1 . ASP B 2 156 ? 13.208 14.659 -7.382 1.00 93.59 156 B 1 ATOM 3978 O OD2 . ASP B 2 156 ? 11.154 14.070 -7.919 1.00 92.97 156 B 1 ATOM 3979 N N . MET B 2 157 ? 14.704 10.088 -9.369 1.00 96.55 157 B 1 ATOM 3980 C CA . MET B 2 157 ? 14.958 8.643 -9.446 1.00 96.34 157 B 1 ATOM 3981 C C . MET B 2 157 ? 16.450 8.267 -9.422 1.00 96.13 157 B 1 ATOM 3982 O O . MET B 2 157 ? 16.779 7.080 -9.453 1.00 94.73 157 B 1 ATOM 3983 C CB . MET B 2 157 ? 14.261 8.058 -10.683 1.00 95.82 157 B 1 ATOM 3984 C CG . MET B 2 157 ? 12.743 8.293 -10.701 1.00 93.79 157 B 1 ATOM 3985 S SD . MET B 2 157 ? 11.843 7.876 -9.181 1.00 92.63 157 B 1 ATOM 3986 C CE . MET B 2 157 ? 12.165 6.110 -9.044 1.00 85.90 157 B 1 ATOM 3987 N N . THR B 2 158 ? 17.350 9.255 -9.357 1.00 96.26 158 B 1 ATOM 3988 C CA . THR B 2 158 ? 18.791 9.004 -9.210 1.00 96.11 158 B 1 ATOM 3989 C C . THR B 2 158 ? 19.065 8.347 -7.859 1.00 96.62 158 B 1 ATOM 3990 O O . THR B 2 158 ? 18.554 8.802 -6.838 1.00 96.24 158 B 1 ATOM 3991 C CB . THR B 2 158 ? 19.599 10.306 -9.332 1.00 95.13 158 B 1 ATOM 3992 O OG1 . THR B 2 158 ? 19.271 10.971 -10.528 1.00 90.61 158 B 1 ATOM 3993 C CG2 . THR B 2 158 ? 21.113 10.079 -9.368 1.00 90.67 158 B 1 ATOM 3994 N N . MET B 2 159 ? 19.894 7.295 -7.836 1.00 96.80 159 B 1 ATOM 3995 C CA . MET B 2 159 ? 20.367 6.710 -6.578 1.00 96.80 159 B 1 ATOM 3996 C C . MET B 2 159 ? 21.348 7.670 -5.895 1.00 96.85 159 B 1 ATOM 3997 O O . MET B 2 159 ? 22.249 8.193 -6.550 1.00 96.21 159 B 1 ATOM 3998 C CB . MET B 2 159 ? 21.023 5.343 -6.818 1.00 96.38 159 B 1 ATOM 3999 C CG . MET B 2 159 ? 20.054 4.287 -7.373 1.00 94.35 159 B 1 ATOM 4000 S SD . MET B 2 159 ? 18.576 3.929 -6.379 1.00 92.98 159 B 1 ATOM 4001 C CE . MET B 2 159 ? 19.314 3.284 -4.862 1.00 86.47 159 B 1 ATOM 4002 N N . THR B 2 160 ? 21.188 7.869 -4.590 1.00 97.44 160 B 1 ATOM 4003 C CA . THR B 2 160 ? 22.114 8.686 -3.799 1.00 97.44 160 B 1 ATOM 4004 C C . THR B 2 160 ? 23.498 8.036 -3.745 1.00 97.39 160 B 1 ATOM 4005 O O . THR B 2 160 ? 23.627 6.807 -3.799 1.00 96.51 160 B 1 ATOM 4006 C CB . THR B 2 160 ? 21.608 8.920 -2.366 1.00 96.71 160 B 1 ATOM 4007 O OG1 . THR B 2 160 ? 21.507 7.714 -1.655 1.00 90.80 160 B 1 ATOM 4008 C CG2 . THR B 2 160 ? 20.235 9.585 -2.319 1.00 90.50 160 B 1 ATOM 4009 N N . LYS B 2 161 ? 24.544 8.845 -3.556 1.00 96.88 161 B 1 ATOM 4010 C CA . LYS B 2 161 ? 25.934 8.362 -3.437 1.00 96.41 161 B 1 ATOM 4011 C C . LYS B 2 161 ? 26.193 7.480 -2.204 1.00 96.45 161 B 1 ATOM 4012 O O . LYS B 2 161 ? 27.227 6.828 -2.110 1.00 94.68 161 B 1 ATOM 4013 C CB . LYS B 2 161 ? 26.899 9.564 -3.485 1.00 94.87 161 B 1 ATOM 4014 C CG . LYS B 2 161 ? 26.815 10.457 -2.235 1.00 89.11 161 B 1 ATOM 4015 C CD . LYS B 2 161 ? 27.879 11.565 -2.258 1.00 86.55 161 B 1 ATOM 4016 C CE . LYS B 2 161 ? 27.840 12.312 -0.915 1.00 78.74 161 B 1 ATOM 4017 N NZ . LYS B 2 161 ? 28.979 13.232 -0.759 1.00 71.74 161 B 1 ATOM 4018 N N . GLY B 2 162 ? 25.285 7.491 -1.225 1.00 96.76 162 B 1 ATOM 4019 C CA . GLY B 2 162 ? 25.392 6.760 0.035 1.00 96.67 162 B 1 ATOM 4020 C C . GLY B 2 162 ? 24.258 7.108 0.996 1.00 97.27 162 B 1 ATOM 4021 O O . GLY B 2 162 ? 23.335 7.847 0.650 1.00 96.09 162 B 1 ATOM 4022 N N . GLN B 2 163 ? 24.311 6.556 2.206 1.00 97.62 163 B 1 ATOM 4023 C CA . GLN B 2 163 ? 23.219 6.690 3.166 1.00 97.69 163 B 1 ATOM 4024 C C . GLN B 2 163 ? 23.504 7.758 4.227 1.00 98.05 163 B 1 ATOM 4025 O O . GLN B 2 163 ? 24.564 7.774 4.857 1.00 97.55 163 B 1 ATOM 4026 C CB . GLN B 2 163 ? 22.890 5.330 3.797 1.00 96.99 163 B 1 ATOM 4027 C CG . GLN B 2 163 ? 22.514 4.254 2.760 1.00 94.11 163 B 1 ATOM 4028 C CD . GLN B 2 163 ? 21.337 4.670 1.878 1.00 90.21 163 B 1 ATOM 4029 O OE1 . GLN B 2 163 ? 20.312 5.116 2.360 1.00 80.68 163 B 1 ATOM 4030 N NE2 . GLN B 2 163 ? 21.451 4.559 0.572 1.00 76.99 163 B 1 ATOM 4031 N N . THR B 2 164 ? 22.508 8.611 4.456 1.00 97.87 164 B 1 ATOM 4032 C CA . THR B 2 164 ? 22.469 9.645 5.497 1.00 98.02 164 B 1 ATOM 4033 C C . THR B 2 164 ? 21.559 9.212 6.661 1.00 98.20 164 B 1 ATOM 4034 O O . THR B 2 164 ? 20.843 8.207 6.546 1.00 97.86 164 B 1 ATOM 4035 C CB . THR B 2 164 ? 21.989 10.973 4.898 1.00 97.57 164 B 1 ATOM 4036 O OG1 . THR B 2 164 ? 20.671 10.852 4.417 1.00 96.36 164 B 1 ATOM 4037 C CG2 . THR B 2 164 ? 22.871 11.447 3.742 1.00 96.07 164 B 1 ATOM 4038 N N . PRO B 2 165 ? 21.547 9.937 7.794 1.00 98.27 165 B 1 ATOM 4039 C CA . PRO B 2 165 ? 20.547 9.721 8.840 1.00 98.26 165 B 1 ATOM 4040 C C . PRO B 2 165 ? 19.105 9.820 8.309 1.00 98.14 165 B 1 ATOM 4041 O O . PRO B 2 165 ? 18.788 10.673 7.486 1.00 97.57 165 B 1 ATOM 4042 C CB . PRO B 2 165 ? 20.846 10.773 9.908 1.00 98.02 165 B 1 ATOM 4043 C CG . PRO B 2 165 ? 22.346 11.019 9.725 1.00 97.25 165 B 1 ATOM 4044 C CD . PRO B 2 165 ? 22.518 10.933 8.214 1.00 98.15 165 B 1 ATOM 4045 N N . GLY B 2 166 ? 18.216 8.947 8.789 1.00 98.00 166 B 1 ATOM 4046 C CA . GLY B 2 166 ? 16.798 8.944 8.414 1.00 97.94 166 B 1 ATOM 4047 C C . GLY B 2 166 ? 16.015 10.010 9.187 1.00 98.09 166 B 1 ATOM 4048 O O . GLY B 2 166 ? 15.605 9.758 10.317 1.00 97.36 166 B 1 ATOM 4049 N N . ARG B 2 167 ? 15.811 11.190 8.594 1.00 97.93 167 B 1 ATOM 4050 C CA . ARG B 2 167 ? 15.123 12.332 9.229 1.00 97.66 167 B 1 ATOM 4051 C C . ARG B 2 167 ? 13.603 12.328 9.009 1.00 97.67 167 B 1 ATOM 4052 O O . ARG B 2 167 ? 13.025 13.337 8.598 1.00 96.41 167 B 1 ATOM 4053 C CB . ARG B 2 167 ? 15.754 13.657 8.783 1.00 96.78 167 B 1 ATOM 4054 C CG . ARG B 2 167 ? 17.197 13.880 9.258 1.00 94.79 167 B 1 ATOM 4055 C CD . ARG B 2 167 ? 17.528 15.353 9.010 1.00 92.81 167 B 1 ATOM 4056 N NE . ARG B 2 167 ? 18.913 15.724 9.317 1.00 91.74 167 B 1 ATOM 4057 C CZ . ARG B 2 167 ? 19.444 16.911 9.086 1.00 90.96 167 B 1 ATOM 4058 N NH1 . ARG B 2 167 ? 18.766 17.890 8.565 1.00 87.45 167 B 1 ATOM 4059 N NH2 . ARG B 2 167 ? 20.681 17.153 9.365 1.00 86.46 167 B 1 ATOM 4060 N N . PHE B 2 168 ? 12.932 11.219 9.274 1.00 98.19 168 B 1 ATOM 4061 C CA . PHE B 2 168 ? 11.472 11.130 9.258 1.00 98.20 168 B 1 ATOM 4062 C C . PHE B 2 168 ? 10.988 10.073 10.254 1.00 98.50 168 B 1 ATOM 4063 O O . PHE B 2 168 ? 11.639 9.047 10.454 1.00 98.23 168 B 1 ATOM 4064 C CB . PHE B 2 168 ? 10.947 10.859 7.841 1.00 97.38 168 B 1 ATOM 4065 C CG . PHE B 2 168 ? 11.476 9.600 7.195 1.00 94.88 168 B 1 ATOM 4066 C CD1 . PHE B 2 168 ? 12.682 9.637 6.467 1.00 90.59 168 B 1 ATOM 4067 C CD2 . PHE B 2 168 ? 10.761 8.394 7.290 1.00 89.92 168 B 1 ATOM 4068 C CE1 . PHE B 2 168 ? 13.163 8.481 5.836 1.00 85.62 168 B 1 ATOM 4069 C CE2 . PHE B 2 168 ? 11.239 7.231 6.660 1.00 86.30 168 B 1 ATOM 4070 C CZ . PHE B 2 168 ? 12.441 7.277 5.932 1.00 83.46 168 B 1 ATOM 4071 N N . VAL B 2 169 ? 9.840 10.331 10.878 1.00 98.47 169 B 1 ATOM 4072 C CA . VAL B 2 169 ? 9.232 9.422 11.851 1.00 98.60 169 B 1 ATOM 4073 C C . VAL B 2 169 ? 8.590 8.254 11.113 1.00 98.60 169 B 1 ATOM 4074 O O . VAL B 2 169 ? 7.723 8.454 10.262 1.00 98.38 169 B 1 ATOM 4075 C CB . VAL B 2 169 ? 8.207 10.149 12.731 1.00 98.56 169 B 1 ATOM 4076 C CG1 . VAL B 2 169 ? 7.627 9.210 13.788 1.00 98.19 169 B 1 ATOM 4077 C CG2 . VAL B 2 169 ? 8.844 11.341 13.459 1.00 98.06 169 B 1 ATOM 4078 N N . HIS B 2 170 ? 8.999 7.036 11.456 1.00 98.64 170 B 1 ATOM 4079 C CA . HIS B 2 170 ? 8.493 5.829 10.808 1.00 98.66 170 B 1 ATOM 4080 C C . HIS B 2 170 ? 8.632 4.586 11.696 1.00 98.71 170 B 1 ATOM 4081 O O . HIS B 2 170 ? 9.398 4.563 12.655 1.00 98.63 170 B 1 ATOM 4082 C CB . HIS B 2 170 ? 9.219 5.618 9.469 1.00 98.58 170 B 1 ATOM 4083 C CG . HIS B 2 170 ? 10.685 5.304 9.594 1.00 98.59 170 B 1 ATOM 4084 N ND1 . HIS B 2 170 ? 11.676 6.188 9.966 1.00 98.20 170 B 1 ATOM 4085 C CD2 . HIS B 2 170 ? 11.295 4.091 9.376 1.00 98.06 170 B 1 ATOM 4086 C CE1 . HIS B 2 170 ? 12.840 5.528 9.966 1.00 97.98 170 B 1 ATOM 4087 N NE2 . HIS B 2 170 ? 12.649 4.251 9.609 1.00 98.01 170 B 1 ATOM 4088 N N . VAL B 2 171 ? 7.896 3.539 11.325 1.00 98.45 171 B 1 ATOM 4089 C CA . VAL B 2 171 ? 8.160 2.145 11.709 1.00 98.43 171 B 1 ATOM 4090 C C . VAL B 2 171 ? 8.531 1.402 10.431 1.00 98.38 171 B 1 ATOM 4091 O O . VAL B 2 171 ? 7.791 1.476 9.454 1.00 98.21 171 B 1 ATOM 4092 C CB . VAL B 2 171 ? 6.937 1.490 12.374 1.00 98.34 171 B 1 ATOM 4093 C CG1 . VAL B 2 171 ? 7.264 0.081 12.874 1.00 98.03 171 B 1 ATOM 4094 C CG2 . VAL B 2 171 ? 6.410 2.299 13.565 1.00 97.99 171 B 1 ATOM 4095 N N . ASP B 2 172 ? 9.647 0.676 10.426 1.00 98.65 172 B 1 ATOM 4096 C CA . ASP B 2 172 ? 10.172 0.002 9.224 1.00 98.50 172 B 1 ATOM 4097 C C . ASP B 2 172 ? 9.204 -1.010 8.583 1.00 98.40 172 B 1 ATOM 4098 O O . ASP B 2 172 ? 9.347 -1.334 7.405 1.00 97.68 172 B 1 ATOM 4099 C CB . ASP B 2 172 ? 11.452 -0.758 9.582 1.00 98.22 172 B 1 ATOM 4100 C CG . ASP B 2 172 ? 12.704 0.093 9.762 1.00 97.73 172 B 1 ATOM 4101 O OD1 . ASP B 2 172 ? 12.611 1.272 10.141 1.00 96.15 172 B 1 ATOM 4102 O OD2 . ASP B 2 172 ? 13.792 -0.496 9.546 1.00 94.99 172 B 1 ATOM 4103 N N . GLN B 2 173 ? 8.251 -1.531 9.364 1.00 97.88 173 B 1 ATOM 4104 C CA . GLN B 2 173 ? 7.286 -2.529 8.914 1.00 97.59 173 B 1 ATOM 4105 C C . GLN B 2 173 ? 5.884 -2.218 9.443 1.00 97.98 173 B 1 ATOM 4106 O O . GLN B 2 173 ? 5.703 -2.042 10.650 1.00 97.36 173 B 1 ATOM 4107 C CB . GLN B 2 173 ? 7.704 -3.924 9.410 1.00 95.89 173 B 1 ATOM 4108 C CG . GLN B 2 173 ? 9.124 -4.376 9.027 1.00 90.56 173 B 1 ATOM 4109 C CD . GLN B 2 173 ? 9.350 -4.577 7.536 1.00 89.72 173 B 1 ATOM 4110 O OE1 . GLN B 2 173 ? 8.450 -4.577 6.727 1.00 82.51 173 B 1 ATOM 4111 N NE2 . GLN B 2 173 ? 10.582 -4.762 7.127 1.00 79.45 173 B 1 ATOM 4112 N N . SER B 2 174 ? 4.882 -2.253 8.570 1.00 97.95 174 B 1 ATOM 4113 C CA . SER B 2 174 ? 3.510 -2.523 8.995 1.00 97.85 174 B 1 ATOM 4114 C C . SER B 2 174 ? 3.379 -3.992 9.434 1.00 97.74 174 B 1 ATOM 4115 O O . SER B 2 174 ? 4.284 -4.803 9.206 1.00 97.45 174 B 1 ATOM 4116 C CB . SER B 2 174 ? 2.524 -2.191 7.869 1.00 97.68 174 B 1 ATOM 4117 O OG . SER B 2 174 ? 2.576 -3.170 6.853 1.00 97.32 174 B 1 ATOM 4118 N N . TYR B 2 175 ? 2.260 -4.374 10.045 1.00 97.79 175 B 1 ATOM 4119 C CA . TYR B 2 175 ? 2.039 -5.784 10.402 1.00 97.47 175 B 1 ATOM 4120 C C . TYR B 2 175 ? 1.975 -6.682 9.158 1.00 97.47 175 B 1 ATOM 4121 O O . TYR B 2 175 ? 2.618 -7.730 9.125 1.00 97.18 175 B 1 ATOM 4122 C CB . TYR B 2 175 ? 0.785 -5.927 11.272 1.00 97.01 175 B 1 ATOM 4123 C CG . TYR B 2 175 ? 0.811 -5.203 12.611 1.00 96.83 175 B 1 ATOM 4124 C CD1 . TYR B 2 175 ? 2.023 -4.942 13.283 1.00 95.37 175 B 1 ATOM 4125 C CD2 . TYR B 2 175 ? -0.399 -4.794 13.204 1.00 95.25 175 B 1 ATOM 4126 C CE1 . TYR B 2 175 ? 2.034 -4.267 14.520 1.00 94.70 175 B 1 ATOM 4127 C CE2 . TYR B 2 175 ? -0.400 -4.122 14.443 1.00 94.46 175 B 1 ATOM 4128 C CZ . TYR B 2 175 ? 0.822 -3.853 15.095 1.00 95.18 175 B 1 ATOM 4129 O OH . TYR B 2 175 ? 0.836 -3.181 16.285 1.00 93.39 175 B 1 ATOM 4130 N N . GLN B 2 176 ? 1.291 -6.233 8.101 1.00 97.25 176 B 1 ATOM 4131 C CA . GLN B 2 176 ? 1.279 -6.920 6.806 1.00 97.19 176 B 1 ATOM 4132 C C . GLN B 2 176 ? 2.685 -6.955 6.180 1.00 97.51 176 B 1 ATOM 4133 O O . GLN B 2 176 ? 3.134 -8.001 5.715 1.00 97.39 176 B 1 ATOM 4134 C CB . GLN B 2 176 ? 0.270 -6.215 5.889 1.00 96.73 176 B 1 ATOM 4135 C CG . GLN B 2 176 ? 0.154 -6.891 4.512 1.00 93.60 176 B 1 ATOM 4136 C CD . GLN B 2 176 ? -0.838 -6.191 3.585 1.00 91.82 176 B 1 ATOM 4137 O OE1 . GLN B 2 176 ? -1.520 -5.251 3.945 1.00 85.55 176 B 1 ATOM 4138 N NE2 . GLN B 2 176 ? -0.938 -6.623 2.353 1.00 83.17 176 B 1 ATOM 4139 N N . GLY B 2 177 ? 3.410 -5.837 6.226 1.00 97.63 177 B 1 ATOM 4140 C CA . GLY B 2 177 ? 4.779 -5.749 5.716 1.00 97.70 177 B 1 ATOM 4141 C C . GLY B 2 177 ? 5.757 -6.678 6.441 1.00 97.82 177 B 1 ATOM 4142 O O . GLY B 2 177 ? 6.638 -7.258 5.809 1.00 97.63 177 B 1 ATOM 4143 N N . ALA B 2 178 ? 5.582 -6.876 7.748 1.00 97.89 178 B 1 ATOM 4144 C CA . ALA B 2 178 ? 6.373 -7.839 8.514 1.00 97.92 178 B 1 ATOM 4145 C C . ALA B 2 178 ? 6.146 -9.278 8.021 1.00 97.90 178 B 1 ATOM 4146 O O . ALA B 2 178 ? 7.112 -9.981 7.714 1.00 97.82 178 B 1 ATOM 4147 C CB . ALA B 2 178 ? 6.039 -7.684 10.003 1.00 97.91 178 B 1 ATOM 4148 N N . VAL B 2 179 ? 4.886 -9.687 7.862 1.00 97.81 179 B 1 ATOM 4149 C CA . VAL B 2 179 ? 4.532 -11.003 7.300 1.00 97.71 179 B 1 ATOM 4150 C C . VAL B 2 179 ? 5.079 -11.139 5.878 1.00 97.80 179 B 1 ATOM 4151 O O . VAL B 2 179 ? 5.705 -12.148 5.556 1.00 97.58 179 B 1 ATOM 4152 C CB . VAL B 2 179 ? 3.011 -11.233 7.341 1.00 97.28 179 B 1 ATOM 4153 C CG1 . VAL B 2 179 ? 2.619 -12.552 6.674 1.00 96.18 179 B 1 ATOM 4154 C CG2 . VAL B 2 179 ? 2.503 -11.283 8.791 1.00 96.31 179 B 1 ATOM 4155 N N . ARG B 2 180 ? 4.942 -10.101 5.044 1.00 97.85 180 B 1 ATOM 4156 C CA . ARG B 2 180 ? 5.493 -10.088 3.682 1.00 97.81 180 B 1 ATOM 4157 C C . ARG B 2 180 ? 7.002 -10.340 3.681 1.00 97.88 180 B 1 ATOM 4158 O O . ARG B 2 180 ? 7.469 -11.169 2.906 1.00 97.51 180 B 1 ATOM 4159 C CB . ARG B 2 180 ? 5.117 -8.764 2.997 1.00 97.49 180 B 1 ATOM 4160 C CG . ARG B 2 180 ? 5.546 -8.676 1.522 1.00 95.05 180 B 1 ATOM 4161 C CD . ARG B 2 180 ? 4.885 -9.752 0.660 1.00 93.42 180 B 1 ATOM 4162 N NE . ARG B 2 180 ? 5.169 -9.535 -0.765 1.00 92.12 180 B 1 ATOM 4163 C CZ . ARG B 2 180 ? 4.979 -10.392 -1.745 1.00 91.21 180 B 1 ATOM 4164 N NH1 . ARG B 2 180 ? 4.513 -11.594 -1.534 1.00 85.88 180 B 1 ATOM 4165 N NH2 . ARG B 2 180 ? 5.259 -10.043 -2.965 1.00 86.87 180 B 1 ATOM 4166 N N . ARG B 2 181 ? 7.768 -9.689 4.572 1.00 98.09 181 B 1 ATOM 4167 C CA . ARG B 2 181 ? 9.213 -9.942 4.729 1.00 97.99 181 B 1 ATOM 4168 C C . ARG B 2 181 ? 9.516 -11.386 5.124 1.00 98.04 181 B 1 ATOM 4169 O O . ARG B 2 181 ? 10.450 -11.959 4.581 1.00 97.71 181 B 1 ATOM 4170 C CB . ARG B 2 181 ? 9.862 -9.006 5.767 1.00 97.66 181 B 1 ATOM 4171 C CG . ARG B 2 181 ? 10.094 -7.556 5.352 1.00 92.97 181 B 1 ATOM 4172 C CD . ARG B 2 181 ? 10.489 -7.286 3.920 1.00 92.23 181 B 1 ATOM 4173 N NE . ARG B 2 181 ? 11.593 -8.116 3.410 1.00 89.81 181 B 1 ATOM 4174 C CZ . ARG B 2 181 ? 11.938 -8.178 2.134 1.00 89.61 181 B 1 ATOM 4175 N NH1 . ARG B 2 181 ? 11.328 -7.489 1.220 1.00 81.85 181 B 1 ATOM 4176 N NH2 . ARG B 2 181 ? 12.893 -8.933 1.730 1.00 82.08 181 B 1 ATOM 4177 N N . LEU B 2 182 ? 8.722 -11.968 6.029 1.00 98.03 182 B 1 ATOM 4178 C CA . LEU B 2 182 ? 8.915 -13.354 6.463 1.00 98.09 182 B 1 ATOM 4179 C C . LEU B 2 182 ? 8.845 -14.325 5.274 1.00 98.10 182 B 1 ATOM 4180 O O . LEU B 2 182 ? 9.717 -15.178 5.130 1.00 97.84 182 B 1 ATOM 4181 C CB . LEU B 2 182 ? 7.871 -13.689 7.544 1.00 98.02 182 B 1 ATOM 4182 C CG . LEU B 2 182 ? 8.065 -15.066 8.207 1.00 97.31 182 B 1 ATOM 4183 C CD1 . LEU B 2 182 ? 9.301 -15.092 9.104 1.00 96.58 182 B 1 ATOM 4184 C CD2 . LEU B 2 182 ? 6.847 -15.413 9.062 1.00 96.41 182 B 1 ATOM 4185 N N . TYR B 2 183 ? 7.845 -14.149 4.396 1.00 98.01 183 B 1 ATOM 4186 C CA . TYR B 2 183 ? 7.645 -15.017 3.228 1.00 97.67 183 B 1 ATOM 4187 C C . TYR B 2 183 ? 8.555 -14.683 2.035 1.00 97.41 183 B 1 ATOM 4188 O O . TYR B 2 183 ? 8.765 -15.539 1.179 1.00 96.51 183 B 1 ATOM 4189 C CB . TYR B 2 183 ? 6.168 -14.991 2.830 1.00 97.37 183 B 1 ATOM 4190 C CG . TYR B 2 183 ? 5.301 -15.856 3.726 1.00 97.59 183 B 1 ATOM 4191 C CD1 . TYR B 2 183 ? 5.092 -17.211 3.405 1.00 97.03 183 B 1 ATOM 4192 C CD2 . TYR B 2 183 ? 4.729 -15.334 4.901 1.00 97.11 183 B 1 ATOM 4193 C CE1 . TYR B 2 183 ? 4.312 -18.037 4.239 1.00 96.76 183 B 1 ATOM 4194 C CE2 . TYR B 2 183 ? 3.950 -16.150 5.747 1.00 96.87 183 B 1 ATOM 4195 C CZ . TYR B 2 183 ? 3.743 -17.502 5.409 1.00 97.09 183 B 1 ATOM 4196 O OH . TYR B 2 183 ? 2.989 -18.300 6.227 1.00 96.38 183 B 1 ATOM 4197 N N . LEU B 2 184 ? 9.098 -13.465 1.952 1.00 97.97 184 B 1 ATOM 4198 C CA . LEU B 2 184 ? 10.060 -13.091 0.910 1.00 97.56 184 B 1 ATOM 4199 C C . LEU B 2 184 ? 11.498 -13.505 1.244 1.00 97.42 184 B 1 ATOM 4200 O O . LEU B 2 184 ? 12.250 -13.847 0.340 1.00 96.54 184 B 1 ATOM 4201 C CB . LEU B 2 184 ? 9.992 -11.578 0.651 1.00 97.22 184 B 1 ATOM 4202 C CG . LEU B 2 184 ? 8.737 -11.096 -0.101 1.00 96.55 184 B 1 ATOM 4203 C CD1 . LEU B 2 184 ? 8.793 -9.571 -0.215 1.00 95.44 184 B 1 ATOM 4204 C CD2 . LEU B 2 184 ? 8.638 -11.675 -1.512 1.00 95.00 184 B 1 ATOM 4205 N N . ASP B 2 185 ? 11.885 -13.449 2.525 1.00 97.73 185 B 1 ATOM 4206 C CA . ASP B 2 185 ? 13.276 -13.667 2.941 1.00 97.50 185 B 1 ATOM 4207 C C . ASP B 2 185 ? 13.566 -15.102 3.390 1.00 97.68 185 B 1 ATOM 4208 O O . ASP B 2 185 ? 14.730 -15.502 3.448 1.00 96.63 185 B 1 ATOM 4209 C CB . ASP B 2 185 ? 13.653 -12.664 4.043 1.00 96.90 185 B 1 ATOM 4210 C CG . ASP B 2 185 ? 13.677 -11.215 3.557 1.00 94.46 185 B 1 ATOM 4211 O OD1 . ASP B 2 185 ? 13.931 -10.966 2.358 1.00 88.75 185 B 1 ATOM 4212 O OD2 . ASP B 2 185 ? 13.461 -10.293 4.373 1.00 88.23 185 B 1 ATOM 4213 N N . LEU B 2 186 ? 12.534 -15.888 3.705 1.00 98.04 186 B 1 ATOM 4214 C CA . LEU B 2 186 ? 12.661 -17.294 4.083 1.00 98.12 186 B 1 ATOM 4215 C C . LEU B 2 186 ? 12.005 -18.215 3.043 1.00 98.18 186 B 1 ATOM 4216 O O . LEU B 2 186 ? 11.057 -17.818 2.371 1.00 97.65 186 B 1 ATOM 4217 C CB . LEU B 2 186 ? 12.066 -17.523 5.483 1.00 97.96 186 B 1 ATOM 4218 C CG . LEU B 2 186 ? 12.708 -16.705 6.616 1.00 96.79 186 B 1 ATOM 4219 C CD1 . LEU B 2 186 ? 12.041 -17.080 7.935 1.00 94.48 186 B 1 ATOM 4220 C CD2 . LEU B 2 186 ? 14.209 -16.975 6.757 1.00 93.73 186 B 1 ATOM 4221 N N . PRO B 2 187 ? 12.448 -19.487 2.942 1.00 97.88 187 B 1 ATOM 4222 C CA . PRO B 2 187 ? 11.717 -20.499 2.190 1.00 97.76 187 B 1 ATOM 4223 C C . PRO B 2 187 ? 10.278 -20.623 2.700 1.00 97.92 187 B 1 ATOM 4224 O O . PRO B 2 187 ? 10.050 -20.610 3.908 1.00 97.66 187 B 1 ATOM 4225 C CB . PRO B 2 187 ? 12.500 -21.803 2.377 1.00 97.35 187 B 1 ATOM 4226 C CG . PRO B 2 187 ? 13.907 -21.334 2.744 1.00 96.40 187 B 1 ATOM 4227 C CD . PRO B 2 187 ? 13.646 -20.055 3.533 1.00 97.72 187 B 1 ATOM 4228 N N . GLN B 2 188 ? 9.306 -20.805 1.793 1.00 97.46 188 B 1 ATOM 4229 C CA . GLN B 2 188 ? 7.871 -20.809 2.120 1.00 97.24 188 B 1 ATOM 4230 C C . GLN B 2 188 ? 7.512 -21.770 3.264 1.00 97.51 188 B 1 ATOM 4231 O O . GLN B 2 188 ? 6.745 -21.420 4.159 1.00 97.07 188 B 1 ATOM 4232 C CB . GLN B 2 188 ? 7.085 -21.163 0.849 1.00 96.17 188 B 1 ATOM 4233 C CG . GLN B 2 188 ? 5.563 -21.073 1.039 1.00 91.55 188 B 1 ATOM 4234 C CD . GLN B 2 188 ? 4.815 -21.571 -0.200 1.00 89.11 188 B 1 ATOM 4235 O OE1 . GLN B 2 188 ? 4.883 -22.736 -0.553 1.00 81.77 188 B 1 ATOM 4236 N NE2 . GLN B 2 188 ? 4.088 -20.720 -0.887 1.00 78.19 188 B 1 ATOM 4237 N N . GLU B 2 189 ? 8.060 -22.980 3.260 1.00 97.46 189 B 1 ATOM 4238 C CA . GLU B 2 189 ? 7.802 -23.980 4.299 1.00 97.35 189 B 1 ATOM 4239 C C . GLU B 2 189 ? 8.308 -23.525 5.676 1.00 97.66 189 B 1 ATOM 4240 O O . GLU B 2 189 ? 7.630 -23.695 6.688 1.00 97.13 189 B 1 ATOM 4241 C CB . GLU B 2 189 ? 8.462 -25.307 3.892 1.00 96.80 189 B 1 ATOM 4242 C CG . GLU B 2 189 ? 7.461 -26.467 3.904 1.00 84.98 189 B 1 ATOM 4243 C CD . GLU B 2 189 ? 8.083 -27.808 3.519 1.00 71.90 189 B 1 ATOM 4244 O OE1 . GLU B 2 189 ? 7.307 -28.794 3.481 1.00 65.44 189 B 1 ATOM 4245 O OE2 . GLU B 2 189 ? 9.308 -27.862 3.279 1.00 66.18 189 B 1 ATOM 4246 N N . GLU B 2 190 ? 9.475 -22.886 5.707 1.00 97.85 190 B 1 ATOM 4247 C CA . GLU B 2 190 ? 10.077 -22.363 6.930 1.00 97.84 190 B 1 ATOM 4248 C C . GLU B 2 190 ? 9.320 -21.132 7.448 1.00 98.12 190 B 1 ATOM 4249 O O . GLU B 2 190 ? 9.042 -21.047 8.641 1.00 97.76 190 B 1 ATOM 4250 C CB . GLU B 2 190 ? 11.564 -22.071 6.666 1.00 97.11 190 B 1 ATOM 4251 C CG . GLU B 2 190 ? 12.368 -21.654 7.899 1.00 85.79 190 B 1 ATOM 4252 C CD . GLU B 2 190 ? 12.557 -22.740 8.975 1.00 81.92 190 B 1 ATOM 4253 O OE1 . GLU B 2 190 ? 13.375 -22.505 9.893 1.00 74.98 190 B 1 ATOM 4254 O OE2 . GLU B 2 190 ? 11.884 -23.796 8.957 1.00 76.62 190 B 1 ATOM 4255 N N . ALA B 2 191 ? 8.891 -20.232 6.547 1.00 97.80 191 B 1 ATOM 4256 C CA . ALA B 2 191 ? 8.023 -19.109 6.889 1.00 97.85 191 B 1 ATOM 4257 C C . ALA B 2 191 ? 6.694 -19.594 7.500 1.00 97.77 191 B 1 ATOM 4258 O O . ALA B 2 191 ? 6.329 -19.158 8.588 1.00 97.60 191 B 1 ATOM 4259 C CB . ALA B 2 191 ? 7.804 -18.250 5.638 1.00 97.77 191 B 1 ATOM 4260 N N . ARG B 2 192 ? 6.025 -20.560 6.866 1.00 97.78 192 B 1 ATOM 4261 C CA . ARG B 2 192 ? 4.779 -21.167 7.376 1.00 97.47 192 B 1 ATOM 4262 C C . ARG B 2 192 ? 4.955 -21.836 8.740 1.00 97.45 192 B 1 ATOM 4263 O O . ARG B 2 192 ? 4.024 -21.822 9.543 1.00 96.90 192 B 1 ATOM 4264 C CB . ARG B 2 192 ? 4.256 -22.217 6.384 1.00 96.93 192 B 1 ATOM 4265 C CG . ARG B 2 192 ? 3.569 -21.623 5.140 1.00 90.94 192 B 1 ATOM 4266 C CD . ARG B 2 192 ? 3.200 -22.765 4.187 1.00 88.14 192 B 1 ATOM 4267 N NE . ARG B 2 192 ? 2.415 -22.329 3.012 1.00 81.90 192 B 1 ATOM 4268 C CZ . ARG B 2 192 ? 2.134 -23.087 1.962 1.00 76.64 192 B 1 ATOM 4269 N NH1 . ARG B 2 192 ? 2.571 -24.307 1.842 1.00 69.00 192 B 1 ATOM 4270 N NH2 . ARG B 2 192 ? 1.395 -22.638 0.996 1.00 71.40 192 B 1 ATOM 4271 N N . ARG B 2 193 ? 6.106 -22.447 8.995 1.00 97.67 193 B 1 ATOM 4272 C CA . ARG B 2 193 ? 6.427 -23.048 10.292 1.00 97.54 193 B 1 ATOM 4273 C C . ARG B 2 193 ? 6.629 -21.976 11.358 1.00 97.72 193 B 1 ATOM 4274 O O . ARG B 2 193 ? 6.034 -22.069 12.425 1.00 97.43 193 B 1 ATOM 4275 C CB . ARG B 2 193 ? 7.673 -23.938 10.158 1.00 97.06 193 B 1 ATOM 4276 C CG . ARG B 2 193 ? 7.971 -24.714 11.454 1.00 94.13 193 B 1 ATOM 4277 C CD . ARG B 2 193 ? 9.278 -25.503 11.359 1.00 93.16 193 B 1 ATOM 4278 N NE . ARG B 2 193 ? 10.477 -24.646 11.372 1.00 91.79 193 B 1 ATOM 4279 C CZ . ARG B 2 193 ? 11.101 -24.151 12.441 1.00 91.49 193 B 1 ATOM 4280 N NH1 . ARG B 2 193 ? 10.668 -24.330 13.659 1.00 85.38 193 B 1 ATOM 4281 N NH2 . ARG B 2 193 ? 12.197 -23.476 12.299 1.00 87.51 193 B 1 ATOM 4282 N N . LEU B 2 194 ? 7.438 -20.963 11.053 1.00 97.80 194 B 1 ATOM 4283 C CA . LEU B 2 194 ? 7.836 -19.919 12.002 1.00 97.81 194 B 1 ATOM 4284 C C . LEU B 2 194 ? 6.727 -18.893 12.276 1.00 97.69 194 B 1 ATOM 4285 O O . LEU B 2 194 ? 6.653 -18.380 13.387 1.00 97.42 194 B 1 ATOM 4286 C CB . LEU B 2 194 ? 9.114 -19.247 11.492 1.00 97.90 194 B 1 ATOM 4287 C CG . LEU B 2 194 ? 10.364 -20.150 11.551 1.00 97.53 194 B 1 ATOM 4288 C CD1 . LEU B 2 194 ? 11.511 -19.480 10.809 1.00 96.88 194 B 1 ATOM 4289 C CD2 . LEU B 2 194 ? 10.817 -20.418 12.990 1.00 96.55 194 B 1 ATOM 4290 N N . GLU B 2 195 ? 5.820 -18.643 11.326 1.00 97.72 195 B 1 ATOM 4291 C CA . GLU B 2 195 ? 4.645 -17.780 11.538 1.00 97.55 195 B 1 ATOM 4292 C C . GLU B 2 195 ? 3.683 -18.353 12.596 1.00 97.43 195 B 1 ATOM 4293 O O . GLU B 2 195 ? 2.920 -17.614 13.213 1.00 96.75 195 B 1 ATOM 4294 C CB . GLU B 2 195 ? 3.920 -17.535 10.201 1.00 97.17 195 B 1 ATOM 4295 C CG . GLU B 2 195 ? 2.865 -16.413 10.303 1.00 96.47 195 B 1 ATOM 4296 C CD . GLU B 2 195 ? 2.100 -16.112 8.999 1.00 96.32 195 B 1 ATOM 4297 O OE1 . GLU B 2 195 ? 1.412 -15.066 8.941 1.00 93.55 195 B 1 ATOM 4298 O OE2 . GLU B 2 195 ? 2.131 -16.915 8.042 1.00 94.18 195 B 1 ATOM 4299 N N . LYS B 2 196 ? 3.737 -19.660 12.851 1.00 97.51 196 B 1 ATOM 4300 C CA . LYS B 2 196 ? 2.952 -20.324 13.908 1.00 97.13 196 B 1 ATOM 4301 C C . LYS B 2 196 ? 3.582 -20.209 15.296 1.00 96.92 196 B 1 ATOM 4302 O O . LYS B 2 196 ? 2.961 -20.624 16.270 1.00 95.76 196 B 1 ATOM 4303 C CB . LYS B 2 196 ? 2.738 -21.800 13.561 1.00 96.55 196 B 1 ATOM 4304 C CG . LYS B 2 196 ? 1.942 -21.985 12.267 1.00 93.90 196 B 1 ATOM 4305 C CD . LYS B 2 196 ? 1.859 -23.475 11.928 1.00 89.87 196 B 1 ATOM 4306 C CE . LYS B 2 196 ? 1.138 -23.636 10.592 1.00 82.63 196 B 1 ATOM 4307 N NZ . LYS B 2 196 ? 1.072 -25.059 10.189 1.00 72.56 196 B 1 ATOM 4308 N N . THR B 2 197 ? 4.800 -19.691 15.397 1.00 97.47 197 B 1 ATOM 4309 C CA . THR B 2 197 ? 5.492 -19.429 16.664 1.00 97.16 197 B 1 ATOM 4310 C C . THR B 2 197 ? 5.409 -17.942 17.006 1.00 97.30 197 B 1 ATOM 4311 O O . THR B 2 197 ? 5.067 -17.117 16.153 1.00 96.45 197 B 1 ATOM 4312 C CB . THR B 2 197 ? 6.956 -19.892 16.619 1.00 96.26 197 B 1 ATOM 4313 O OG1 . THR B 2 197 ? 7.758 -19.065 15.812 1.00 92.83 197 B 1 ATOM 4314 C CG2 . THR B 2 197 ? 7.114 -21.324 16.105 1.00 92.09 197 B 1 ATOM 4315 N N . ARG B 2 198 ? 5.749 -17.553 18.243 1.00 97.43 198 B 1 ATOM 4316 C CA . ARG B 2 198 ? 6.023 -16.137 18.503 1.00 97.74 198 B 1 ATOM 4317 C C . ARG B 2 198 ? 7.239 -15.716 17.692 1.00 98.06 198 B 1 ATOM 4318 O O . ARG B 2 198 ? 8.273 -16.379 17.737 1.00 97.76 198 B 1 ATOM 4319 C CB . ARG B 2 198 ? 6.222 -15.860 19.992 1.00 97.28 198 B 1 ATOM 4320 C CG . ARG B 2 198 ? 6.457 -14.351 20.250 1.00 96.56 198 B 1 ATOM 4321 C CD . ARG B 2 198 ? 6.804 -14.081 21.714 1.00 94.95 198 B 1 ATOM 4322 N NE . ARG B 2 198 ? 7.116 -12.658 21.937 1.00 94.57 198 B 1 ATOM 4323 C CZ . ARG B 2 198 ? 7.661 -12.124 23.022 1.00 94.92 198 B 1 ATOM 4324 N NH1 . ARG B 2 198 ? 7.983 -12.843 24.056 1.00 91.80 198 B 1 ATOM 4325 N NH2 . ARG B 2 198 ? 7.889 -10.846 23.074 1.00 92.44 198 B 1 ATOM 4326 N N . TRP B 2 199 ? 7.127 -14.583 17.016 1.00 98.02 199 B 1 ATOM 4327 C CA . TRP B 2 199 ? 8.235 -14.005 16.272 1.00 98.16 199 B 1 ATOM 4328 C C . TRP B 2 199 ? 8.190 -12.482 16.270 1.00 98.20 199 B 1 ATOM 4329 O O . TRP B 2 199 ? 7.154 -11.869 16.533 1.00 97.99 199 B 1 ATOM 4330 C CB . TRP B 2 199 ? 8.270 -14.586 14.856 1.00 98.15 199 B 1 ATOM 4331 C CG . TRP B 2 199 ? 7.152 -14.158 13.954 1.00 98.23 199 B 1 ATOM 4332 C CD1 . TRP B 2 199 ? 5.874 -14.606 13.999 1.00 97.84 199 B 1 ATOM 4333 C CD2 . TRP B 2 199 ? 7.208 -13.202 12.851 1.00 98.26 199 B 1 ATOM 4334 N NE1 . TRP B 2 199 ? 5.130 -14.000 12.999 1.00 97.79 199 B 1 ATOM 4335 C CE2 . TRP B 2 199 ? 5.914 -13.135 12.264 1.00 98.04 199 B 1 ATOM 4336 C CE3 . TRP B 2 199 ? 8.235 -12.408 12.295 1.00 98.03 199 B 1 ATOM 4337 C CZ2 . TRP B 2 199 ? 5.641 -12.308 11.153 1.00 97.69 199 B 1 ATOM 4338 C CZ3 . TRP B 2 199 ? 7.963 -11.584 11.191 1.00 97.67 199 B 1 ATOM 4339 C CH2 . TRP B 2 199 ? 6.679 -11.537 10.629 1.00 97.56 199 B 1 ATOM 4340 N N . ALA B 2 200 ? 9.335 -11.874 15.981 1.00 98.40 200 B 1 ATOM 4341 C CA . ALA B 2 200 ? 9.501 -10.432 15.900 1.00 98.44 200 B 1 ATOM 4342 C C . ALA B 2 200 ? 10.476 -10.042 14.780 1.00 98.57 200 B 1 ATOM 4343 O O . ALA B 2 200 ? 11.253 -10.864 14.291 1.00 98.51 200 B 1 ATOM 4344 C CB . ALA B 2 200 ? 9.965 -9.920 17.271 1.00 98.26 200 B 1 ATOM 4345 N N . ILE B 2 201 ? 10.451 -8.759 14.418 1.00 98.61 201 B 1 ATOM 4346 C CA . ILE B 2 201 ? 11.540 -8.100 13.691 1.00 98.66 201 B 1 ATOM 4347 C C . ILE B 2 201 ? 12.163 -7.085 14.645 1.00 98.67 201 B 1 ATOM 4348 O O . ILE B 2 201 ? 11.460 -6.248 15.210 1.00 98.53 201 B 1 ATOM 4349 C CB . ILE B 2 201 ? 11.070 -7.457 12.368 1.00 98.59 201 B 1 ATOM 4350 C CG1 . ILE B 2 201 ? 10.465 -8.526 11.430 1.00 98.27 201 B 1 ATOM 4351 C CG2 . ILE B 2 201 ? 12.251 -6.735 11.680 1.00 98.33 201 B 1 ATOM 4352 C CD1 . ILE B 2 201 ? 9.897 -7.982 10.112 1.00 97.86 201 B 1 ATOM 4353 N N . ILE B 2 202 ? 13.471 -7.154 14.828 1.00 98.68 202 B 1 ATOM 4354 C CA . ILE B 2 202 ? 14.235 -6.217 15.658 1.00 98.72 202 B 1 ATOM 4355 C C . ILE B 2 202 ? 15.396 -5.673 14.829 1.00 98.70 202 B 1 ATOM 4356 O O . ILE B 2 202 ? 16.184 -6.446 14.284 1.00 98.52 202 B 1 ATOM 4357 C CB . ILE B 2 202 ? 14.706 -6.876 16.981 1.00 98.69 202 B 1 ATOM 4358 C CG1 . ILE B 2 202 ? 13.496 -7.409 17.793 1.00 98.43 202 B 1 ATOM 4359 C CG2 . ILE B 2 202 ? 15.526 -5.871 17.819 1.00 98.49 202 B 1 ATOM 4360 C CD1 . ILE B 2 202 ? 13.848 -8.097 19.119 1.00 98.10 202 B 1 ATOM 4361 N N . ASN B 2 203 ? 15.512 -4.340 14.754 1.00 98.83 203 B 1 ATOM 4362 C CA . ASN B 2 203 ? 16.715 -3.691 14.247 1.00 98.80 203 B 1 ATOM 4363 C C . ASN B 2 203 ? 17.707 -3.503 15.396 1.00 98.85 203 B 1 ATOM 4364 O O . ASN B 2 203 ? 17.340 -3.042 16.475 1.00 98.67 203 B 1 ATOM 4365 C CB . ASN B 2 203 ? 16.374 -2.356 13.558 1.00 98.49 203 B 1 ATOM 4366 C CG . ASN B 2 203 ? 15.809 -2.523 12.155 1.00 96.85 203 B 1 ATOM 4367 O OD1 . ASN B 2 203 ? 15.543 -3.608 11.671 1.00 90.24 203 B 1 ATOM 4368 N ND2 . ASN B 2 203 ? 15.624 -1.427 11.450 1.00 89.34 203 B 1 ATOM 4369 N N . VAL B 2 204 ? 18.967 -3.832 15.146 1.00 98.71 204 B 1 ATOM 4370 C CA . VAL B 2 204 ? 20.092 -3.560 16.048 1.00 98.71 204 B 1 ATOM 4371 C C . VAL B 2 204 ? 20.858 -2.382 15.474 1.00 98.71 204 B 1 ATOM 4372 O O . VAL B 2 204 ? 21.638 -2.547 14.536 1.00 98.48 204 B 1 ATOM 4373 C CB . VAL B 2 204 ? 20.986 -4.799 16.228 1.00 98.55 204 B 1 ATOM 4374 C CG1 . VAL B 2 204 ? 22.129 -4.514 17.205 1.00 98.06 204 B 1 ATOM 4375 C CG2 . VAL B 2 204 ? 20.172 -5.989 16.761 1.00 98.15 204 B 1 ATOM 4376 N N . TRP B 2 205 ? 20.604 -1.190 16.020 1.00 98.82 205 B 1 ATOM 4377 C CA . TRP B 2 205 ? 21.289 0.037 15.619 1.00 98.85 205 B 1 ATOM 4378 C C . TRP B 2 205 ? 22.546 0.232 16.462 1.00 98.81 205 B 1 ATOM 4379 O O . TRP B 2 205 ? 22.489 0.159 17.688 1.00 98.65 205 B 1 ATOM 4380 C CB . TRP B 2 205 ? 20.322 1.217 15.720 1.00 98.83 205 B 1 ATOM 4381 C CG . TRP B 2 205 ? 20.867 2.495 15.156 1.00 98.78 205 B 1 ATOM 4382 C CD1 . TRP B 2 205 ? 20.669 2.941 13.898 1.00 98.52 205 B 1 ATOM 4383 C CD2 . TRP B 2 205 ? 21.710 3.493 15.814 1.00 98.68 205 B 1 ATOM 4384 N NE1 . TRP B 2 205 ? 21.322 4.158 13.726 1.00 98.33 205 B 1 ATOM 4385 C CE2 . TRP B 2 205 ? 21.970 4.534 14.874 1.00 98.50 205 B 1 ATOM 4386 C CE3 . TRP B 2 205 ? 22.264 3.628 17.102 1.00 98.48 205 B 1 ATOM 4387 C CZ2 . TRP B 2 205 ? 22.748 5.666 15.205 1.00 98.08 205 B 1 ATOM 4388 C CZ3 . TRP B 2 205 ? 23.047 4.759 17.428 1.00 97.89 205 B 1 ATOM 4389 C CH2 . TRP B 2 205 ? 23.278 5.763 16.486 1.00 97.76 205 B 1 ATOM 4390 N N . ARG B 2 206 ? 23.681 0.478 15.813 1.00 98.65 206 B 1 ATOM 4391 C CA . ARG B 2 206 ? 24.983 0.639 16.468 1.00 98.61 206 B 1 ATOM 4392 C C . ARG B 2 206 ? 25.757 1.801 15.852 1.00 98.72 206 B 1 ATOM 4393 O O . ARG B 2 206 ? 25.885 1.842 14.630 1.00 98.50 206 B 1 ATOM 4394 C CB . ARG B 2 206 ? 25.768 -0.673 16.342 1.00 97.91 206 B 1 ATOM 4395 C CG . ARG B 2 206 ? 27.170 -0.584 16.960 1.00 96.37 206 B 1 ATOM 4396 C CD . ARG B 2 206 ? 28.004 -1.840 16.667 1.00 95.52 206 B 1 ATOM 4397 N NE . ARG B 2 206 ? 27.387 -3.033 17.253 1.00 94.26 206 B 1 ATOM 4398 C CZ . ARG B 2 206 ? 27.509 -3.465 18.490 1.00 95.34 206 B 1 ATOM 4399 N NH1 . ARG B 2 206 ? 28.261 -2.875 19.368 1.00 89.39 206 B 1 ATOM 4400 N NH2 . ARG B 2 206 ? 26.869 -4.528 18.859 1.00 90.60 206 B 1 ATOM 4401 N N . PRO B 2 207 ? 26.336 2.704 16.668 1.00 98.62 207 B 1 ATOM 4402 C CA . PRO B 2 207 ? 27.359 3.619 16.183 1.00 98.53 207 B 1 ATOM 4403 C C . PRO B 2 207 ? 28.601 2.847 15.717 1.00 98.49 207 B 1 ATOM 4404 O O . PRO B 2 207 ? 29.027 1.893 16.361 1.00 97.99 207 B 1 ATOM 4405 C CB . PRO B 2 207 ? 27.689 4.544 17.359 1.00 98.07 207 B 1 ATOM 4406 C CG . PRO B 2 207 ? 26.507 4.376 18.309 1.00 96.60 207 B 1 ATOM 4407 C CD . PRO B 2 207 ? 26.076 2.932 18.076 1.00 98.20 207 B 1 ATOM 4408 N N . VAL B 2 208 ? 29.198 3.288 14.607 1.00 98.35 208 B 1 ATOM 4409 C CA . VAL B 2 208 ? 30.524 2.816 14.157 1.00 98.11 208 B 1 ATOM 4410 C C . VAL B 2 208 ? 31.633 3.598 14.867 1.00 97.76 208 B 1 ATOM 4411 O O . VAL B 2 208 ? 32.722 3.083 15.103 1.00 96.30 208 B 1 ATOM 4412 C CB . VAL B 2 208 ? 30.641 2.942 12.626 1.00 97.67 208 B 1 ATOM 4413 C CG1 . VAL B 2 208 ? 32.016 2.544 12.093 1.00 96.34 208 B 1 ATOM 4414 C CG2 . VAL B 2 208 ? 29.596 2.055 11.929 1.00 96.79 208 B 1 ATOM 4415 N N . ARG B 2 209 ? 31.333 4.844 15.252 1.00 97.48 209 B 1 ATOM 4416 C CA . ARG B 2 209 ? 32.124 5.702 16.145 1.00 96.90 209 B 1 ATOM 4417 C C . ARG B 2 209 ? 31.179 6.502 17.034 1.00 97.34 209 B 1 ATOM 4418 O O . ARG B 2 209 ? 29.986 6.583 16.736 1.00 96.60 209 B 1 ATOM 4419 C CB . ARG B 2 209 ? 33.061 6.613 15.326 1.00 94.76 209 B 1 ATOM 4420 C CG . ARG B 2 209 ? 32.336 7.538 14.338 1.00 90.02 209 B 1 ATOM 4421 C CD . ARG B 2 209 ? 33.356 8.410 13.592 1.00 88.94 209 B 1 ATOM 4422 N NE . ARG B 2 209 ? 32.713 9.242 12.565 1.00 86.09 209 B 1 ATOM 4423 C CZ . ARG B 2 209 ? 32.724 9.043 11.252 1.00 86.46 209 B 1 ATOM 4424 N NH1 . ARG B 2 209 ? 33.266 8.002 10.700 1.00 77.06 209 B 1 ATOM 4425 N NH2 . ARG B 2 209 ? 32.190 9.921 10.471 1.00 79.79 209 B 1 ATOM 4426 N N . LYS B 2 210 ? 31.696 7.125 18.101 1.00 97.12 210 B 1 ATOM 4427 C CA . LYS B 2 210 ? 30.893 7.921 19.038 1.00 97.24 210 B 1 ATOM 4428 C C . LYS B 2 210 ? 29.980 8.907 18.296 1.00 97.49 210 B 1 ATOM 4429 O O . LYS B 2 210 ? 30.437 9.656 17.438 1.00 96.91 210 B 1 ATOM 4430 C CB . LYS B 2 210 ? 31.815 8.643 20.034 1.00 96.69 210 B 1 ATOM 4431 C CG . LYS B 2 210 ? 31.017 9.375 21.124 1.00 95.42 210 B 1 ATOM 4432 C CD . LYS B 2 210 ? 31.936 10.029 22.164 1.00 92.93 210 B 1 ATOM 4433 C CE . LYS B 2 210 ? 31.072 10.706 23.236 1.00 88.81 210 B 1 ATOM 4434 N NZ . LYS B 2 210 ? 31.885 11.346 24.289 1.00 82.15 210 B 1 ATOM 4435 N N . VAL B 2 211 ? 28.696 8.924 18.654 1.00 97.64 211 B 1 ATOM 4436 C CA . VAL B 2 211 ? 27.706 9.843 18.079 1.00 97.67 211 B 1 ATOM 4437 C C . VAL B 2 211 ? 27.944 11.245 18.631 1.00 97.43 211 B 1 ATOM 4438 O O . VAL B 2 211 ? 27.845 11.464 19.836 1.00 97.00 211 B 1 ATOM 4439 C CB . VAL B 2 211 ? 26.272 9.364 18.374 1.00 97.67 211 B 1 ATOM 4440 C CG1 . VAL B 2 211 ? 25.227 10.314 17.786 1.00 97.20 211 B 1 ATOM 4441 C CG2 . VAL B 2 211 ? 26.025 7.972 17.771 1.00 97.22 211 B 1 ATOM 4442 N N . THR B 2 212 ? 28.247 12.190 17.735 1.00 97.37 212 B 1 ATOM 4443 C CA . THR B 2 212 ? 28.440 13.613 18.059 1.00 96.99 212 B 1 ATOM 4444 C C . THR B 2 212 ? 27.465 14.523 17.312 1.00 96.78 212 B 1 ATOM 4445 O O . THR B 2 212 ? 27.419 15.719 17.577 1.00 95.94 212 B 1 ATOM 4446 C CB . THR B 2 212 ? 29.880 14.058 17.768 1.00 96.50 212 B 1 ATOM 4447 O OG1 . THR B 2 212 ? 30.185 13.916 16.401 1.00 95.13 212 B 1 ATOM 4448 C CG2 . THR B 2 212 ? 30.919 13.253 18.555 1.00 94.85 212 B 1 ATOM 4449 N N . ASN B 2 213 ? 26.684 13.975 16.379 1.00 97.37 213 B 1 ATOM 4450 C CA . ASN B 2 213 ? 25.655 14.652 15.603 1.00 97.47 213 B 1 ATOM 4451 C C . ASN B 2 213 ? 24.566 13.666 15.175 1.00 97.71 213 B 1 ATOM 4452 O O . ASN B 2 213 ? 24.795 12.456 15.110 1.00 97.58 213 B 1 ATOM 4453 C CB . ASN B 2 213 ? 26.295 15.359 14.398 1.00 97.23 213 B 1 ATOM 4454 C CG . ASN B 2 213 ? 27.094 14.423 13.505 1.00 96.88 213 B 1 ATOM 4455 O OD1 . ASN B 2 213 ? 26.585 13.787 12.600 1.00 91.02 213 B 1 ATOM 4456 N ND2 . ASN B 2 213 ? 28.388 14.316 13.731 1.00 90.80 213 B 1 ATOM 4457 N N . GLU B 2 214 ? 23.381 14.203 14.888 1.00 97.90 214 B 1 ATOM 4458 C CA . GLU B 2 214 ? 22.216 13.481 14.364 1.00 97.84 214 B 1 ATOM 4459 C C . GLU B 2 214 ? 21.907 12.153 15.093 1.00 98.11 214 B 1 ATOM 4460 O O . GLU B 2 214 ? 21.813 11.098 14.454 1.00 97.54 214 B 1 ATOM 4461 C CB . GLU B 2 214 ? 22.335 13.308 12.843 1.00 97.02 214 B 1 ATOM 4462 C CG . GLU B 2 214 ? 22.462 14.651 12.111 1.00 92.72 214 B 1 ATOM 4463 C CD . GLU B 2 214 ? 22.096 14.562 10.635 1.00 90.19 214 B 1 ATOM 4464 O OE1 . GLU B 2 214 ? 22.609 15.379 9.851 1.00 83.97 214 B 1 ATOM 4465 O OE2 . GLU B 2 214 ? 21.207 13.765 10.263 1.00 84.98 214 B 1 ATOM 4466 N N . PRO B 2 215 ? 21.732 12.162 16.426 1.00 98.29 215 B 1 ATOM 4467 C CA . PRO B 2 215 ? 21.394 10.953 17.163 1.00 98.30 215 B 1 ATOM 4468 C C . PRO B 2 215 ? 20.070 10.339 16.683 1.00 98.46 215 B 1 ATOM 4469 O O . PRO B 2 215 ? 19.233 10.997 16.059 1.00 98.24 215 B 1 ATOM 4470 C CB . PRO B 2 215 ? 21.347 11.373 18.636 1.00 97.84 215 B 1 ATOM 4471 C CG . PRO B 2 215 ? 20.992 12.859 18.568 1.00 96.85 215 B 1 ATOM 4472 C CD . PRO B 2 215 ? 21.715 13.324 17.304 1.00 97.90 215 B 1 ATOM 4473 N N . LEU B 2 216 ? 19.861 9.060 17.004 1.00 98.65 216 B 1 ATOM 4474 C CA . LEU B 2 216 ? 18.614 8.352 16.718 1.00 98.75 216 B 1 ATOM 4475 C C . LEU B 2 216 ? 17.697 8.392 17.944 1.00 98.76 216 B 1 ATOM 4476 O O . LEU B 2 216 ? 18.067 7.901 19.010 1.00 98.58 216 B 1 ATOM 4477 C CB . LEU B 2 216 ? 18.942 6.917 16.271 1.00 98.67 216 B 1 ATOM 4478 C CG . LEU B 2 216 ? 17.703 6.081 15.888 1.00 98.24 216 B 1 ATOM 4479 C CD1 . LEU B 2 216 ? 16.967 6.641 14.672 1.00 97.74 216 B 1 ATOM 4480 C CD2 . LEU B 2 216 ? 18.133 4.654 15.549 1.00 97.50 216 B 1 ATOM 4481 N N . ALA B 2 217 ? 16.490 8.930 17.769 1.00 98.77 217 B 1 ATOM 4482 C CA . ALA B 2 217 ? 15.430 8.907 18.765 1.00 98.80 217 B 1 ATOM 4483 C C . ALA B 2 217 ? 14.473 7.733 18.533 1.00 98.86 217 B 1 ATOM 4484 O O . ALA B 2 217 ? 14.197 7.349 17.395 1.00 98.78 217 B 1 ATOM 4485 C CB . ALA B 2 217 ? 14.687 10.244 18.757 1.00 98.61 217 B 1 ATOM 4486 N N . VAL B 2 218 ? 13.926 7.207 19.621 1.00 98.83 218 B 1 ATOM 4487 C CA . VAL B 2 218 ? 12.901 6.159 19.651 1.00 98.84 218 B 1 ATOM 4488 C C . VAL B 2 218 ? 11.691 6.634 20.448 1.00 98.80 218 B 1 ATOM 4489 O O . VAL B 2 218 ? 11.828 7.341 21.446 1.00 98.59 218 B 1 ATOM 4490 C CB . VAL B 2 218 ? 13.448 4.832 20.212 1.00 98.72 218 B 1 ATOM 4491 C CG1 . VAL B 2 218 ? 14.383 4.159 19.207 1.00 98.15 218 B 1 ATOM 4492 C CG2 . VAL B 2 218 ? 14.201 4.998 21.545 1.00 97.61 218 B 1 ATOM 4493 N N . CYS B 2 219 ? 10.500 6.250 20.010 1.00 98.68 219 B 1 ATOM 4494 C CA . CYS B 2 219 ? 9.243 6.612 20.652 1.00 98.54 219 B 1 ATOM 4495 C C . CYS B 2 219 ? 8.681 5.422 21.435 1.00 98.65 219 B 1 ATOM 4496 O O . CYS B 2 219 ? 8.554 4.327 20.891 1.00 98.08 219 B 1 ATOM 4497 C CB . CYS B 2 219 ? 8.283 7.104 19.568 1.00 97.37 219 B 1 ATOM 4498 S SG . CYS B 2 219 ? 6.824 7.841 20.330 1.00 94.69 219 B 1 ATOM 4499 N N . ASP B 2 220 ? 8.292 5.638 22.693 1.00 98.68 220 B 1 ATOM 4500 C CA . ASP B 2 220 ? 7.624 4.609 23.498 1.00 98.65 220 B 1 ATOM 4501 C C . ASP B 2 220 ? 6.380 4.098 22.758 1.00 98.63 220 B 1 ATOM 4502 O O . ASP B 2 220 ? 5.442 4.860 22.491 1.00 98.29 220 B 1 ATOM 4503 C CB . ASP B 2 220 ? 7.265 5.179 24.874 1.00 98.44 220 B 1 ATOM 4504 C CG . ASP B 2 220 ? 6.665 4.164 25.859 1.00 97.98 220 B 1 ATOM 4505 O OD1 . ASP B 2 220 ? 5.998 3.179 25.470 1.00 96.31 220 B 1 ATOM 4506 O OD2 . ASP B 2 220 ? 6.826 4.377 27.080 1.00 95.52 220 B 1 ATOM 4507 N N . ALA B 2 221 ? 6.362 2.803 22.453 1.00 98.59 221 B 1 ATOM 4508 C CA . ALA B 2 221 ? 5.301 2.167 21.676 1.00 98.50 221 B 1 ATOM 4509 C C . ALA B 2 221 ? 3.898 2.414 22.256 1.00 98.42 221 B 1 ATOM 4510 O O . ALA B 2 221 ? 2.925 2.509 21.509 1.00 97.83 221 B 1 ATOM 4511 C CB . ALA B 2 221 ? 5.607 0.669 21.610 1.00 98.16 221 B 1 ATOM 4512 N N . ARG B 2 222 ? 3.785 2.569 23.576 1.00 98.36 222 B 1 ATOM 4513 C CA . ARG B 2 222 ? 2.521 2.810 24.296 1.00 98.09 222 B 1 ATOM 4514 C C . ARG B 2 222 ? 1.956 4.212 24.053 1.00 98.03 222 B 1 ATOM 4515 O O . ARG B 2 222 ? 0.778 4.439 24.305 1.00 97.26 222 B 1 ATOM 4516 C CB . ARG B 2 222 ? 2.751 2.611 25.796 1.00 97.54 222 B 1 ATOM 4517 C CG . ARG B 2 222 ? 3.289 1.217 26.149 1.00 96.58 222 B 1 ATOM 4518 C CD . ARG B 2 222 ? 3.655 1.116 27.630 1.00 95.49 222 B 1 ATOM 4519 N NE . ARG B 2 222 ? 4.793 1.990 27.967 1.00 94.29 222 B 1 ATOM 4520 C CZ . ARG B 2 222 ? 5.325 2.160 29.169 1.00 94.45 222 B 1 ATOM 4521 N NH1 . ARG B 2 222 ? 4.884 1.518 30.212 1.00 90.34 222 B 1 ATOM 4522 N NH2 . ARG B 2 222 ? 6.318 2.976 29.330 1.00 91.17 222 B 1 ATOM 4523 N N . SER B 2 223 ? 2.786 5.153 23.617 1.00 98.41 223 B 1 ATOM 4524 C CA . SER B 2 223 ? 2.385 6.549 23.402 1.00 98.27 223 B 1 ATOM 4525 C C . SER B 2 223 ? 1.835 6.835 22.002 1.00 98.24 223 B 1 ATOM 4526 O O . SER B 2 223 ? 1.325 7.931 21.776 1.00 97.38 223 B 1 ATOM 4527 C CB . SER B 2 223 ? 3.540 7.491 23.749 1.00 97.88 223 B 1 ATOM 4528 O OG . SER B 2 223 ? 4.594 7.438 22.815 1.00 96.72 223 B 1 ATOM 4529 N N . VAL B 2 224 ? 1.907 5.862 21.092 1.00 98.21 224 B 1 ATOM 4530 C CA . VAL B 2 224 ? 1.390 5.959 19.720 1.00 98.04 224 B 1 ATOM 4531 C C . VAL B 2 224 ? 0.302 4.909 19.521 1.00 97.86 224 B 1 ATOM 4532 O O . VAL B 2 224 ? 0.550 3.711 19.675 1.00 97.33 224 B 1 ATOM 4533 C CB . VAL B 2 224 ? 2.519 5.806 18.686 1.00 97.77 224 B 1 ATOM 4534 C CG1 . VAL B 2 224 ? 2.001 6.012 17.262 1.00 95.86 224 B 1 ATOM 4535 C CG2 . VAL B 2 224 ? 3.629 6.835 18.931 1.00 96.01 224 B 1 ATOM 4536 N N . ARG B 2 225 ? -0.910 5.344 19.186 1.00 97.77 225 B 1 ATOM 4537 C CA . ARG B 2 225 ? -2.057 4.462 18.946 1.00 97.36 225 B 1 ATOM 4538 C C . ARG B 2 225 ? -1.953 3.782 17.582 1.00 97.41 225 B 1 ATOM 4539 O O . ARG B 2 225 ? -1.237 4.251 16.699 1.00 97.23 225 B 1 ATOM 4540 C CB . ARG B 2 225 ? -3.369 5.255 19.051 1.00 96.92 225 B 1 ATOM 4541 C CG . ARG B 2 225 ? -3.527 6.038 20.367 1.00 95.32 225 B 1 ATOM 4542 C CD . ARG B 2 225 ? -4.911 6.703 20.467 1.00 94.35 225 B 1 ATOM 4543 N NE . ARG B 2 225 ? -5.263 7.447 19.249 1.00 92.11 225 B 1 ATOM 4544 C CZ . ARG B 2 225 ? -4.809 8.621 18.833 1.00 91.36 225 B 1 ATOM 4545 N NH1 . ARG B 2 225 ? -4.031 9.361 19.560 1.00 86.45 225 B 1 ATOM 4546 N NH2 . ARG B 2 225 ? -5.148 9.042 17.651 1.00 88.71 225 B 1 ATOM 4547 N N . GLU B 2 226 ? -2.700 2.701 17.392 1.00 96.81 226 B 1 ATOM 4548 C CA . GLU B 2 226 ? -2.806 2.025 16.093 1.00 96.26 226 B 1 ATOM 4549 C C . GLU B 2 226 ? -3.334 2.974 14.999 1.00 97.03 226 B 1 ATOM 4550 O O . GLU B 2 226 ? -2.756 3.038 13.924 1.00 96.34 226 B 1 ATOM 4551 C CB . GLU B 2 226 ? -3.703 0.783 16.215 1.00 94.18 226 B 1 ATOM 4552 C CG . GLU B 2 226 ? -3.105 -0.353 17.068 1.00 86.93 226 B 1 ATOM 4553 C CD . GLU B 2 226 ? -1.857 -1.005 16.455 1.00 83.82 226 B 1 ATOM 4554 O OE1 . GLU B 2 226 ? -0.913 -1.319 17.215 1.00 76.70 226 B 1 ATOM 4555 O OE2 . GLU B 2 226 ? -1.812 -1.204 15.228 1.00 77.03 226 B 1 ATOM 4556 N N . ASP B 2 227 ? -4.352 3.789 15.293 1.00 96.93 227 B 1 ATOM 4557 C CA . ASP B 2 227 ? -4.975 4.731 14.351 1.00 96.89 227 B 1 ATOM 4558 C C . ASP B 2 227 ? -4.084 5.927 13.949 1.00 97.44 227 B 1 ATOM 4559 O O . ASP B 2 227 ? -4.473 6.736 13.109 1.00 96.86 227 B 1 ATOM 4560 C CB . ASP B 2 227 ? -6.328 5.216 14.921 1.00 96.20 227 B 1 ATOM 4561 C CG . ASP B 2 227 ? -6.195 6.149 16.143 1.00 94.66 227 B 1 ATOM 4562 O OD1 . ASP B 2 227 ? -5.300 5.941 16.988 1.00 92.78 227 B 1 ATOM 4563 O OD2 . ASP B 2 227 ? -6.987 7.100 16.304 1.00 91.49 227 B 1 ATOM 4564 N N . GLU B 2 228 ? -2.881 6.046 14.517 1.00 97.65 228 B 1 ATOM 4565 C CA . GLU B 2 228 ? -1.878 7.049 14.131 1.00 97.85 228 B 1 ATOM 4566 C C . GLU B 2 228 ? -0.867 6.510 13.106 1.00 98.09 228 B 1 ATOM 4567 O O . GLU B 2 228 ? -0.015 7.263 12.631 1.00 97.89 228 B 1 ATOM 4568 C CB . GLU B 2 228 ? -1.150 7.576 15.378 1.00 97.79 228 B 1 ATOM 4569 C CG . GLU B 2 228 ? -2.099 8.316 16.338 1.00 97.36 228 B 1 ATOM 4570 C CD . GLU B 2 228 ? -1.359 8.824 17.577 1.00 97.26 228 B 1 ATOM 4571 O OE1 . GLU B 2 228 ? -0.852 9.964 17.543 1.00 94.62 228 B 1 ATOM 4572 O OE2 . GLU B 2 228 ? -1.307 8.102 18.589 1.00 95.37 228 B 1 ATOM 4573 N N . LEU B 2 229 ? -0.938 5.224 12.781 1.00 97.90 229 B 1 ATOM 4574 C CA . LEU B 2 229 ? -0.024 4.560 11.854 1.00 97.86 229 B 1 ATOM 4575 C C . LEU B 2 229 ? -0.677 4.443 10.472 1.00 97.76 229 B 1 ATOM 4576 O O . LEU B 2 229 ? -1.837 4.064 10.365 1.00 97.42 229 B 1 ATOM 4577 C CB . LEU B 2 229 ? 0.370 3.189 12.426 1.00 97.84 229 B 1 ATOM 4578 C CG . LEU B 2 229 ? 1.003 3.225 13.833 1.00 97.52 229 B 1 ATOM 4579 C CD1 . LEU B 2 229 ? 1.264 1.804 14.325 1.00 97.28 229 B 1 ATOM 4580 C CD2 . LEU B 2 229 ? 2.332 3.987 13.848 1.00 96.94 229 B 1 ATOM 4581 N N . PHE B 2 230 ? 0.061 4.740 9.405 1.00 98.10 230 B 1 ATOM 4582 C CA . PHE B 2 230 ? -0.464 4.739 8.040 1.00 97.94 230 B 1 ATOM 4583 C C . PHE B 2 230 ? 0.447 3.948 7.111 1.00 97.89 230 B 1 ATOM 4584 O O . PHE B 2 230 ? 1.651 4.194 7.058 1.00 97.40 230 B 1 ATOM 4585 C CB . PHE B 2 230 ? -0.624 6.175 7.542 1.00 97.63 230 B 1 ATOM 4586 C CG . PHE B 2 230 ? -1.708 6.960 8.246 1.00 97.46 230 B 1 ATOM 4587 C CD1 . PHE B 2 230 ? -2.961 7.132 7.642 1.00 96.50 230 B 1 ATOM 4588 C CD2 . PHE B 2 230 ? -1.472 7.506 9.523 1.00 96.55 230 B 1 ATOM 4589 C CE1 . PHE B 2 230 ? -3.967 7.858 8.295 1.00 95.86 230 B 1 ATOM 4590 C CE2 . PHE B 2 230 ? -2.479 8.223 10.188 1.00 96.02 230 B 1 ATOM 4591 C CZ . PHE B 2 230 ? -3.726 8.401 9.569 1.00 95.93 230 B 1 ATOM 4592 N N . ASN B 2 231 ? -0.144 3.037 6.340 1.00 98.00 231 B 1 ATOM 4593 C CA . ASN B 2 231 ? 0.590 2.263 5.351 1.00 97.80 231 B 1 ATOM 4594 C C . ASN B 2 231 ? 1.258 3.192 4.332 1.00 97.94 231 B 1 ATOM 4595 O O . ASN B 2 231 ? 0.622 4.069 3.750 1.00 97.51 231 B 1 ATOM 4596 C CB . ASN B 2 231 ? -0.356 1.269 4.657 1.00 97.20 231 B 1 ATOM 4597 C CG . ASN B 2 231 ? -0.865 0.171 5.582 1.00 95.97 231 B 1 ATOM 4598 O OD1 . ASN B 2 231 ? -0.297 -0.135 6.610 1.00 92.20 231 B 1 ATOM 4599 N ND2 . ASN B 2 231 ? -1.954 -0.467 5.222 1.00 91.19 231 B 1 ATOM 4600 N N . THR B 2 232 ? 2.553 2.971 4.106 1.00 98.04 232 B 1 ATOM 4601 C CA . THR B 2 232 ? 3.346 3.641 3.073 1.00 98.10 232 B 1 ATOM 4602 C C . THR B 2 232 ? 4.250 2.589 2.454 1.00 98.20 232 B 1 ATOM 4603 O O . THR B 2 232 ? 4.972 1.904 3.174 1.00 97.72 232 B 1 ATOM 4604 C CB . THR B 2 232 ? 4.188 4.779 3.671 1.00 97.61 232 B 1 ATOM 4605 O OG1 . THR B 2 232 ? 3.360 5.710 4.336 1.00 94.31 232 B 1 ATOM 4606 C CG2 . THR B 2 232 ? 4.971 5.556 2.613 1.00 94.29 232 B 1 ATOM 4607 N N . LEU B 2 233 ? 4.230 2.438 1.122 1.00 98.43 233 B 1 ATOM 4608 C CA . LEU B 2 233 ? 5.110 1.479 0.468 1.00 98.43 233 B 1 ATOM 4609 C C . LEU B 2 233 ? 6.493 2.092 0.255 1.00 98.53 233 B 1 ATOM 4610 O O . LEU B 2 233 ? 6.637 3.113 -0.410 1.00 98.31 233 B 1 ATOM 4611 C CB . LEU B 2 233 ? 4.474 0.976 -0.832 1.00 98.12 233 B 1 ATOM 4612 C CG . LEU B 2 233 ? 5.263 -0.200 -1.437 1.00 95.38 233 B 1 ATOM 4613 C CD1 . LEU B 2 233 ? 5.126 -1.475 -0.603 1.00 93.48 233 B 1 ATOM 4614 C CD2 . LEU B 2 233 ? 4.739 -0.501 -2.831 1.00 93.58 233 B 1 ATOM 4615 N N . HIS B 2 234 ? 7.519 1.442 0.780 1.00 98.64 234 B 1 ATOM 4616 C CA . HIS B 2 234 ? 8.913 1.786 0.536 1.00 98.60 234 B 1 ATOM 4617 C C . HIS B 2 234 ? 9.485 0.851 -0.533 1.00 98.59 234 B 1 ATOM 4618 O O . HIS B 2 234 ? 9.536 -0.363 -0.332 1.00 98.31 234 B 1 ATOM 4619 C CB . HIS B 2 234 ? 9.683 1.717 1.863 1.00 98.32 234 B 1 ATOM 4620 C CG . HIS B 2 234 ? 11.136 2.089 1.780 1.00 97.47 234 B 1 ATOM 4621 N ND1 . HIS B 2 234 ? 12.133 1.588 2.603 1.00 90.58 234 B 1 ATOM 4622 C CD2 . HIS B 2 234 ? 11.734 2.971 0.926 1.00 90.24 234 B 1 ATOM 4623 C CE1 . HIS B 2 234 ? 13.294 2.156 2.248 1.00 90.36 234 B 1 ATOM 4624 N NE2 . HIS B 2 234 ? 13.091 3.000 1.229 1.00 91.85 234 B 1 ATOM 4625 N N . LEU B 2 235 ? 9.930 1.421 -1.655 1.00 98.55 235 B 1 ATOM 4626 C CA . LEU B 2 235 ? 10.529 0.704 -2.777 1.00 98.53 235 B 1 ATOM 4627 C C . LEU B 2 235 ? 11.990 1.118 -2.940 1.00 98.41 235 B 1 ATOM 4628 O O . LEU B 2 235 ? 12.292 2.307 -2.985 1.00 97.92 235 B 1 ATOM 4629 C CB . LEU B 2 235 ? 9.735 0.988 -4.058 1.00 98.44 235 B 1 ATOM 4630 C CG . LEU B 2 235 ? 8.288 0.466 -4.044 1.00 97.85 235 B 1 ATOM 4631 C CD1 . LEU B 2 235 ? 7.541 1.015 -5.249 1.00 96.72 235 B 1 ATOM 4632 C CD2 . LEU B 2 235 ? 8.237 -1.061 -4.115 1.00 96.39 235 B 1 ATOM 4633 N N . VAL B 2 236 ? 12.897 0.149 -3.076 1.00 98.21 236 B 1 ATOM 4634 C CA . VAL B 2 236 ? 14.333 0.400 -3.259 1.00 97.96 236 B 1 ATOM 4635 C C . VAL B 2 236 ? 14.773 -0.103 -4.636 1.00 97.96 236 B 1 ATOM 4636 O O . VAL B 2 236 ? 14.954 -1.311 -4.809 1.00 97.54 236 B 1 ATOM 4637 C CB . VAL B 2 236 ? 15.168 -0.220 -2.120 1.00 97.31 236 B 1 ATOM 4638 C CG1 . VAL B 2 236 ? 16.640 0.165 -2.276 1.00 95.45 236 B 1 ATOM 4639 C CG2 . VAL B 2 236 ? 14.695 0.257 -0.743 1.00 95.78 236 B 1 ATOM 4640 N N . PRO B 2 237 ? 14.972 0.788 -5.636 1.00 97.82 237 B 1 ATOM 4641 C CA . PRO B 2 237 ? 15.258 0.392 -7.015 1.00 97.56 237 B 1 ATOM 4642 C C . PRO B 2 237 ? 16.744 0.102 -7.281 1.00 96.81 237 B 1 ATOM 4643 O O . PRO B 2 237 ? 17.248 0.377 -8.365 1.00 95.02 237 B 1 ATOM 4644 C CB . PRO B 2 237 ? 14.693 1.538 -7.859 1.00 97.25 237 B 1 ATOM 4645 C CG . PRO B 2 237 ? 14.987 2.761 -7.002 1.00 96.66 237 B 1 ATOM 4646 C CD . PRO B 2 237 ? 14.754 2.235 -5.576 1.00 97.67 237 B 1 ATOM 4647 N N . MET B 2 238 ? 17.475 -0.452 -6.313 1.00 96.66 238 B 1 ATOM 4648 C CA . MET B 2 238 ? 18.940 -0.586 -6.350 1.00 95.36 238 B 1 ATOM 4649 C C . MET B 2 238 ? 19.469 -1.444 -7.511 1.00 95.29 238 B 1 ATOM 4650 O O . MET B 2 238 ? 20.585 -1.237 -7.976 1.00 92.93 238 B 1 ATOM 4651 C CB . MET B 2 238 ? 19.400 -1.178 -5.017 1.00 92.94 238 B 1 ATOM 4652 C CG . MET B 2 238 ? 20.926 -1.121 -4.832 1.00 83.78 238 B 1 ATOM 4653 S SD . MET B 2 238 ? 21.525 -1.943 -3.326 1.00 77.19 238 B 1 ATOM 4654 C CE . MET B 2 238 ? 20.673 -1.007 -2.047 1.00 67.71 238 B 1 ATOM 4655 N N . ARG B 2 239 ? 18.674 -2.426 -7.975 1.00 95.17 239 B 1 ATOM 4656 C CA . ARG B 2 239 ? 19.043 -3.357 -9.057 1.00 95.00 239 B 1 ATOM 4657 C C . ARG B 2 239 ? 18.224 -3.137 -10.327 1.00 95.51 239 B 1 ATOM 4658 O O . ARG B 2 239 ? 18.089 -4.054 -11.130 1.00 94.12 239 B 1 ATOM 4659 C CB . ARG B 2 239 ? 18.957 -4.807 -8.564 1.00 93.86 239 B 1 ATOM 4660 C CG . ARG B 2 239 ? 19.919 -5.088 -7.399 1.00 88.54 239 B 1 ATOM 4661 C CD . ARG B 2 239 ? 19.891 -6.574 -7.026 1.00 82.84 239 B 1 ATOM 4662 N NE . ARG B 2 239 ? 18.579 -6.961 -6.474 1.00 73.70 239 B 1 ATOM 4663 C CZ . ARG B 2 239 ? 18.021 -8.162 -6.514 1.00 66.19 239 B 1 ATOM 4664 N NH1 . ARG B 2 239 ? 18.625 -9.184 -7.057 1.00 60.17 239 B 1 ATOM 4665 N NH2 . ARG B 2 239 ? 16.845 -8.349 -6.000 1.00 58.32 239 B 1 ATOM 4666 N N . TRP B 2 240 ? 17.655 -1.958 -10.509 1.00 94.71 240 B 1 ATOM 4667 C CA . TRP B 2 240 ? 16.941 -1.622 -11.745 1.00 94.80 240 B 1 ATOM 4668 C C . TRP B 2 240 ? 17.913 -1.533 -12.927 1.00 94.29 240 B 1 ATOM 4669 O O . TRP B 2 240 ? 18.951 -0.888 -12.791 1.00 92.28 240 B 1 ATOM 4670 C CB . TRP B 2 240 ? 16.195 -0.307 -11.553 1.00 94.28 240 B 1 ATOM 4671 C CG . TRP B 2 240 ? 15.309 0.061 -12.701 1.00 94.16 240 B 1 ATOM 4672 C CD1 . TRP B 2 240 ? 15.713 0.567 -13.889 1.00 91.29 240 B 1 ATOM 4673 C CD2 . TRP B 2 240 ? 13.862 -0.107 -12.802 1.00 93.45 240 B 1 ATOM 4674 N NE1 . TRP B 2 240 ? 14.612 0.729 -14.726 1.00 90.38 240 B 1 ATOM 4675 C CE2 . TRP B 2 240 ? 13.461 0.329 -14.093 1.00 92.07 240 B 1 ATOM 4676 C CE3 . TRP B 2 240 ? 12.870 -0.580 -11.923 1.00 91.20 240 B 1 ATOM 4677 C CZ2 . TRP B 2 240 ? 12.109 0.288 -14.507 1.00 91.33 240 B 1 ATOM 4678 C CZ3 . TRP B 2 240 ? 11.526 -0.616 -12.331 1.00 90.04 240 B 1 ATOM 4679 C CH2 . TRP B 2 240 ? 11.153 -0.186 -13.617 1.00 90.41 240 B 1 ATOM 4680 N N . PRO B 2 241 ? 17.603 -2.105 -14.111 1.00 94.03 241 B 1 ATOM 4681 C CA . PRO B 2 241 ? 16.387 -2.847 -14.476 1.00 93.99 241 B 1 ATOM 4682 C C . PRO B 2 241 ? 16.476 -4.364 -14.265 1.00 94.67 241 B 1 ATOM 4683 O O . PRO B 2 241 ? 15.527 -5.072 -14.568 1.00 93.42 241 B 1 ATOM 4684 C CB . PRO B 2 241 ? 16.188 -2.513 -15.958 1.00 92.46 241 B 1 ATOM 4685 C CG . PRO B 2 241 ? 17.628 -2.463 -16.477 1.00 90.51 241 B 1 ATOM 4686 C CD . PRO B 2 241 ? 18.389 -1.842 -15.311 1.00 92.27 241 B 1 ATOM 4687 N N . ASP B 2 242 ? 17.602 -4.876 -13.748 1.00 94.44 242 B 1 ATOM 4688 C CA . ASP B 2 242 ? 17.869 -6.322 -13.654 1.00 94.49 242 B 1 ATOM 4689 C C . ASP B 2 242 ? 16.939 -7.057 -12.673 1.00 94.80 242 B 1 ATOM 4690 O O . ASP B 2 242 ? 16.768 -8.273 -12.741 1.00 93.52 242 B 1 ATOM 4691 C CB . ASP B 2 242 ? 19.325 -6.558 -13.222 1.00 93.67 242 B 1 ATOM 4692 C CG . ASP B 2 242 ? 20.368 -5.967 -14.167 1.00 89.53 242 B 1 ATOM 4693 O OD1 . ASP B 2 242 ? 20.089 -5.879 -15.382 1.00 85.83 242 B 1 ATOM 4694 O OD2 . ASP B 2 242 ? 21.450 -5.609 -13.658 1.00 84.57 242 B 1 ATOM 4695 N N . ALA B 2 243 ? 16.347 -6.328 -11.741 1.00 94.74 243 B 1 ATOM 4696 C CA . ALA B 2 243 ? 15.312 -6.811 -10.846 1.00 95.01 243 B 1 ATOM 4697 C C . ALA B 2 243 ? 14.314 -5.691 -10.526 1.00 96.05 243 B 1 ATOM 4698 O O . ALA B 2 243 ? 14.666 -4.509 -10.517 1.00 95.56 243 B 1 ATOM 4699 C CB . ALA B 2 243 ? 15.962 -7.365 -9.575 1.00 93.51 243 B 1 ATOM 4700 N N . ALA B 2 244 ? 13.080 -6.086 -10.197 1.00 95.44 244 B 1 ATOM 4701 C CA . ALA B 2 244 ? 12.108 -5.170 -9.622 1.00 96.01 244 B 1 ATOM 4702 C C . ALA B 2 244 ? 12.659 -4.548 -8.320 1.00 96.70 244 B 1 ATOM 4703 O O . ALA B 2 244 ? 13.438 -5.192 -7.606 1.00 96.30 244 B 1 ATOM 4704 C CB . ALA B 2 244 ? 10.792 -5.921 -9.375 1.00 95.31 244 B 1 ATOM 4705 N N . PRO B 2 245 ? 12.259 -3.310 -7.982 1.00 97.00 245 B 1 ATOM 4706 C CA . PRO B 2 245 ? 12.558 -2.716 -6.687 1.00 97.33 245 B 1 ATOM 4707 C C . PRO B 2 245 ? 12.150 -3.639 -5.537 1.00 97.47 245 B 1 ATOM 4708 O O . PRO B 2 245 ? 11.106 -4.286 -5.589 1.00 96.99 245 B 1 ATOM 4709 C CB . PRO B 2 245 ? 11.790 -1.397 -6.655 1.00 97.05 245 B 1 ATOM 4710 C CG . PRO B 2 245 ? 11.702 -1.021 -8.130 1.00 96.23 245 B 1 ATOM 4711 C CD . PRO B 2 245 ? 11.541 -2.371 -8.815 1.00 97.08 245 B 1 ATOM 4712 N N . GLN B 2 246 ? 12.981 -3.677 -4.491 1.00 97.23 246 B 1 ATOM 4713 C CA . GLN B 2 246 ? 12.598 -4.359 -3.260 1.00 97.13 246 B 1 ATOM 4714 C C . GLN B 2 246 ? 11.438 -3.601 -2.622 1.00 97.79 246 B 1 ATOM 4715 O O . GLN B 2 246 ? 11.538 -2.396 -2.404 1.00 97.52 246 B 1 ATOM 4716 C CB . GLN B 2 246 ? 13.783 -4.455 -2.295 1.00 95.77 246 B 1 ATOM 4717 C CG . GLN B 2 246 ? 14.838 -5.449 -2.790 1.00 85.49 246 B 1 ATOM 4718 C CD . GLN B 2 246 ? 16.001 -5.608 -1.812 1.00 80.02 246 B 1 ATOM 4719 O OE1 . GLN B 2 246 ? 16.416 -4.700 -1.123 1.00 72.60 246 B 1 ATOM 4720 N NE2 . GLN B 2 246 ? 16.582 -6.781 -1.720 1.00 68.71 246 B 1 ATOM 4721 N N . GLU B 2 247 ? 10.367 -4.319 -2.311 1.00 97.66 247 B 1 ATOM 4722 C CA . GLU B 2 247 ? 9.190 -3.761 -1.662 1.00 97.79 247 B 1 ATOM 4723 C C . GLU B 2 247 ? 9.246 -3.971 -0.148 1.00 97.92 247 B 1 ATOM 4724 O O . GLU B 2 247 ? 9.719 -4.991 0.361 1.00 97.20 247 B 1 ATOM 4725 C CB . GLU B 2 247 ? 7.906 -4.339 -2.287 1.00 96.50 247 B 1 ATOM 4726 C CG . GLU B 2 247 ? 7.692 -5.834 -2.016 1.00 92.46 247 B 1 ATOM 4727 C CD . GLU B 2 247 ? 6.527 -6.455 -2.792 1.00 93.84 247 B 1 ATOM 4728 O OE1 . GLU B 2 247 ? 5.962 -7.460 -2.304 1.00 88.78 247 B 1 ATOM 4729 O OE2 . GLU B 2 247 ? 6.235 -5.991 -3.911 1.00 91.25 247 B 1 ATOM 4730 N N . ASN B 2 248 ? 8.735 -2.977 0.584 1.00 98.19 248 B 1 ATOM 4731 C CA . ASN B 2 248 ? 8.508 -3.084 2.013 1.00 98.08 248 B 1 ATOM 4732 C C . ASN B 2 248 ? 7.390 -2.123 2.422 1.00 98.34 248 B 1 ATOM 4733 O O . ASN B 2 248 ? 7.560 -0.905 2.336 1.00 97.86 248 B 1 ATOM 4734 C CB . ASN B 2 248 ? 9.825 -2.795 2.747 1.00 97.07 248 B 1 ATOM 4735 C CG . ASN B 2 248 ? 9.658 -2.963 4.232 1.00 89.63 248 B 1 ATOM 4736 O OD1 . ASN B 2 248 ? 9.081 -3.924 4.717 1.00 80.05 248 B 1 ATOM 4737 N ND2 . ASN B 2 248 ? 10.175 -2.041 5.004 1.00 76.28 248 B 1 ATOM 4738 N N . GLN B 2 249 ? 6.254 -2.653 2.885 1.00 97.79 249 B 1 ATOM 4739 C CA . GLN B 2 249 ? 5.208 -1.819 3.462 1.00 97.86 249 B 1 ATOM 4740 C C . GLN B 2 249 ? 5.627 -1.413 4.872 1.00 98.01 249 B 1 ATOM 4741 O O . GLN B 2 249 ? 5.734 -2.247 5.772 1.00 97.79 249 B 1 ATOM 4742 C CB . GLN B 2 249 ? 3.853 -2.532 3.422 1.00 97.59 249 B 1 ATOM 4743 C CG . GLN B 2 249 ? 2.716 -1.570 3.780 1.00 96.29 249 B 1 ATOM 4744 C CD . GLN B 2 249 ? 1.370 -2.287 3.824 1.00 95.49 249 B 1 ATOM 4745 O OE1 . GLN B 2 249 ? 1.019 -2.901 4.812 1.00 89.66 249 B 1 ATOM 4746 N NE2 . GLN B 2 249 ? 0.591 -2.237 2.768 1.00 87.92 249 B 1 ATOM 4747 N N . MET B 2 250 ? 5.861 -0.120 5.049 1.00 98.30 250 B 1 ATOM 4748 C CA . MET B 2 250 ? 6.185 0.522 6.320 1.00 98.31 250 B 1 ATOM 4749 C C . MET B 2 250 ? 4.974 1.269 6.881 1.00 98.39 250 B 1 ATOM 4750 O O . MET B 2 250 ? 3.930 1.372 6.235 1.00 98.12 250 B 1 ATOM 4751 C CB . MET B 2 250 ? 7.408 1.444 6.137 1.00 97.80 250 B 1 ATOM 4752 C CG . MET B 2 250 ? 7.144 2.643 5.211 1.00 95.58 250 B 1 ATOM 4753 S SD . MET B 2 250 ? 8.491 3.871 5.168 1.00 93.61 250 B 1 ATOM 4754 C CE . MET B 2 250 ? 8.329 4.567 6.816 1.00 86.21 250 B 1 ATOM 4755 N N . TRP B 2 251 ? 5.132 1.837 8.077 1.00 98.22 251 B 1 ATOM 4756 C CA . TRP B 2 251 ? 4.216 2.836 8.611 1.00 98.23 251 B 1 ATOM 4757 C C . TRP B 2 251 ? 4.878 4.209 8.701 1.00 98.28 251 B 1 ATOM 4758 O O . TRP B 2 251 ? 5.935 4.369 9.308 1.00 98.21 251 B 1 ATOM 4759 C CB . TRP B 2 251 ? 3.652 2.386 9.953 1.00 98.05 251 B 1 ATOM 4760 C CG . TRP B 2 251 ? 2.545 1.376 9.877 1.00 97.96 251 B 1 ATOM 4761 C CD1 . TRP B 2 251 ? 1.569 1.322 8.946 1.00 97.25 251 B 1 ATOM 4762 C CD2 . TRP B 2 251 ? 2.249 0.309 10.825 1.00 97.83 251 B 1 ATOM 4763 N NE1 . TRP B 2 251 ? 0.681 0.294 9.254 1.00 96.96 251 B 1 ATOM 4764 C CE2 . TRP B 2 251 ? 1.056 -0.340 10.401 1.00 97.45 251 B 1 ATOM 4765 C CE3 . TRP B 2 251 ? 2.867 -0.148 12.005 1.00 97.43 251 B 1 ATOM 4766 C CZ2 . TRP B 2 251 ? 0.480 -1.405 11.129 1.00 96.89 251 B 1 ATOM 4767 C CZ3 . TRP B 2 251 ? 2.295 -1.216 12.726 1.00 96.60 251 B 1 ATOM 4768 C CH2 . TRP B 2 251 ? 1.116 -1.829 12.287 1.00 96.33 251 B 1 ATOM 4769 N N . ALA B 2 252 ? 4.206 5.207 8.140 1.00 98.40 252 B 1 ATOM 4770 C CA . ALA B 2 252 ? 4.365 6.596 8.534 1.00 98.30 252 B 1 ATOM 4771 C C . ALA B 2 252 ? 3.458 6.882 9.745 1.00 98.39 252 B 1 ATOM 4772 O O . ALA B 2 252 ? 2.516 6.137 10.015 1.00 98.14 252 B 1 ATOM 4773 C CB . ALA B 2 252 ? 4.057 7.487 7.330 1.00 97.90 252 B 1 ATOM 4774 N N . VAL B 2 253 ? 3.737 7.957 10.483 1.00 98.42 253 B 1 ATOM 4775 C CA . VAL B 2 253 ? 3.038 8.301 11.732 1.00 98.49 253 B 1 ATOM 4776 C C . VAL B 2 253 ? 2.358 9.659 11.590 1.00 98.46 253 B 1 ATOM 4777 O O . VAL B 2 253 ? 2.965 10.617 11.109 1.00 98.32 253 B 1 ATOM 4778 C CB . VAL B 2 253 ? 4.002 8.260 12.933 1.00 98.42 253 B 1 ATOM 4779 C CG1 . VAL B 2 253 ? 3.264 8.450 14.263 1.00 98.07 253 B 1 ATOM 4780 C CG2 . VAL B 2 253 ? 4.762 6.927 13.017 1.00 98.02 253 B 1 ATOM 4781 N N . ALA B 2 254 ? 1.098 9.747 12.022 1.00 98.18 254 B 1 ATOM 4782 C CA . ALA B 2 254 ? 0.343 10.990 12.035 1.00 98.10 254 B 1 ATOM 4783 C C . ALA B 2 254 ? 0.976 12.016 12.995 1.00 98.27 254 B 1 ATOM 4784 O O . ALA B 2 254 ? 1.486 11.642 14.055 1.00 98.08 254 B 1 ATOM 4785 C CB . ALA B 2 254 ? -1.111 10.697 12.417 1.00 97.60 254 B 1 ATOM 4786 N N . PRO B 2 255 ? 0.940 13.313 12.667 1.00 98.44 255 B 1 ATOM 4787 C CA . PRO B 2 255 ? 1.525 14.350 13.509 1.00 98.32 255 B 1 ATOM 4788 C C . PRO B 2 255 ? 0.805 14.448 14.864 1.00 98.32 255 B 1 ATOM 4789 O O . PRO B 2 255 ? -0.429 14.467 14.912 1.00 97.87 255 B 1 ATOM 4790 C CB . PRO B 2 255 ? 1.415 15.640 12.692 1.00 97.74 255 B 1 ATOM 4791 C CG . PRO B 2 255 ? 0.232 15.383 11.756 1.00 96.01 255 B 1 ATOM 4792 C CD . PRO B 2 255 ? 0.349 13.893 11.464 1.00 97.99 255 B 1 ATOM 4793 N N . PRO B 2 256 ? 1.544 14.543 15.987 1.00 98.34 256 B 1 ATOM 4794 C CA . PRO B 2 256 ? 0.942 14.643 17.310 1.00 98.26 256 B 1 ATOM 4795 C C . PRO B 2 256 ? 0.265 16.004 17.517 1.00 97.96 256 B 1 ATOM 4796 O O . PRO B 2 256 ? 0.636 17.020 16.924 1.00 97.17 256 B 1 ATOM 4797 C CB . PRO B 2 256 ? 2.090 14.410 18.294 1.00 98.13 256 B 1 ATOM 4798 C CG . PRO B 2 256 ? 3.296 14.978 17.543 1.00 97.97 256 B 1 ATOM 4799 C CD . PRO B 2 256 ? 2.998 14.603 16.090 1.00 98.32 256 B 1 ATOM 4800 N N . LYS B 2 257 ? -0.705 16.032 18.443 1.00 97.95 257 B 1 ATOM 4801 C CA . LYS B 2 257 ? -1.419 17.269 18.818 1.00 97.41 257 B 1 ATOM 4802 C C . LYS B 2 257 ? -0.633 18.139 19.796 1.00 97.41 257 B 1 ATOM 4803 O O . LYS B 2 257 ? -0.882 19.335 19.895 1.00 95.41 257 B 1 ATOM 4804 C CB . LYS B 2 257 ? -2.795 16.912 19.399 1.00 96.37 257 B 1 ATOM 4805 C CG . LYS B 2 257 ? -3.699 16.221 18.366 1.00 91.02 257 B 1 ATOM 4806 C CD . LYS B 2 257 ? -5.066 15.875 18.971 1.00 80.45 257 B 1 ATOM 4807 C CE . LYS B 2 257 ? -5.899 15.148 17.909 1.00 72.49 257 B 1 ATOM 4808 N NZ . LYS B 2 257 ? -7.207 14.685 18.433 1.00 60.99 257 B 1 ATOM 4809 N N . THR B 2 258 ? 0.288 17.531 20.558 1.00 96.43 258 B 1 ATOM 4810 C CA . THR B 2 258 ? 1.135 18.233 21.539 1.00 96.41 258 B 1 ATOM 4811 C C . THR B 2 258 ? 2.575 17.713 21.477 1.00 97.04 258 B 1 ATOM 4812 O O . THR B 2 258 ? 2.777 16.538 21.152 1.00 96.90 258 B 1 ATOM 4813 C CB . THR B 2 258 ? 0.619 18.082 22.984 1.00 96.09 258 B 1 ATOM 4814 O OG1 . THR B 2 258 ? 0.821 16.779 23.476 1.00 94.09 258 B 1 ATOM 4815 C CG2 . THR B 2 258 ? -0.860 18.421 23.160 1.00 93.04 258 B 1 ATOM 4816 N N . PRO B 2 259 ? 3.582 18.503 21.891 1.00 96.40 259 B 1 ATOM 4817 C CA . PRO B 2 259 ? 4.992 18.086 21.876 1.00 95.77 259 B 1 ATOM 4818 C C . PRO B 2 259 ? 5.324 16.862 22.744 1.00 96.21 259 B 1 ATOM 4819 O O . PRO B 2 259 ? 6.402 16.282 22.619 1.00 95.13 259 B 1 ATOM 4820 C CB . PRO B 2 259 ? 5.777 19.311 22.360 1.00 95.34 259 B 1 ATOM 4821 C CG . PRO B 2 259 ? 4.875 20.489 21.998 1.00 93.48 259 B 1 ATOM 4822 C CD . PRO B 2 259 ? 3.477 19.917 22.215 1.00 95.80 259 B 1 ATOM 4823 N N . THR B 2 260 ? 4.434 16.477 23.657 1.00 96.20 260 B 1 ATOM 4824 C CA . THR B 2 260 ? 4.647 15.375 24.610 1.00 96.27 260 B 1 ATOM 4825 C C . THR B 2 260 ? 3.628 14.243 24.471 1.00 96.98 260 B 1 ATOM 4826 O O . THR B 2 260 ? 3.598 13.357 25.330 1.00 95.97 260 B 1 ATOM 4827 C CB . THR B 2 260 ? 4.681 15.888 26.057 1.00 95.37 260 B 1 ATOM 4828 O OG1 . THR B 2 260 ? 3.448 16.486 26.398 1.00 92.30 260 B 1 ATOM 4829 C CG2 . THR B 2 260 ? 5.788 16.916 26.295 1.00 90.48 260 B 1 ATOM 4830 N N . GLN B 2 261 ? 2.771 14.261 23.439 1.00 97.71 261 B 1 ATOM 4831 C CA . GLN B 2 261 ? 1.846 13.160 23.151 1.00 97.88 261 B 1 ATOM 4832 C C . GLN B 2 261 ? 2.633 11.881 22.859 1.00 98.20 261 B 1 ATOM 4833 O O . GLN B 2 261 ? 2.436 10.871 23.534 1.00 97.80 261 B 1 ATOM 4834 C CB . GLN B 2 261 ? 0.931 13.546 21.980 1.00 97.42 261 B 1 ATOM 4835 C CG . GLN B 2 261 ? -0.035 12.406 21.587 1.00 95.59 261 B 1 ATOM 4836 C CD . GLN B 2 261 ? -0.925 12.790 20.406 1.00 95.56 261 B 1 ATOM 4837 O OE1 . GLN B 2 261 ? -1.429 13.899 20.313 1.00 89.82 261 B 1 ATOM 4838 N NE2 . GLN B 2 261 ? -1.144 11.901 19.471 1.00 87.63 261 B 1 ATOM 4839 N N . HIS B 2 262 ? 3.570 11.957 21.914 1.00 98.39 262 B 1 ATOM 4840 C CA . HIS B 2 262 ? 4.535 10.896 21.661 1.00 98.43 262 B 1 ATOM 4841 C C . HIS B 2 262 ? 5.691 11.010 22.666 1.00 98.37 262 B 1 ATOM 4842 O O . HIS B 2 262 ? 6.246 12.093 22.871 1.00 97.88 262 B 1 ATOM 4843 C CB . HIS B 2 262 ? 5.013 10.976 20.205 1.00 98.34 262 B 1 ATOM 4844 C CG . HIS B 2 262 ? 3.931 10.806 19.171 1.00 98.54 262 B 1 ATOM 4845 N ND1 . HIS B 2 262 ? 4.046 11.123 17.827 1.00 95.92 262 B 1 ATOM 4846 C CD2 . HIS B 2 262 ? 2.668 10.307 19.350 1.00 95.81 262 B 1 ATOM 4847 C CE1 . HIS B 2 262 ? 2.890 10.823 17.230 1.00 96.44 262 B 1 ATOM 4848 N NE2 . HIS B 2 262 ? 2.027 10.329 18.124 1.00 96.83 262 B 1 ATOM 4849 N N . LYS B 2 263 ? 6.039 9.904 23.323 1.00 98.66 263 B 1 ATOM 4850 C CA . LYS B 2 263 ? 7.103 9.863 24.338 1.00 98.62 263 B 1 ATOM 4851 C C . LYS B 2 263 ? 8.427 9.505 23.677 1.00 98.68 263 B 1 ATOM 4852 O O . LYS B 2 263 ? 8.737 8.330 23.515 1.00 98.38 263 B 1 ATOM 4853 C CB . LYS B 2 263 ? 6.730 8.896 25.476 1.00 98.32 263 B 1 ATOM 4854 C CG . LYS B 2 263 ? 5.446 9.270 26.234 1.00 93.28 263 B 1 ATOM 4855 C CD . LYS B 2 263 ? 5.528 10.652 26.880 1.00 82.20 263 B 1 ATOM 4856 C CE . LYS B 2 263 ? 4.245 10.960 27.655 1.00 75.34 263 B 1 ATOM 4857 N NZ . LYS B 2 263 ? 4.231 12.372 28.101 1.00 61.41 263 B 1 ATOM 4858 N N . TRP B 2 264 ? 9.180 10.530 23.292 1.00 98.62 264 B 1 ATOM 4859 C CA . TRP B 2 264 ? 10.454 10.390 22.592 1.00 98.66 264 B 1 ATOM 4860 C C . TRP B 2 264 ? 11.639 10.330 23.555 1.00 98.58 264 B 1 ATOM 4861 O O . TRP B 2 264 ? 11.733 11.126 24.489 1.00 98.34 264 B 1 ATOM 4862 C CB . TRP B 2 264 ? 10.615 11.536 21.601 1.00 98.67 264 B 1 ATOM 4863 C CG . TRP B 2 264 ? 9.762 11.409 20.377 1.00 98.77 264 B 1 ATOM 4864 C CD1 . TRP B 2 264 ? 8.615 12.080 20.135 1.00 98.62 264 B 1 ATOM 4865 C CD2 . TRP B 2 264 ? 9.989 10.544 19.223 1.00 98.78 264 B 1 ATOM 4866 N NE1 . TRP B 2 264 ? 8.111 11.699 18.898 1.00 98.60 264 B 1 ATOM 4867 C CE2 . TRP B 2 264 ? 8.926 10.754 18.308 1.00 98.71 264 B 1 ATOM 4868 C CE3 . TRP B 2 264 ? 10.988 9.609 18.875 1.00 98.75 264 B 1 ATOM 4869 C CZ2 . TRP B 2 264 ? 8.849 10.057 17.081 1.00 98.64 264 B 1 ATOM 4870 C CZ3 . TRP B 2 264 ? 10.910 8.914 17.651 1.00 98.57 264 B 1 ATOM 4871 C CH2 . TRP B 2 264 ? 9.850 9.138 16.771 1.00 98.53 264 B 1 ATOM 4872 N N . HIS B 2 265 ? 12.552 9.419 23.260 1.00 98.69 265 B 1 ATOM 4873 C CA . HIS B 2 265 ? 13.748 9.137 24.043 1.00 98.68 265 B 1 ATOM 4874 C C . HIS B 2 265 ? 14.962 8.968 23.126 1.00 98.66 265 B 1 ATOM 4875 O O . HIS B 2 265 ? 14.849 8.459 22.013 1.00 98.45 265 B 1 ATOM 4876 C CB . HIS B 2 265 ? 13.518 7.862 24.860 1.00 98.59 265 B 1 ATOM 4877 C CG . HIS B 2 265 ? 12.316 7.928 25.758 1.00 98.49 265 B 1 ATOM 4878 N ND1 . HIS B 2 265 ? 12.275 8.484 27.017 1.00 92.52 265 B 1 ATOM 4879 C CD2 . HIS B 2 265 ? 11.036 7.495 25.482 1.00 92.92 265 B 1 ATOM 4880 C CE1 . HIS B 2 265 ? 11.021 8.374 27.486 1.00 93.80 265 B 1 ATOM 4881 N NE2 . HIS B 2 265 ? 10.236 7.782 26.575 1.00 95.31 265 B 1 ATOM 4882 N N . TYR B 2 266 ? 16.141 9.360 23.611 1.00 98.56 266 B 1 ATOM 4883 C CA . TYR B 2 266 ? 17.423 9.031 22.981 1.00 98.41 266 B 1 ATOM 4884 C C . TYR B 2 266 ? 18.509 8.924 24.054 1.00 98.35 266 B 1 ATOM 4885 O O . TYR B 2 266 ? 18.325 9.382 25.175 1.00 98.10 266 B 1 ATOM 4886 C CB . TYR B 2 266 ? 17.784 10.071 21.903 1.00 98.19 266 B 1 ATOM 4887 C CG . TYR B 2 266 ? 18.533 11.294 22.394 1.00 98.11 266 B 1 ATOM 4888 C CD1 . TYR B 2 266 ? 17.904 12.241 23.232 1.00 97.76 266 B 1 ATOM 4889 C CD2 . TYR B 2 266 ? 19.880 11.482 22.029 1.00 97.73 266 B 1 ATOM 4890 C CE1 . TYR B 2 266 ? 18.617 13.352 23.707 1.00 97.20 266 B 1 ATOM 4891 C CE2 . TYR B 2 266 ? 20.602 12.595 22.493 1.00 97.13 266 B 1 ATOM 4892 C CZ . TYR B 2 266 ? 19.969 13.528 23.337 1.00 96.96 266 B 1 ATOM 4893 O OH . TYR B 2 266 ? 20.674 14.605 23.800 1.00 95.87 266 B 1 ATOM 4894 N N . VAL B 2 267 ? 19.656 8.352 23.714 1.00 98.29 267 B 1 ATOM 4895 C CA . VAL B 2 267 ? 20.839 8.328 24.586 1.00 98.16 267 B 1 ATOM 4896 C C . VAL B 2 267 ? 21.962 9.126 23.935 1.00 97.96 267 B 1 ATOM 4897 O O . VAL B 2 267 ? 22.403 8.809 22.827 1.00 97.57 267 B 1 ATOM 4898 C CB . VAL B 2 267 ? 21.230 6.882 24.946 1.00 97.99 267 B 1 ATOM 4899 C CG1 . VAL B 2 267 ? 22.616 6.779 25.575 1.00 97.18 267 B 1 ATOM 4900 C CG2 . VAL B 2 267 ? 20.231 6.321 25.965 1.00 97.07 267 B 1 ATOM 4901 N N . SER B 2 268 ? 22.432 10.167 24.612 1.00 97.58 268 B 1 ATOM 4902 C CA . SER B 2 268 ? 23.505 11.029 24.108 1.00 97.24 268 B 1 ATOM 4903 C C . SER B 2 268 ? 24.856 10.309 24.055 1.00 97.29 268 B 1 ATOM 4904 O O . SER B 2 268 ? 25.189 9.498 24.922 1.00 96.86 268 B 1 ATOM 4905 C CB . SER B 2 268 ? 23.612 12.316 24.936 1.00 96.35 268 B 1 ATOM 4906 O OG . SER B 2 268 ? 23.893 12.029 26.292 1.00 94.46 268 B 1 ATOM 4907 N N . GLY B 2 269 ? 25.654 10.632 23.039 1.00 96.97 269 B 1 ATOM 4908 C CA . GLY B 2 269 ? 27.042 10.175 22.929 1.00 96.83 269 B 1 ATOM 4909 C C . GLY B 2 269 ? 27.230 8.657 22.925 1.00 97.25 269 B 1 ATOM 4910 O O . GLY B 2 269 ? 28.225 8.180 23.464 1.00 96.57 269 B 1 ATOM 4911 N N . MET B 2 270 ? 26.292 7.903 22.337 1.00 97.36 270 B 1 ATOM 4912 C CA . MET B 2 270 ? 26.438 6.453 22.151 1.00 97.76 270 B 1 ATOM 4913 C C . MET B 2 270 ? 27.755 6.119 21.444 1.00 97.79 270 B 1 ATOM 4914 O O . MET B 2 270 ? 28.188 6.841 20.544 1.00 97.61 270 B 1 ATOM 4915 C CB . MET B 2 270 ? 25.266 5.868 21.359 1.00 97.96 270 B 1 ATOM 4916 C CG . MET B 2 270 ? 23.989 5.743 22.191 1.00 97.17 270 B 1 ATOM 4917 S SD . MET B 2 270 ? 22.626 4.915 21.313 1.00 97.39 270 B 1 ATOM 4918 C CE . MET B 2 270 ? 23.274 3.226 21.196 1.00 94.59 270 B 1 ATOM 4919 N N . THR B 2 271 ? 28.372 5.020 21.841 1.00 97.59 271 B 1 ATOM 4920 C CA . THR B 2 271 ? 29.667 4.551 21.330 1.00 97.58 271 B 1 ATOM 4921 C C . THR B 2 271 ? 29.517 3.252 20.541 1.00 98.00 271 B 1 ATOM 4922 O O . THR B 2 271 ? 28.476 2.598 20.581 1.00 97.78 271 B 1 ATOM 4923 C CB . THR B 2 271 ? 30.684 4.356 22.469 1.00 96.68 271 B 1 ATOM 4924 O OG1 . THR B 2 271 ? 30.273 3.324 23.329 1.00 92.99 271 B 1 ATOM 4925 C CG2 . THR B 2 271 ? 30.893 5.619 23.305 1.00 92.19 271 B 1 ATOM 4926 N N . GLU B 2 272 ? 30.578 2.840 19.863 1.00 97.72 272 B 1 ATOM 4927 C CA . GLU B 2 272 ? 30.660 1.575 19.124 1.00 97.68 272 B 1 ATOM 4928 C C . GLU B 2 272 ? 30.489 0.317 20.003 1.00 97.88 272 B 1 ATOM 4929 O O . GLU B 2 272 ? 30.148 -0.753 19.496 1.00 96.91 272 B 1 ATOM 4930 C CB . GLU B 2 272 ? 31.987 1.542 18.343 1.00 96.67 272 B 1 ATOM 4931 C CG . GLU B 2 272 ? 33.283 1.571 19.181 1.00 91.32 272 B 1 ATOM 4932 C CD . GLU B 2 272 ? 33.770 2.965 19.636 1.00 91.60 272 B 1 ATOM 4933 O OE1 . GLU B 2 272 ? 34.943 3.054 20.062 1.00 84.53 272 B 1 ATOM 4934 O OE2 . GLU B 2 272 ? 32.992 3.953 19.585 1.00 86.18 272 B 1 ATOM 4935 N N . ASP B 2 273 ? 30.646 0.452 21.325 1.00 97.72 273 B 1 ATOM 4936 C CA . ASP B 2 273 ? 30.402 -0.602 22.318 1.00 97.52 273 B 1 ATOM 4937 C C . ASP B 2 273 ? 28.942 -0.649 22.817 1.00 97.80 273 B 1 ATOM 4938 O O . ASP B 2 273 ? 28.598 -1.465 23.684 1.00 96.61 273 B 1 ATOM 4939 C CB . ASP B 2 273 ? 31.358 -0.412 23.508 1.00 96.33 273 B 1 ATOM 4940 C CG . ASP B 2 273 ? 32.795 -0.896 23.299 1.00 92.71 273 B 1 ATOM 4941 O OD1 . ASP B 2 273 ? 33.080 -1.697 22.389 1.00 88.79 273 B 1 ATOM 4942 O OD2 . ASP B 2 273 ? 33.628 -0.633 24.201 1.00 87.77 273 B 1 ATOM 4943 N N . GLU B 2 274 ? 28.069 0.230 22.305 1.00 98.10 274 B 1 ATOM 4944 C CA . GLU B 2 274 ? 26.648 0.306 22.645 1.00 98.14 274 B 1 ATOM 4945 C C . GLU B 2 274 ? 25.782 -0.031 21.422 1.00 98.34 274 B 1 ATOM 4946 O O . GLU B 2 274 ? 26.155 0.214 20.277 1.00 97.98 274 B 1 ATOM 4947 C CB . GLU B 2 274 ? 26.303 1.698 23.215 1.00 97.54 274 B 1 ATOM 4948 C CG . GLU B 2 274 ? 26.988 1.978 24.568 1.00 96.38 274 B 1 ATOM 4949 C CD . GLU B 2 274 ? 26.654 3.376 25.126 1.00 96.87 274 B 1 ATOM 4950 O OE1 . GLU B 2 274 ? 26.220 3.484 26.295 1.00 92.58 274 B 1 ATOM 4951 O OE2 . GLU B 2 274 ? 26.834 4.392 24.420 1.00 93.49 274 B 1 ATOM 4952 N N . ALA B 2 275 ? 24.592 -0.569 21.656 1.00 98.29 275 B 1 ATOM 4953 C CA . ALA B 2 275 ? 23.584 -0.740 20.621 1.00 98.37 275 B 1 ATOM 4954 C C . ALA B 2 275 ? 22.189 -0.386 21.145 1.00 98.53 275 B 1 ATOM 4955 O O . ALA B 2 275 ? 21.881 -0.573 22.322 1.00 98.33 275 B 1 ATOM 4956 C CB . ALA B 2 275 ? 23.652 -2.167 20.060 1.00 98.04 275 B 1 ATOM 4957 N N . LEU B 2 276 ? 21.336 0.094 20.243 1.00 98.56 276 B 1 ATOM 4958 C CA . LEU B 2 276 ? 19.914 0.311 20.468 1.00 98.68 276 B 1 ATOM 4959 C C . LEU B 2 276 ? 19.135 -0.772 19.724 1.00 98.75 276 B 1 ATOM 4960 O O . LEU B 2 276 ? 19.215 -0.874 18.502 1.00 98.67 276 B 1 ATOM 4961 C CB . LEU B 2 276 ? 19.562 1.739 20.015 1.00 98.61 276 B 1 ATOM 4962 C CG . LEU B 2 276 ? 18.065 2.073 19.998 1.00 98.28 276 B 1 ATOM 4963 C CD1 . LEU B 2 276 ? 17.411 1.911 21.368 1.00 97.86 276 B 1 ATOM 4964 C CD2 . LEU B 2 276 ? 17.886 3.522 19.543 1.00 97.84 276 B 1 ATOM 4965 N N . LEU B 2 277 ? 18.394 -1.579 20.467 1.00 98.59 277 B 1 ATOM 4966 C CA . LEU B 2 277 ? 17.498 -2.593 19.928 1.00 98.62 277 B 1 ATOM 4967 C C . LEU B 2 277 ? 16.128 -1.954 19.719 1.00 98.70 277 B 1 ATOM 4968 O O . LEU B 2 277 ? 15.549 -1.447 20.679 1.00 98.58 277 B 1 ATOM 4969 C CB . LEU B 2 277 ? 17.412 -3.788 20.891 1.00 98.50 277 B 1 ATOM 4970 C CG . LEU B 2 277 ? 18.757 -4.338 21.399 1.00 97.60 277 B 1 ATOM 4971 C CD1 . LEU B 2 277 ? 18.507 -5.578 22.258 1.00 96.65 277 B 1 ATOM 4972 C CD2 . LEU B 2 277 ? 19.697 -4.719 20.258 1.00 96.44 277 B 1 ATOM 4973 N N . ILE B 2 278 ? 15.602 -1.982 18.499 1.00 98.78 278 B 1 ATOM 4974 C CA . ILE B 2 278 ? 14.330 -1.348 18.137 1.00 98.82 278 B 1 ATOM 4975 C C . ILE B 2 278 ? 13.392 -2.414 17.577 1.00 98.80 278 B 1 ATOM 4976 O O . ILE B 2 278 ? 13.674 -3.009 16.532 1.00 98.62 278 B 1 ATOM 4977 C CB . ILE B 2 278 ? 14.531 -0.196 17.128 1.00 98.75 278 B 1 ATOM 4978 C CG1 . ILE B 2 278 ? 15.687 0.758 17.515 1.00 98.35 278 B 1 ATOM 4979 C CG2 . ILE B 2 278 ? 13.207 0.581 16.999 1.00 98.20 278 B 1 ATOM 4980 C CD1 . ILE B 2 278 ? 15.982 1.833 16.463 1.00 97.75 278 B 1 ATOM 4981 N N . LYS B 2 279 ? 12.266 -2.648 18.242 1.00 98.68 279 B 1 ATOM 4982 C CA . LYS B 2 279 ? 11.267 -3.612 17.787 1.00 98.62 279 B 1 ATOM 4983 C C . LYS B 2 279 ? 10.444 -3.023 16.642 1.00 98.71 279 B 1 ATOM 4984 O O . LYS B 2 279 ? 9.729 -2.043 16.831 1.00 98.40 279 B 1 ATOM 4985 C CB . LYS B 2 279 ? 10.410 -4.060 18.978 1.00 97.97 279 B 1 ATOM 4986 C CG . LYS B 2 279 ? 9.601 -5.328 18.649 1.00 95.37 279 B 1 ATOM 4987 C CD . LYS B 2 279 ? 8.668 -5.738 19.791 1.00 94.51 279 B 1 ATOM 4988 C CE . LYS B 2 279 ? 9.412 -6.213 21.044 1.00 93.39 279 B 1 ATOM 4989 N NZ . LYS B 2 279 ? 8.457 -6.656 22.091 1.00 93.08 279 B 1 ATOM 4990 N N . MET B 2 280 ? 10.523 -3.646 15.465 1.00 98.58 280 B 1 ATOM 4991 C CA . MET B 2 280 ? 9.759 -3.256 14.267 1.00 98.46 280 B 1 ATOM 4992 C C . MET B 2 280 ? 8.465 -4.053 14.110 1.00 98.35 280 B 1 ATOM 4993 O O . MET B 2 280 ? 7.520 -3.591 13.480 1.00 97.58 280 B 1 ATOM 4994 C CB . MET B 2 280 ? 10.641 -3.407 13.025 1.00 98.17 280 B 1 ATOM 4995 C CG . MET B 2 280 ? 11.912 -2.561 13.092 1.00 97.50 280 B 1 ATOM 4996 S SD . MET B 2 280 ? 11.623 -0.800 13.388 1.00 96.73 280 B 1 ATOM 4997 C CE . MET B 2 280 ? 13.318 -0.227 13.511 1.00 93.24 280 B 1 ATOM 4998 N N . PHE B 2 281 ? 8.421 -5.235 14.710 1.00 98.32 281 B 1 ATOM 4999 C CA . PHE B 2 281 ? 7.247 -6.100 14.780 1.00 98.23 281 B 1 ATOM 5000 C C . PHE B 2 281 ? 7.362 -7.045 15.982 1.00 98.27 281 B 1 ATOM 5001 O O . PHE B 2 281 ? 8.461 -7.429 16.369 1.00 98.10 281 B 1 ATOM 5002 C CB . PHE B 2 281 ? 7.133 -6.889 13.465 1.00 98.07 281 B 1 ATOM 5003 C CG . PHE B 2 281 ? 6.015 -7.905 13.441 1.00 98.07 281 B 1 ATOM 5004 C CD1 . PHE B 2 281 ? 6.293 -9.273 13.623 1.00 97.73 281 B 1 ATOM 5005 C CD2 . PHE B 2 281 ? 4.687 -7.486 13.260 1.00 97.76 281 B 1 ATOM 5006 C CE1 . PHE B 2 281 ? 5.249 -10.214 13.616 1.00 97.35 281 B 1 ATOM 5007 C CE2 . PHE B 2 281 ? 3.642 -8.423 13.252 1.00 97.44 281 B 1 ATOM 5008 C CZ . PHE B 2 281 ? 3.921 -9.786 13.430 1.00 97.37 281 B 1 ATOM 5009 N N . ASP B 2 282 ? 6.229 -7.444 16.552 1.00 97.99 282 B 1 ATOM 5010 C CA . ASP B 2 282 ? 6.101 -8.612 17.433 1.00 97.86 282 B 1 ATOM 5011 C C . ASP B 2 282 ? 4.737 -9.258 17.159 1.00 97.68 282 B 1 ATOM 5012 O O . ASP B 2 282 ? 3.738 -8.552 17.000 1.00 97.21 282 B 1 ATOM 5013 C CB . ASP B 2 282 ? 6.270 -8.197 18.911 1.00 97.72 282 B 1 ATOM 5014 C CG . ASP B 2 282 ? 6.538 -9.353 19.887 1.00 97.61 282 B 1 ATOM 5015 O OD1 . ASP B 2 282 ? 5.983 -10.454 19.718 1.00 96.79 282 B 1 ATOM 5016 O OD2 . ASP B 2 282 ? 7.309 -9.148 20.859 1.00 96.35 282 B 1 ATOM 5017 N N . SER B 2 283 ? 4.684 -10.580 17.068 1.00 97.77 283 B 1 ATOM 5018 C CA . SER B 2 283 ? 3.435 -11.308 16.818 1.00 97.48 283 B 1 ATOM 5019 C C . SER B 2 283 ? 2.467 -11.269 18.007 1.00 97.06 283 B 1 ATOM 5020 O O . SER B 2 283 ? 1.264 -11.411 17.805 1.00 96.09 283 B 1 ATOM 5021 C CB . SER B 2 283 ? 3.731 -12.752 16.407 1.00 97.31 283 B 1 ATOM 5022 O OG . SER B 2 283 ? 4.380 -13.460 17.451 1.00 96.99 283 B 1 ATOM 5023 N N . LYS B 2 284 ? 2.969 -11.037 19.223 1.00 96.54 284 B 1 ATOM 5024 C CA . LYS B 2 284 ? 2.151 -10.950 20.440 1.00 95.98 284 B 1 ATOM 5025 C C . LYS B 2 284 ? 1.136 -9.812 20.382 1.00 96.09 284 B 1 ATOM 5026 O O . LYS B 2 284 ? 1.451 -8.701 19.966 1.00 94.89 284 B 1 ATOM 5027 C CB . LYS B 2 284 ? 3.035 -10.786 21.678 1.00 94.60 284 B 1 ATOM 5028 C CG . LYS B 2 284 ? 3.486 -12.137 22.247 1.00 88.75 284 B 1 ATOM 5029 C CD . LYS B 2 284 ? 4.137 -11.896 23.613 1.00 85.12 284 B 1 ATOM 5030 C CE . LYS B 2 284 ? 4.111 -13.159 24.473 1.00 81.09 284 B 1 ATOM 5031 N NZ . LYS B 2 284 ? 4.108 -12.777 25.902 1.00 73.10 284 B 1 ATOM 5032 N N . LYS B 2 285 ? -0.077 -10.096 20.876 1.00 95.96 285 B 1 ATOM 5033 C CA . LYS B 2 285 ? -1.208 -9.160 20.968 1.00 95.21 285 B 1 ATOM 5034 C C . LYS B 2 285 ? -1.694 -8.955 22.415 1.00 95.24 285 B 1 ATOM 5035 O O . LYS B 2 285 ? -2.750 -8.388 22.636 1.00 92.90 285 B 1 ATOM 5036 C CB . LYS B 2 285 ? -2.344 -9.637 20.047 1.00 93.50 285 B 1 ATOM 5037 C CG . LYS B 2 285 ? -1.942 -9.760 18.565 1.00 91.51 285 B 1 ATOM 5038 C CD . LYS B 2 285 ? -3.143 -10.254 17.751 1.00 87.49 285 B 1 ATOM 5039 C CE . LYS B 2 285 ? -2.798 -10.477 16.276 1.00 81.57 285 B 1 ATOM 5040 N NZ . LYS B 2 285 ? -3.975 -10.996 15.540 1.00 73.48 285 B 1 ATOM 5041 N N . ASP B 2 286 ? -0.916 -9.382 23.406 1.00 95.37 286 B 1 ATOM 5042 C CA . ASP B 2 286 ? -1.252 -9.377 24.840 1.00 94.87 286 B 1 ATOM 5043 C C . ASP B 2 286 ? -0.956 -8.042 25.561 1.00 95.40 286 B 1 ATOM 5044 O O . ASP B 2 286 ? -0.957 -7.975 26.789 1.00 92.99 286 B 1 ATOM 5045 C CB . ASP B 2 286 ? -0.536 -10.564 25.519 1.00 93.07 286 B 1 ATOM 5046 C CG . ASP B 2 286 ? 1.002 -10.465 25.523 1.00 92.99 286 B 1 ATOM 5047 O OD1 . ASP B 2 286 ? 1.565 -9.510 24.940 1.00 90.93 286 B 1 ATOM 5048 O OD2 . ASP B 2 286 ? 1.670 -11.376 26.071 1.00 89.82 286 B 1 ATOM 5049 N N . GLY B 2 287 ? -0.691 -6.973 24.807 1.00 95.33 287 B 1 ATOM 5050 C CA . GLY B 2 287 ? -0.246 -5.677 25.337 1.00 95.49 287 B 1 ATOM 5051 C C . GLY B 2 287 ? 1.274 -5.483 25.332 1.00 96.60 287 B 1 ATOM 5052 O O . GLY B 2 287 ? 1.743 -4.370 25.592 1.00 95.39 287 B 1 ATOM 5053 N N . THR B 2 288 ? 2.047 -6.508 24.988 1.00 96.75 288 B 1 ATOM 5054 C CA . THR B 2 288 ? 3.476 -6.374 24.686 1.00 97.08 288 B 1 ATOM 5055 C C . THR B 2 288 ? 3.673 -5.368 23.547 1.00 97.53 288 B 1 ATOM 5056 O O . THR B 2 288 ? 2.944 -5.387 22.553 1.00 96.84 288 B 1 ATOM 5057 C CB . THR B 2 288 ? 4.074 -7.738 24.300 1.00 96.18 288 B 1 ATOM 5058 O OG1 . THR B 2 288 ? 3.981 -8.627 25.389 1.00 90.50 288 B 1 ATOM 5059 C CG2 . THR B 2 288 ? 5.553 -7.679 23.938 1.00 90.03 288 B 1 ATOM 5060 N N . ALA B 2 289 ? 4.682 -4.502 23.661 1.00 97.84 289 B 1 ATOM 5061 C CA . ALA B 2 289 ? 5.017 -3.557 22.600 1.00 98.11 289 B 1 ATOM 5062 C C . ALA B 2 289 ? 5.313 -4.293 21.283 1.00 98.17 289 B 1 ATOM 5063 O O . ALA B 2 289 ? 6.126 -5.218 21.249 1.00 97.79 289 B 1 ATOM 5064 C CB . ALA B 2 289 ? 6.202 -2.703 23.049 1.00 97.99 289 B 1 ATOM 5065 N N . ARG B 2 290 ? 4.669 -3.868 20.189 1.00 98.17 290 B 1 ATOM 5066 C CA . ARG B 2 290 ? 4.760 -4.534 18.876 1.00 98.06 290 B 1 ATOM 5067 C C . ARG B 2 290 ? 5.614 -3.784 17.861 1.00 98.13 290 B 1 ATOM 5068 O O . ARG B 2 290 ? 6.136 -4.406 16.941 1.00 97.56 290 B 1 ATOM 5069 C CB . ARG B 2 290 ? 3.354 -4.785 18.309 1.00 97.55 290 B 1 ATOM 5070 C CG . ARG B 2 290 ? 2.497 -5.679 19.216 1.00 96.81 290 B 1 ATOM 5071 C CD . ARG B 2 290 ? 1.177 -6.063 18.548 1.00 96.02 290 B 1 ATOM 5072 N NE . ARG B 2 290 ? 1.401 -7.019 17.448 1.00 95.59 290 B 1 ATOM 5073 C CZ . ARG B 2 290 ? 0.529 -7.373 16.515 1.00 95.64 290 B 1 ATOM 5074 N NH1 . ARG B 2 290 ? -0.680 -6.884 16.475 1.00 92.71 290 B 1 ATOM 5075 N NH2 . ARG B 2 290 ? 0.863 -8.238 15.608 1.00 92.58 290 B 1 ATOM 5076 N N . ARG B 2 291 ? 5.747 -2.474 18.003 1.00 97.85 291 B 1 ATOM 5077 C CA . ARG B 2 291 ? 6.441 -1.588 17.051 1.00 97.92 291 B 1 ATOM 5078 C C . ARG B 2 291 ? 6.880 -0.296 17.737 1.00 98.32 291 B 1 ATOM 5079 O O . ARG B 2 291 ? 6.247 0.149 18.688 1.00 98.08 291 B 1 ATOM 5080 C CB . ARG B 2 291 ? 5.549 -1.318 15.817 1.00 96.74 291 B 1 ATOM 5081 C CG . ARG B 2 291 ? 4.329 -0.405 16.062 1.00 95.51 291 B 1 ATOM 5082 C CD . ARG B 2 291 ? 3.257 -1.053 16.969 1.00 94.19 291 B 1 ATOM 5083 N NE . ARG B 2 291 ? 2.087 -0.197 17.170 1.00 95.00 291 B 1 ATOM 5084 C CZ . ARG B 2 291 ? 1.899 0.714 18.099 1.00 95.91 291 B 1 ATOM 5085 N NH1 . ARG B 2 291 ? 2.819 1.053 18.955 1.00 90.75 291 B 1 ATOM 5086 N NH2 . ARG B 2 291 ? 0.741 1.300 18.194 1.00 92.20 291 B 1 ATOM 5087 N N . VAL B 2 292 ? 7.942 0.326 17.197 1.00 98.58 292 B 1 ATOM 5088 C CA . VAL B 2 292 ? 8.537 1.567 17.721 1.00 98.66 292 B 1 ATOM 5089 C C . VAL B 2 292 ? 8.689 2.585 16.593 1.00 98.70 292 B 1 ATOM 5090 O O . VAL B 2 292 ? 9.521 2.370 15.706 1.00 98.55 292 B 1 ATOM 5091 C CB . VAL B 2 292 ? 9.899 1.269 18.368 1.00 98.50 292 B 1 ATOM 5092 C CG1 . VAL B 2 292 ? 10.657 2.539 18.757 1.00 97.95 292 B 1 ATOM 5093 C CG2 . VAL B 2 292 ? 9.724 0.433 19.632 1.00 97.87 292 B 1 ATOM 5094 N N . PRO B 2 293 ? 7.950 3.700 16.606 1.00 98.80 293 B 1 ATOM 5095 C CA . PRO B 2 293 ? 8.291 4.844 15.774 1.00 98.80 293 B 1 ATOM 5096 C C . PRO B 2 293 ? 9.668 5.396 16.143 1.00 98.80 293 B 1 ATOM 5097 O O . PRO B 2 293 ? 10.003 5.511 17.322 1.00 98.68 293 B 1 ATOM 5098 C CB . PRO B 2 293 ? 7.185 5.873 15.986 1.00 98.68 293 B 1 ATOM 5099 C CG . PRO B 2 293 ? 6.016 5.024 16.478 1.00 98.20 293 B 1 ATOM 5100 C CD . PRO B 2 293 ? 6.704 3.936 17.293 1.00 98.70 293 B 1 ATOM 5101 N N . HIS B 2 294 ? 10.457 5.749 15.138 1.00 98.89 294 B 1 ATOM 5102 C CA . HIS B 2 294 ? 11.801 6.281 15.338 1.00 98.89 294 B 1 ATOM 5103 C C . HIS B 2 294 ? 12.187 7.269 14.234 1.00 98.84 294 B 1 ATOM 5104 O O . HIS B 2 294 ? 11.637 7.246 13.135 1.00 98.63 294 B 1 ATOM 5105 C CB . HIS B 2 294 ? 12.809 5.127 15.479 1.00 98.85 294 B 1 ATOM 5106 C CG . HIS B 2 294 ? 12.839 4.177 14.321 1.00 98.86 294 B 1 ATOM 5107 N ND1 . HIS B 2 294 ? 11.872 3.236 14.023 1.00 98.53 294 B 1 ATOM 5108 C CD2 . HIS B 2 294 ? 13.815 4.071 13.366 1.00 98.41 294 B 1 ATOM 5109 C CE1 . HIS B 2 294 ? 12.263 2.588 12.914 1.00 98.35 294 B 1 ATOM 5110 N NE2 . HIS B 2 294 ? 13.439 3.062 12.495 1.00 98.40 294 B 1 ATOM 5111 N N . SER B 2 295 ? 13.129 8.163 14.556 1.00 98.78 295 B 1 ATOM 5112 C CA . SER B 2 295 ? 13.682 9.153 13.628 1.00 98.75 295 B 1 ATOM 5113 C C . SER B 2 295 ? 15.036 9.640 14.124 1.00 98.74 295 B 1 ATOM 5114 O O . SER B 2 295 ? 15.231 9.827 15.325 1.00 98.55 295 B 1 ATOM 5115 C CB . SER B 2 295 ? 12.733 10.348 13.497 1.00 98.61 295 B 1 ATOM 5116 O OG . SER B 2 295 ? 13.226 11.296 12.564 1.00 98.32 295 B 1 ATOM 5117 N N . SER B 2 296 ? 15.963 9.887 13.196 1.00 98.63 296 B 1 ATOM 5118 C CA . SER B 2 296 ? 17.135 10.698 13.522 1.00 98.58 296 B 1 ATOM 5119 C C . SER B 2 296 ? 16.757 12.176 13.586 1.00 98.54 296 B 1 ATOM 5120 O O . SER B 2 296 ? 15.771 12.594 12.976 1.00 98.19 296 B 1 ATOM 5121 C CB . SER B 2 296 ? 18.261 10.467 12.520 1.00 98.28 296 B 1 ATOM 5122 O OG . SER B 2 296 ? 18.675 9.113 12.594 1.00 94.75 296 B 1 ATOM 5123 N N . PHE B 2 297 ? 17.562 12.968 14.289 1.00 98.15 297 B 1 ATOM 5124 C CA . PHE B 2 297 ? 17.335 14.407 14.411 1.00 98.05 297 B 1 ATOM 5125 C C . PHE B 2 297 ? 18.649 15.172 14.580 1.00 97.88 297 B 1 ATOM 5126 O O . PHE B 2 297 ? 19.540 14.704 15.287 1.00 97.57 297 B 1 ATOM 5127 C CB . PHE B 2 297 ? 16.374 14.684 15.576 1.00 98.00 297 B 1 ATOM 5128 C CG . PHE B 2 297 ? 16.898 14.321 16.953 1.00 98.17 297 B 1 ATOM 5129 C CD1 . PHE B 2 297 ? 16.945 12.979 17.378 1.00 97.80 297 B 1 ATOM 5130 C CD2 . PHE B 2 297 ? 17.333 15.329 17.830 1.00 97.78 297 B 1 ATOM 5131 C CE1 . PHE B 2 297 ? 17.416 12.653 18.659 1.00 97.44 297 B 1 ATOM 5132 C CE2 . PHE B 2 297 ? 17.800 15.011 19.116 1.00 97.38 297 B 1 ATOM 5133 C CZ . PHE B 2 297 ? 17.842 13.671 19.531 1.00 97.47 297 B 1 ATOM 5134 N N . PRO B 2 298 ? 18.793 16.358 13.952 1.00 97.48 298 B 1 ATOM 5135 C CA . PRO B 2 298 ? 19.882 17.267 14.266 1.00 96.93 298 B 1 ATOM 5136 C C . PRO B 2 298 ? 19.642 17.918 15.632 1.00 96.98 298 B 1 ATOM 5137 O O . PRO B 2 298 ? 18.500 18.095 16.068 1.00 96.09 298 B 1 ATOM 5138 C CB . PRO B 2 298 ? 19.891 18.284 13.129 1.00 95.60 298 B 1 ATOM 5139 C CG . PRO B 2 298 ? 18.416 18.368 12.741 1.00 93.32 298 B 1 ATOM 5140 C CD . PRO B 2 298 ? 17.900 16.950 12.974 1.00 96.17 298 B 1 ATOM 5141 N N . THR B 2 299 ? 20.725 18.314 16.300 1.00 96.48 299 B 1 ATOM 5142 C CA . THR B 2 299 ? 20.664 19.105 17.535 1.00 96.29 299 B 1 ATOM 5143 C C . THR B 2 299 ? 21.418 20.426 17.365 1.00 96.27 299 B 1 ATOM 5144 O O . THR B 2 299 ? 22.303 20.530 16.515 1.00 95.84 299 B 1 ATOM 5145 C CB . THR B 2 299 ? 21.184 18.339 18.765 1.00 95.64 299 B 1 ATOM 5146 O OG1 . THR B 2 299 ? 22.580 18.416 18.874 1.00 92.54 299 B 1 ATOM 5147 C CG2 . THR B 2 299 ? 20.768 16.871 18.807 1.00 92.39 299 B 1 ATOM 5148 N N . PRO B 2 300 ? 21.133 21.455 18.182 1.00 95.37 300 B 1 ATOM 5149 C CA . PRO B 2 300 ? 21.914 22.696 18.180 1.00 94.81 300 B 1 ATOM 5150 C C . PRO B 2 300 ? 23.380 22.526 18.593 1.00 94.98 300 B 1 ATOM 5151 O O . PRO B 2 300 ? 24.174 23.444 18.392 1.00 93.82 300 B 1 ATOM 5152 C CB . PRO B 2 300 ? 21.196 23.628 19.163 1.00 93.73 300 B 1 ATOM 5153 C CG . PRO B 2 300 ? 19.778 23.073 19.231 1.00 91.61 300 B 1 ATOM 5154 C CD . PRO B 2 300 ? 19.995 21.573 19.066 1.00 94.94 300 B 1 ATOM 5155 N N . ASP B 2 301 ? 23.738 21.396 19.202 1.00 95.64 301 B 1 ATOM 5156 C CA . ASP B 2 301 ? 25.078 21.101 19.716 1.00 95.46 301 B 1 ATOM 5157 C C . ASP B 2 301 ? 25.833 20.081 18.840 1.00 95.65 301 B 1 ATOM 5158 O O . ASP B 2 301 ? 26.884 19.574 19.247 1.00 94.46 301 B 1 ATOM 5159 C CB . ASP B 2 301 ? 24.984 20.627 21.174 1.00 94.75 301 B 1 ATOM 5160 C CG . ASP B 2 301 ? 24.151 21.543 22.078 1.00 94.01 301 B 1 ATOM 5161 O OD1 . ASP B 2 301 ? 24.537 22.689 22.398 1.00 91.35 301 B 1 ATOM 5162 O OD2 . ASP B 2 301 ? 23.084 21.096 22.542 1.00 91.33 301 B 1 ATOM 5163 N N . ASP B 2 302 ? 25.319 19.765 17.645 1.00 96.34 302 B 1 ATOM 5164 C CA . ASP B 2 302 ? 25.954 18.845 16.703 1.00 96.15 302 B 1 ATOM 5165 C C . ASP B 2 302 ? 27.333 19.362 16.265 1.00 95.98 302 B 1 ATOM 5166 O O . ASP B 2 302 ? 27.512 20.540 15.935 1.00 94.90 302 B 1 ATOM 5167 C CB . ASP B 2 302 ? 25.054 18.612 15.476 1.00 95.96 302 B 1 ATOM 5168 C CG . ASP B 2 302 ? 23.881 17.650 15.719 1.00 95.94 302 B 1 ATOM 5169 O OD1 . ASP B 2 302 ? 23.801 17.023 16.800 1.00 94.59 302 B 1 ATOM 5170 O OD2 . ASP B 2 302 ? 23.069 17.484 14.785 1.00 94.48 302 B 1 ATOM 5171 N N . PHE B 2 303 ? 28.328 18.468 16.244 1.00 95.65 303 B 1 ATOM 5172 C CA . PHE B 2 303 ? 29.698 18.779 15.834 1.00 95.55 303 B 1 ATOM 5173 C C . PHE B 2 303 ? 30.430 17.545 15.290 1.00 95.76 303 B 1 ATOM 5174 O O . PHE B 2 303 ? 29.954 16.413 15.400 1.00 95.26 303 B 1 ATOM 5175 C CB . PHE B 2 303 ? 30.470 19.400 17.014 1.00 94.76 303 B 1 ATOM 5176 C CG . PHE B 2 303 ? 30.805 18.442 18.141 1.00 94.17 303 B 1 ATOM 5177 C CD1 . PHE B 2 303 ? 29.887 18.227 19.185 1.00 92.73 303 B 1 ATOM 5178 C CD2 . PHE B 2 303 ? 32.038 17.763 18.158 1.00 92.57 303 B 1 ATOM 5179 C CE1 . PHE B 2 303 ? 30.192 17.341 20.227 1.00 91.33 303 B 1 ATOM 5180 C CE2 . PHE B 2 303 ? 32.351 16.873 19.201 1.00 91.37 303 B 1 ATOM 5181 C CZ . PHE B 2 303 ? 31.425 16.659 20.235 1.00 90.54 303 B 1 ATOM 5182 N N . GLY B 2 304 ? 31.628 17.761 14.759 1.00 95.11 304 B 1 ATOM 5183 C CA . GLY B 2 304 ? 32.534 16.702 14.327 1.00 94.78 304 B 1 ATOM 5184 C C . GLY B 2 304 ? 32.219 16.134 12.950 1.00 95.74 304 B 1 ATOM 5185 O O . GLY B 2 304 ? 31.468 16.713 12.164 1.00 94.76 304 B 1 ATOM 5186 N N . GLU B 2 305 ? 32.820 14.984 12.645 1.00 96.23 305 B 1 ATOM 5187 C CA . GLU B 2 305 ? 32.584 14.286 11.385 1.00 96.37 305 B 1 ATOM 5188 C C . GLU B 2 305 ? 31.135 13.788 11.263 1.00 97.08 305 B 1 ATOM 5189 O O . GLU B 2 305 ? 30.487 13.532 12.279 1.00 96.64 305 B 1 ATOM 5190 C CB . GLU B 2 305 ? 33.523 13.083 11.259 1.00 95.22 305 B 1 ATOM 5191 C CG . GLU B 2 305 ? 34.999 13.445 11.083 1.00 85.85 305 B 1 ATOM 5192 C CD . GLU B 2 305 ? 35.839 12.203 10.750 1.00 82.02 305 B 1 ATOM 5193 O OE1 . GLU B 2 305 ? 37.008 12.384 10.359 1.00 75.76 305 B 1 ATOM 5194 O OE2 . GLU B 2 305 ? 35.305 11.064 10.876 1.00 77.18 305 B 1 ATOM 5195 N N . PRO B 2 306 ? 30.633 13.554 10.031 1.00 97.27 306 B 1 ATOM 5196 C CA . PRO B 2 306 ? 29.324 12.947 9.826 1.00 97.48 306 B 1 ATOM 5197 C C . PRO B 2 306 ? 29.132 11.686 10.674 1.00 97.79 306 B 1 ATOM 5198 O O . PRO B 2 306 ? 30.053 10.875 10.818 1.00 97.45 306 B 1 ATOM 5199 C CB . PRO B 2 306 ? 29.252 12.623 8.334 1.00 96.94 306 B 1 ATOM 5200 C CG . PRO B 2 306 ? 30.175 13.665 7.711 1.00 95.50 306 B 1 ATOM 5201 C CD . PRO B 2 306 ? 31.272 13.822 8.750 1.00 96.98 306 B 1 ATOM 5202 N N . ARG B 2 307 ? 27.918 11.485 11.198 1.00 97.76 307 B 1 ATOM 5203 C CA . ARG B 2 307 ? 27.583 10.270 11.945 1.00 98.09 307 B 1 ATOM 5204 C C . ARG B 2 307 ? 27.888 9.031 11.104 1.00 98.21 307 B 1 ATOM 5205 O O . ARG B 2 307 ? 27.421 8.916 9.973 1.00 97.88 307 B 1 ATOM 5206 C CB . ARG B 2 307 ? 26.105 10.306 12.358 1.00 97.79 307 B 1 ATOM 5207 C CG . ARG B 2 307 ? 25.739 9.161 13.307 1.00 97.25 307 B 1 ATOM 5208 C CD . ARG B 2 307 ? 24.228 9.122 13.569 1.00 96.70 307 B 1 ATOM 5209 N NE . ARG B 2 307 ? 23.516 8.399 12.505 1.00 96.33 307 B 1 ATOM 5210 C CZ . ARG B 2 307 ? 22.201 8.307 12.367 1.00 97.49 307 B 1 ATOM 5211 N NH1 . ARG B 2 307 ? 21.378 8.964 13.130 1.00 93.99 307 B 1 ATOM 5212 N NH2 . ARG B 2 307 ? 21.682 7.530 11.470 1.00 94.89 307 B 1 ATOM 5213 N N . ALA B 2 308 ? 28.600 8.075 11.691 1.00 98.29 308 B 1 ATOM 5214 C CA . ALA B 2 308 ? 28.734 6.738 11.143 1.00 98.30 308 B 1 ATOM 5215 C C . ALA B 2 308 ? 28.012 5.743 12.058 1.00 98.43 308 B 1 ATOM 5216 O O . ALA B 2 308 ? 28.277 5.673 13.258 1.00 98.08 308 B 1 ATOM 5217 C CB . ALA B 2 308 ? 30.212 6.402 10.938 1.00 97.83 308 B 1 ATOM 5218 N N . SER B 2 309 ? 27.076 4.992 11.487 1.00 98.64 309 B 1 ATOM 5219 C CA . SER B 2 309 ? 26.256 4.019 12.206 1.00 98.71 309 B 1 ATOM 5220 C C . SER B 2 309 ? 25.824 2.900 11.270 1.00 98.71 309 B 1 ATOM 5221 O O . SER B 2 309 ? 25.773 3.081 10.054 1.00 98.48 309 B 1 ATOM 5222 C CB . SER B 2 309 ? 25.017 4.698 12.811 1.00 98.60 309 B 1 ATOM 5223 O OG . SER B 2 309 ? 24.194 5.244 11.793 1.00 98.42 309 B 1 ATOM 5224 N N . THR B 2 310 ? 25.438 1.759 11.838 1.00 98.73 310 B 1 ATOM 5225 C CA . THR B 2 310 ? 24.851 0.643 11.104 1.00 98.72 310 B 1 ATOM 5226 C C . THR B 2 310 ? 23.606 0.149 11.823 1.00 98.77 310 B 1 ATOM 5227 O O . THR B 2 310 ? 23.583 0.068 13.052 1.00 98.47 310 B 1 ATOM 5228 C CB . THR B 2 310 ? 25.888 -0.470 10.872 1.00 98.19 310 B 1 ATOM 5229 O OG1 . THR B 2 310 ? 25.342 -1.495 10.088 1.00 89.95 310 B 1 ATOM 5230 C CG2 . THR B 2 310 ? 26.413 -1.108 12.157 1.00 91.33 310 B 1 ATOM 5231 N N . GLU B 2 311 ? 22.570 -0.190 11.067 1.00 98.79 311 B 1 ATOM 5232 C CA . GLU B 2 311 ? 21.452 -0.962 11.580 1.00 98.75 311 B 1 ATOM 5233 C C . GLU B 2 311 ? 21.399 -2.323 10.890 1.00 98.78 311 B 1 ATOM 5234 O O . GLU B 2 311 ? 21.574 -2.441 9.685 1.00 98.48 311 B 1 ATOM 5235 C CB . GLU B 2 311 ? 20.111 -0.211 11.504 1.00 98.37 311 B 1 ATOM 5236 C CG . GLU B 2 311 ? 19.606 0.114 10.096 1.00 96.62 311 B 1 ATOM 5237 C CD . GLU B 2 311 ? 19.991 1.510 9.583 1.00 97.25 311 B 1 ATOM 5238 O OE1 . GLU B 2 311 ? 19.314 1.989 8.651 1.00 93.95 311 B 1 ATOM 5239 O OE2 . GLU B 2 311 ? 20.924 2.155 10.117 1.00 95.44 311 B 1 ATOM 5240 N N . THR B 2 312 ? 21.149 -3.360 11.694 1.00 98.73 312 B 1 ATOM 5241 C CA . THR B 2 312 ? 21.043 -4.745 11.235 1.00 98.75 312 B 1 ATOM 5242 C C . THR B 2 312 ? 19.643 -5.256 11.536 1.00 98.76 312 B 1 ATOM 5243 O O . THR B 2 312 ? 19.263 -5.371 12.701 1.00 98.47 312 B 1 ATOM 5244 C CB . THR B 2 312 ? 22.107 -5.622 11.906 1.00 98.51 312 B 1 ATOM 5245 O OG1 . THR B 2 312 ? 23.386 -5.075 11.697 1.00 96.59 312 B 1 ATOM 5246 C CG2 . THR B 2 312 ? 22.134 -7.033 11.339 1.00 96.68 312 B 1 ATOM 5247 N N . ARG B 2 313 ? 18.870 -5.566 10.489 1.00 98.63 313 B 1 ATOM 5248 C CA . ARG B 2 313 ? 17.503 -6.082 10.616 1.00 98.59 313 B 1 ATOM 5249 C C . ARG B 2 313 ? 17.523 -7.588 10.841 1.00 98.72 313 B 1 ATOM 5250 O O . ARG B 2 313 ? 18.150 -8.322 10.081 1.00 98.55 313 B 1 ATOM 5251 C CB . ARG B 2 313 ? 16.680 -5.676 9.390 1.00 98.03 313 B 1 ATOM 5252 C CG . ARG B 2 313 ? 15.204 -6.073 9.542 1.00 90.76 313 B 1 ATOM 5253 C CD . ARG B 2 313 ? 14.370 -5.640 8.330 1.00 86.39 313 B 1 ATOM 5254 N NE . ARG B 2 313 ? 14.253 -4.181 8.250 1.00 79.43 313 B 1 ATOM 5255 C CZ . ARG B 2 313 ? 13.877 -3.472 7.206 1.00 74.06 313 B 1 ATOM 5256 N NH1 . ARG B 2 313 ? 13.533 -4.028 6.079 1.00 68.23 313 B 1 ATOM 5257 N NH2 . ARG B 2 313 ? 13.836 -2.183 7.288 1.00 66.85 313 B 1 ATOM 5258 N N . CYS B 2 314 ? 16.803 -8.043 11.853 1.00 98.75 314 B 1 ATOM 5259 C CA . CYS B 2 314 ? 16.768 -9.445 12.250 1.00 98.77 314 B 1 ATOM 5260 C C . CYS B 2 314 ? 15.337 -9.946 12.442 1.00 98.81 314 B 1 ATOM 5261 O O . CYS B 2 314 ? 14.542 -9.293 13.119 1.00 98.62 314 B 1 ATOM 5262 C CB . CYS B 2 314 ? 17.555 -9.621 13.551 1.00 98.63 314 B 1 ATOM 5263 S SG . CYS B 2 314 ? 19.268 -9.039 13.368 1.00 98.22 314 B 1 ATOM 5264 N N . PHE B 2 315 ? 15.040 -11.144 11.924 1.00 98.78 315 B 1 ATOM 5265 C CA . PHE B 2 315 ? 13.951 -11.953 12.456 1.00 98.80 315 B 1 ATOM 5266 C C . PHE B 2 315 ? 14.397 -12.602 13.769 1.00 98.80 315 B 1 ATOM 5267 O O . PHE B 2 315 ? 15.505 -13.129 13.861 1.00 98.66 315 B 1 ATOM 5268 C CB . PHE B 2 315 ? 13.525 -13.037 11.466 1.00 98.72 315 B 1 ATOM 5269 C CG . PHE B 2 315 ? 12.935 -12.537 10.175 1.00 98.67 315 B 1 ATOM 5270 C CD1 . PHE B 2 315 ? 11.757 -11.773 10.187 1.00 98.20 315 B 1 ATOM 5271 C CD2 . PHE B 2 315 ? 13.540 -12.873 8.948 1.00 98.13 315 B 1 ATOM 5272 C CE1 . PHE B 2 315 ? 11.190 -11.329 8.980 1.00 97.85 315 B 1 ATOM 5273 C CE2 . PHE B 2 315 ? 12.977 -12.434 7.743 1.00 97.76 315 B 1 ATOM 5274 C CZ . PHE B 2 315 ? 11.802 -11.659 7.759 1.00 98.05 315 B 1 ATOM 5275 N N . VAL B 2 316 ? 13.516 -12.583 14.758 1.00 98.69 316 B 1 ATOM 5276 C CA . VAL B 2 316 ? 13.718 -13.163 16.087 1.00 98.68 316 B 1 ATOM 5277 C C . VAL B 2 316 ? 12.564 -14.125 16.343 1.00 98.66 316 B 1 ATOM 5278 O O . VAL B 2 316 ? 11.410 -13.719 16.247 1.00 98.41 316 B 1 ATOM 5279 C CB . VAL B 2 316 ? 13.772 -12.047 17.146 1.00 98.52 316 B 1 ATOM 5280 C CG1 . VAL B 2 316 ? 14.024 -12.608 18.542 1.00 97.85 316 B 1 ATOM 5281 C CG2 . VAL B 2 316 ? 14.891 -11.037 16.843 1.00 97.82 316 B 1 ATOM 5282 N N . PHE B 2 317 ? 12.858 -15.381 16.636 1.00 98.63 317 B 1 ATOM 5283 C CA . PHE B 2 317 ? 11.862 -16.436 16.802 1.00 98.58 317 B 1 ATOM 5284 C C . PHE B 2 317 ? 11.971 -17.088 18.180 1.00 98.51 317 B 1 ATOM 5285 O O . PHE B 2 317 ? 13.064 -17.448 18.616 1.00 98.21 317 B 1 ATOM 5286 C CB . PHE B 2 317 ? 12.017 -17.493 15.703 1.00 98.44 317 B 1 ATOM 5287 C CG . PHE B 2 317 ? 12.015 -16.953 14.287 1.00 98.52 317 B 1 ATOM 5288 C CD1 . PHE B 2 317 ? 10.804 -16.594 13.672 1.00 98.13 317 B 1 ATOM 5289 C CD2 . PHE B 2 317 ? 13.221 -16.810 13.575 1.00 98.21 317 B 1 ATOM 5290 C CE1 . PHE B 2 317 ? 10.795 -16.110 12.354 1.00 97.99 317 B 1 ATOM 5291 C CE2 . PHE B 2 317 ? 13.217 -16.326 12.254 1.00 97.98 317 B 1 ATOM 5292 C CZ . PHE B 2 317 ? 12.001 -15.977 11.643 1.00 98.15 317 B 1 ATOM 5293 N N . TRP B 2 318 ? 10.820 -17.288 18.821 1.00 98.35 318 B 1 ATOM 5294 C CA . TRP B 2 318 ? 10.665 -18.115 20.015 1.00 98.25 318 B 1 ATOM 5295 C C . TRP B 2 318 ? 9.892 -19.372 19.612 1.00 98.12 318 B 1 ATOM 5296 O O . TRP B 2 318 ? 8.672 -19.427 19.718 1.00 97.47 318 B 1 ATOM 5297 C CB . TRP B 2 318 ? 9.966 -17.329 21.120 1.00 98.07 318 B 1 ATOM 5298 C CG . TRP B 2 318 ? 10.650 -16.082 21.599 1.00 98.13 318 B 1 ATOM 5299 C CD1 . TRP B 2 318 ? 11.421 -15.994 22.705 1.00 97.57 318 B 1 ATOM 5300 C CD2 . TRP B 2 318 ? 10.609 -14.735 21.023 1.00 98.17 318 B 1 ATOM 5301 N NE1 . TRP B 2 318 ? 11.852 -14.680 22.864 1.00 97.56 318 B 1 ATOM 5302 C CE2 . TRP B 2 318 ? 11.377 -13.879 21.856 1.00 97.93 318 B 1 ATOM 5303 C CE3 . TRP B 2 318 ? 9.988 -14.166 19.891 1.00 97.88 318 B 1 ATOM 5304 C CZ2 . TRP B 2 318 ? 11.530 -12.500 21.576 1.00 97.54 318 B 1 ATOM 5305 C CZ3 . TRP B 2 318 ? 10.150 -12.792 19.611 1.00 97.42 318 B 1 ATOM 5306 C CH2 . TRP B 2 318 ? 10.909 -11.974 20.446 1.00 97.34 318 B 1 ATOM 5307 N N . GLU B 2 319 ? 10.615 -20.363 19.097 1.00 97.98 319 B 1 ATOM 5308 C CA . GLU B 2 319 ? 10.034 -21.592 18.525 1.00 97.84 319 B 1 ATOM 5309 C C . GLU B 2 319 ? 9.337 -22.471 19.578 1.00 97.58 319 B 1 ATOM 5310 O O . GLU B 2 319 ? 8.583 -23.376 19.236 1.00 96.30 319 B 1 ATOM 5311 C CB . GLU B 2 319 ? 11.132 -22.394 17.806 1.00 97.57 319 B 1 ATOM 5312 C CG . GLU B 2 319 ? 11.740 -21.643 16.607 1.00 97.06 319 B 1 ATOM 5313 C CD . GLU B 2 319 ? 12.978 -22.356 16.047 1.00 97.24 319 B 1 ATOM 5314 O OE1 . GLU B 2 319 ? 12.860 -23.064 15.020 1.00 93.91 319 B 1 ATOM 5315 O OE2 . GLU B 2 319 ? 14.071 -22.190 16.627 1.00 94.64 319 B 1 ATOM 5316 N N . ASP B 2 320 ? 9.587 -22.181 20.854 1.00 97.57 320 B 1 ATOM 5317 C CA . ASP B 2 320 ? 8.979 -22.781 22.040 1.00 97.13 320 B 1 ATOM 5318 C C . ASP B 2 320 ? 7.676 -22.093 22.491 1.00 97.02 320 B 1 ATOM 5319 O O . ASP B 2 320 ? 7.049 -22.540 23.453 1.00 94.87 320 B 1 ATOM 5320 C CB . ASP B 2 320 ? 10.027 -22.784 23.170 1.00 96.25 320 B 1 ATOM 5321 C CG . ASP B 2 320 ? 10.532 -21.384 23.595 1.00 95.47 320 B 1 ATOM 5322 O OD1 . ASP B 2 320 ? 10.474 -20.427 22.791 1.00 92.73 320 B 1 ATOM 5323 O OD2 . ASP B 2 320 ? 11.048 -21.276 24.731 1.00 92.39 320 B 1 ATOM 5324 N N . GLN B 2 321 ? 7.251 -21.021 21.813 1.00 96.91 321 B 1 ATOM 5325 C CA . GLN B 2 321 ? 5.999 -20.310 22.071 1.00 96.42 321 B 1 ATOM 5326 C C . GLN B 2 321 ? 5.117 -20.347 20.824 1.00 96.26 321 B 1 ATOM 5327 O O . GLN B 2 321 ? 5.567 -20.009 19.732 1.00 94.82 321 B 1 ATOM 5328 C CB . GLN B 2 321 ? 6.273 -18.858 22.496 1.00 95.58 321 B 1 ATOM 5329 C CG . GLN B 2 321 ? 7.103 -18.768 23.785 1.00 93.00 321 B 1 ATOM 5330 C CD . GLN B 2 321 ? 7.512 -17.344 24.148 1.00 91.32 321 B 1 ATOM 5331 O OE1 . GLN B 2 321 ? 6.811 -16.360 23.938 1.00 84.79 321 B 1 ATOM 5332 N NE2 . GLN B 2 321 ? 8.683 -17.186 24.722 1.00 82.97 321 B 1 ATOM 5333 N N . GLU B 2 322 ? 3.841 -20.702 20.977 1.00 94.48 322 B 1 ATOM 5334 C CA . GLU B 2 322 ? 2.871 -20.607 19.888 1.00 93.35 322 B 1 ATOM 5335 C C . GLU B 2 322 ? 2.501 -19.142 19.616 1.00 92.21 322 B 1 ATOM 5336 O O . GLU B 2 322 ? 2.412 -18.320 20.535 1.00 88.09 322 B 1 ATOM 5337 C CB . GLU B 2 322 ? 1.632 -21.469 20.176 1.00 90.65 322 B 1 ATOM 5338 C CG . GLU B 2 322 ? 1.969 -22.970 20.185 1.00 78.22 322 B 1 ATOM 5339 C CD . GLU B 2 322 ? 0.751 -23.888 20.355 1.00 72.43 322 B 1 ATOM 5340 O OE1 . GLU B 2 322 ? 0.931 -25.115 20.171 1.00 66.17 322 B 1 ATOM 5341 O OE2 . GLU B 2 322 ? -0.356 -23.389 20.660 1.00 69.10 322 B 1 ATOM 5342 N N . ALA B 2 323 ? 2.288 -18.799 18.341 1.00 91.70 323 B 1 ATOM 5343 C CA . ALA B 2 323 ? 1.708 -17.517 17.977 1.00 89.35 323 B 1 ATOM 5344 C C . ALA B 2 323 ? 0.232 -17.481 18.378 1.00 87.36 323 B 1 ATOM 5345 O O . ALA B 2 323 ? -0.496 -18.465 18.257 1.00 80.42 323 B 1 ATOM 5346 C CB . ALA B 2 323 ? 1.880 -17.263 16.479 1.00 85.41 323 B 1 ATOM 5347 N N . GLU B 2 324 ? -0.235 -16.301 18.794 1.00 83.24 324 B 1 ATOM 5348 C CA . GLU B 2 324 ? -1.665 -16.046 18.929 1.00 79.48 324 B 1 ATOM 5349 C C . GLU B 2 324 ? -2.355 -16.212 17.571 1.00 76.37 324 B 1 ATOM 5350 O O . GLU B 2 324 ? -1.758 -15.974 16.520 1.00 68.53 324 B 1 ATOM 5351 C CB . GLU B 2 324 ? -1.892 -14.650 19.515 1.00 74.11 324 B 1 ATOM 5352 C CG . GLU B 2 324 ? -1.437 -14.581 20.984 1.00 68.66 324 B 1 ATOM 5353 C CD . GLU B 2 324 ? -1.456 -13.150 21.527 1.00 64.72 324 B 1 ATOM 5354 O OE1 . GLU B 2 324 ? -0.532 -12.820 22.304 1.00 58.75 324 B 1 ATOM 5355 O OE2 . GLU B 2 324 ? -2.351 -12.366 21.142 1.00 63.50 324 B 1 ATOM 5356 N N . ALA B 2 325 ? -3.632 -16.641 17.596 1.00 62.60 325 B 1 ATOM 5357 C CA . ALA B 2 325 ? -4.392 -16.854 16.373 1.00 58.59 325 B 1 ATOM 5358 C C . ALA B 2 325 ? -4.336 -15.598 15.486 1.00 58.19 325 B 1 ATOM 5359 O O . ALA B 2 325 ? -4.655 -14.493 15.923 1.00 54.72 325 B 1 ATOM 5360 C CB . ALA B 2 325 ? -5.827 -17.255 16.729 1.00 51.74 325 B 1 ATOM 5361 N N . LEU B 2 326 ? -3.936 -15.789 14.223 1.00 57.44 326 B 1 ATOM 5362 C CA . LEU B 2 326 ? -4.035 -14.763 13.199 1.00 55.78 326 B 1 ATOM 5363 C C . LEU B 2 326 ? -5.520 -14.466 12.986 1.00 55.46 326 B 1 ATOM 5364 O O . LEU B 2 326 ? -6.221 -15.200 12.296 1.00 51.79 326 B 1 ATOM 5365 C CB . LEU B 2 326 ? -3.357 -15.250 11.903 1.00 51.11 326 B 1 ATOM 5366 C CG . LEU B 2 326 ? -1.817 -15.234 11.956 1.00 47.14 326 B 1 ATOM 5367 C CD1 . LEU B 2 326 ? -1.241 -16.150 10.882 1.00 43.10 326 B 1 ATOM 5368 C CD2 . LEU B 2 326 ? -1.269 -13.823 11.731 1.00 42.16 326 B 1 ATOM 5369 N N . GLU B 2 327 ? -6.007 -13.397 13.611 1.00 50.34 327 B 1 ATOM 5370 C CA . GLU B 2 327 ? -7.301 -12.835 13.259 1.00 49.77 327 B 1 ATOM 5371 C C . GLU B 2 327 ? -7.174 -12.277 11.841 1.00 50.26 327 B 1 ATOM 5372 O O . GLU B 2 327 ? -6.602 -11.213 11.626 1.00 46.79 327 B 1 ATOM 5373 C CB . GLU B 2 327 ? -7.730 -11.764 14.265 1.00 45.31 327 B 1 ATOM 5374 C CG . GLU B 2 327 ? -8.130 -12.365 15.623 1.00 40.20 327 B 1 ATOM 5375 C CD . GLU B 2 327 ? -8.518 -11.302 16.657 1.00 36.00 327 B 1 ATOM 5376 O OE1 . GLU B 2 327 ? -9.168 -11.683 17.655 1.00 32.10 327 B 1 ATOM 5377 O OE2 . GLU B 2 327 ? -8.120 -10.128 16.471 1.00 32.68 327 B 1 ATOM 5378 N N . HIS B 2 328 ? -7.703 -13.026 10.874 1.00 46.15 328 B 1 ATOM 5379 C CA . HIS B 2 328 ? -7.931 -12.550 9.520 1.00 45.57 328 B 1 ATOM 5380 C C . HIS B 2 328 ? -9.099 -11.557 9.526 1.00 45.23 328 B 1 ATOM 5381 O O . HIS B 2 328 ? -10.161 -11.810 8.962 1.00 42.97 328 B 1 ATOM 5382 C CB . HIS B 2 328 ? -8.170 -13.735 8.577 1.00 42.86 328 B 1 ATOM 5383 C CG . HIS B 2 328 ? -6.945 -14.574 8.327 1.00 40.16 328 B 1 ATOM 5384 N ND1 . HIS B 2 328 ? -5.865 -14.214 7.559 1.00 36.89 328 B 1 ATOM 5385 C CD2 . HIS B 2 328 ? -6.702 -15.847 8.780 1.00 35.55 328 B 1 ATOM 5386 C CE1 . HIS B 2 328 ? -5.000 -15.238 7.542 1.00 32.91 328 B 1 ATOM 5387 N NE2 . HIS B 2 328 ? -5.476 -16.256 8.275 1.00 32.54 328 B 1 ATOM 5388 N N . HIS B 2 329 ? -8.925 -10.434 10.213 1.00 42.71 329 B 1 ATOM 5389 C CA . HIS B 2 329 ? -9.807 -9.308 10.029 1.00 42.01 329 B 1 ATOM 5390 C C . HIS B 2 329 ? -9.368 -8.610 8.747 1.00 41.57 329 B 1 ATOM 5391 O O . HIS B 2 329 ? -8.344 -7.942 8.744 1.00 39.27 329 B 1 ATOM 5392 C CB . HIS B 2 329 ? -9.797 -8.409 11.267 1.00 39.23 329 B 1 ATOM 5393 C CG . HIS B 2 329 ? -10.595 -8.985 12.410 1.00 36.80 329 B 1 ATOM 5394 N ND1 . HIS B 2 329 ? -11.926 -9.351 12.365 1.00 33.58 329 B 1 ATOM 5395 C CD2 . HIS B 2 329 ? -10.156 -9.235 13.682 1.00 32.27 329 B 1 ATOM 5396 C CE1 . HIS B 2 329 ? -12.277 -9.813 13.570 1.00 30.05 329 B 1 ATOM 5397 N NE2 . HIS B 2 329 ? -11.225 -9.753 14.401 1.00 29.82 329 B 1 ATOM 5398 N N . HIS B 2 330 ? -10.123 -8.774 7.665 1.00 46.07 330 B 1 ATOM 5399 C CA . HIS B 2 330 ? -10.060 -7.871 6.523 1.00 45.03 330 B 1 ATOM 5400 C C . HIS B 2 330 ? -11.043 -6.733 6.766 1.00 44.12 330 B 1 ATOM 5401 O O . HIS B 2 330 ? -12.210 -6.827 6.400 1.00 41.52 330 B 1 ATOM 5402 C CB . HIS B 2 330 ? -10.338 -8.623 5.219 1.00 42.33 330 B 1 ATOM 5403 C CG . HIS B 2 330 ? -9.178 -9.465 4.781 1.00 39.97 330 B 1 ATOM 5404 N ND1 . HIS B 2 330 ? -7.962 -8.995 4.350 1.00 36.51 330 B 1 ATOM 5405 C CD2 . HIS B 2 330 ? -9.120 -10.838 4.745 1.00 35.33 330 B 1 ATOM 5406 C CE1 . HIS B 2 330 ? -7.185 -10.048 4.070 1.00 34.12 330 B 1 ATOM 5407 N NE2 . HIS B 2 330 ? -7.858 -11.191 4.295 1.00 33.61 330 B 1 ATOM 5408 N N . HIS B 2 331 ? -10.602 -5.670 7.421 1.00 38.84 331 B 1 ATOM 5409 C CA . HIS B 2 331 ? -11.316 -4.406 7.368 1.00 37.61 331 B 1 ATOM 5410 C C . HIS B 2 331 ? -10.718 -3.587 6.219 1.00 36.84 331 B 1 ATOM 5411 O O . HIS B 2 331 ? -9.522 -3.301 6.208 1.00 34.46 331 B 1 ATOM 5412 C CB . HIS B 2 331 ? -11.258 -3.680 8.710 1.00 35.46 331 B 1 ATOM 5413 C CG . HIS B 2 331 ? -11.945 -4.342 9.876 1.00 33.40 331 B 1 ATOM 5414 N ND1 . HIS B 2 331 ? -13.291 -4.293 10.167 1.00 30.65 331 B 1 ATOM 5415 C CD2 . HIS B 2 331 ? -11.336 -4.967 10.934 1.00 29.87 331 B 1 ATOM 5416 C CE1 . HIS B 2 331 ? -13.483 -4.864 11.364 1.00 27.70 331 B 1 ATOM 5417 N NE2 . HIS B 2 331 ? -12.305 -5.282 11.865 1.00 27.31 331 B 1 ATOM 5418 N N . HIS B 2 332 ? -11.547 -3.238 5.252 1.00 41.62 332 B 1 ATOM 5419 C CA . HIS B 2 332 ? -11.132 -2.338 4.179 1.00 39.71 332 B 1 ATOM 5420 C C . HIS B 2 332 ? -11.240 -0.892 4.643 1.00 38.26 332 B 1 ATOM 5421 O O . HIS B 2 332 ? -12.276 -0.485 5.157 1.00 35.11 332 B 1 ATOM 5422 C CB . HIS B 2 332 ? -11.960 -2.600 2.924 1.00 37.00 332 B 1 ATOM 5423 C CG . HIS B 2 332 ? -11.599 -3.937 2.355 1.00 34.79 332 B 1 ATOM 5424 N ND1 . HIS B 2 332 ? -10.384 -4.227 1.765 1.00 31.71 332 B 1 ATOM 5425 C CD2 . HIS B 2 332 ? -12.311 -5.092 2.495 1.00 30.63 332 B 1 ATOM 5426 C CE1 . HIS B 2 332 ? -10.354 -5.537 1.564 1.00 30.16 332 B 1 ATOM 5427 N NE2 . HIS B 2 332 ? -11.504 -6.105 1.995 1.00 29.83 332 B 1 ATOM 5428 N N . HIS B 2 333 ? -10.140 -0.145 4.455 1.00 38.39 333 B 1 ATOM 5429 C CA . HIS B 2 333 ? -10.134 1.316 4.505 1.00 35.44 333 B 1 ATOM 5430 C C . HIS B 2 333 ? -10.239 1.903 3.118 1.00 33.60 333 B 1 ATOM 5431 O O . HIS B 2 333 ? -9.565 1.390 2.200 1.00 30.01 333 B 1 ATOM 5432 C CB . HIS B 2 333 ? -8.902 1.832 5.236 1.00 32.41 333 B 1 ATOM 5433 C CG . HIS B 2 333 ? -9.074 1.582 6.693 1.00 31.31 333 B 1 ATOM 5434 N ND1 . HIS B 2 333 ? -10.187 1.982 7.387 1.00 28.90 333 B 1 ATOM 5435 C CD2 . HIS B 2 333 ? -8.315 0.794 7.495 1.00 27.80 333 B 1 ATOM 5436 C CE1 . HIS B 2 333 ? -10.094 1.418 8.588 1.00 26.86 333 B 1 ATOM 5437 N NE2 . HIS B 2 333 ? -8.973 0.698 8.701 1.00 27.59 333 B 1 ATOM 5438 O OXT . HIS B 2 333 ? -10.991 2.937 3.015 1.00 25.75 333 B 1 HETATM 5439 CU CU . CU C 3 . ? -9.720 -3.096 -15.398 1.00 97.93 1 C 1 HETATM 5440 CU CU . CU D 4 . ? 13.803 2.730 10.629 1.00 97.77 1 D 1 HETATM 5441 C C1 . OGA E 5 . ? -10.579 -2.221 -17.954 1.00 97.58 1 E 1 HETATM 5442 C C2 . OGA E 5 . ? -9.896 -3.550 -18.175 1.00 97.94 1 E 1 HETATM 5443 C C4 . OGA E 5 . ? -9.210 -5.275 -19.764 1.00 97.60 1 E 1 HETATM 5444 C C5 . OGA E 5 . ? -9.415 -5.705 -21.178 1.00 97.98 1 E 1 HETATM 5445 O O1 . OGA E 5 . ? -11.226 -1.711 -18.893 1.00 93.32 1 E 1 HETATM 5446 O O2 . OGA E 5 . ? -10.486 -1.662 -16.840 1.00 93.08 1 E 1 HETATM 5447 O "O2'" . OGA E 5 . ? -9.449 -4.162 -17.224 1.00 97.16 1 E 1 HETATM 5448 O O3 . OGA E 5 . ? -9.955 -4.912 -21.973 1.00 95.01 1 E 1 HETATM 5449 N N1 . OGA E 5 . ? -9.813 -4.013 -19.433 1.00 97.70 1 E 1 HETATM 5450 O O4 . OGA E 5 . ? -9.048 -6.849 -21.522 1.00 93.94 1 E 1 HETATM 5451 C C1 . OGA F 6 . ? 16.443 2.177 11.496 1.00 97.57 1 F 1 HETATM 5452 C C2 . OGA F 6 . ? 16.444 3.624 11.073 1.00 97.91 1 F 1 HETATM 5453 C C4 . OGA F 6 . ? 17.709 5.702 10.815 1.00 97.61 1 F 1 HETATM 5454 C C5 . OGA F 6 . ? 19.008 6.333 11.191 1.00 98.03 1 F 1 HETATM 5455 O O1 . OGA F 6 . ? 17.439 1.735 12.118 1.00 93.41 1 F 1 HETATM 5456 O O2 . OGA F 6 . ? 15.462 1.448 11.235 1.00 92.99 1 F 1 HETATM 5457 O "O2'" . OGA F 6 . ? 15.414 4.130 10.667 1.00 97.12 1 F 1 HETATM 5458 O O3 . OGA F 6 . ? 19.911 5.613 11.645 1.00 95.07 1 F 1 HETATM 5459 N N1 . OGA F 6 . ? 17.596 4.313 11.161 1.00 97.64 1 F 1 HETATM 5460 O O4 . OGA F 6 . ? 19.142 7.564 11.053 1.00 94.34 1 F 1 HETATM 5461 C C13 . JD9 G 7 . ? -2.661 3.567 -15.827 1.00 62.40 1 G 1 HETATM 5462 C C15 . JD9 G 7 . ? -3.706 0.978 -15.570 1.00 81.99 1 G 1 HETATM 5463 C C17 . JD9 G 7 . ? -1.667 -2.009 -19.127 1.00 65.78 1 G 1 HETATM 5464 C C20 . JD9 G 7 . ? -2.316 2.580 -16.773 1.00 74.18 1 G 1 HETATM 5465 C C21 . JD9 G 7 . ? -2.770 1.249 -16.624 1.00 83.08 1 G 1 HETATM 5466 C C22 . JD9 G 7 . ? -5.246 -2.105 -16.896 1.00 78.25 1 G 1 HETATM 5467 C C24 . JD9 G 7 . ? -4.343 -0.301 -15.487 1.00 83.82 1 G 1 HETATM 5468 C C26 . JD9 G 7 . ? -4.796 1.615 -13.466 1.00 68.93 1 G 1 HETATM 5469 C C28 . JD9 G 7 . ? -3.694 -3.203 -18.403 1.00 66.70 1 G 1 HETATM 5470 O O01 . JD9 G 7 . ? -0.326 1.216 -18.162 1.00 65.53 1 G 1 HETATM 5471 O O02 . JD9 G 7 . ? -3.418 -4.206 -19.169 1.00 57.44 1 G 1 HETATM 5472 O O03 . JD9 G 7 . ? -5.696 -4.307 -17.741 1.00 60.13 1 G 1 HETATM 5473 O O04 . JD9 G 7 . ? -1.623 2.946 -17.794 1.00 62.66 1 G 1 HETATM 5474 O O05 . JD9 G 7 . ? -6.011 -0.038 -12.215 1.00 60.19 1 G 1 HETATM 5475 O O06 . JD9 G 7 . ? -5.043 2.463 -12.548 1.00 59.36 1 G 1 HETATM 5476 O O07 . JD9 G 7 . ? -1.366 -3.007 -19.897 1.00 56.88 1 G 1 HETATM 5477 O O08 . JD9 G 7 . ? -3.801 4.156 -13.835 1.00 57.15 1 G 1 HETATM 5478 O O09 . JD9 G 7 . ? -3.597 -3.378 -14.411 1.00 56.51 1 G 1 HETATM 5479 O O10 . JD9 G 7 . ? -6.918 -0.656 -18.728 1.00 52.23 1 G 1 HETATM 5480 C C11 . JD9 G 7 . ? 0.460 1.549 -19.298 1.00 54.89 1 G 1 HETATM 5481 C C12 . JD9 G 7 . ? -3.480 3.258 -14.728 1.00 65.48 1 G 1 HETATM 5482 C C14 . JD9 G 7 . ? -4.507 -3.033 -13.454 1.00 67.07 1 G 1 HETATM 5483 C C16 . JD9 G 7 . ? -5.073 -0.657 -14.305 1.00 78.53 1 G 1 HETATM 5484 C C18 . JD9 G 7 . ? -5.297 0.297 -13.326 1.00 71.85 1 G 1 HETATM 5485 C C19 . JD9 G 7 . ? -6.717 -1.827 -16.654 1.00 66.62 1 G 1 HETATM 5486 C C23 . JD9 G 7 . ? -1.165 0.179 -18.241 1.00 74.25 1 G 1 HETATM 5487 C C25 . JD9 G 7 . ? -5.571 -2.075 -14.016 1.00 72.18 1 G 1 HETATM 5488 C C27 . JD9 G 7 . ? -4.884 -3.228 -17.636 1.00 71.53 1 G 1 HETATM 5489 C C29 . JD9 G 7 . ? -4.241 -1.149 -16.580 1.00 83.65 1 G 1 HETATM 5490 C C30 . JD9 G 7 . ? -3.124 -1.015 -17.454 1.00 81.50 1 G 1 HETATM 5491 C C31 . JD9 G 7 . ? -4.003 1.956 -14.586 1.00 73.80 1 G 1 HETATM 5492 C C32 . JD9 G 7 . ? -0.841 -0.881 -19.065 1.00 65.52 1 G 1 HETATM 5493 C C33 . JD9 G 7 . ? -2.332 0.164 -17.440 1.00 80.80 1 G 1 HETATM 5494 C C34 . JD9 G 7 . ? -7.359 -0.655 -17.447 1.00 61.76 1 G 1 HETATM 5495 C C35 . JD9 G 7 . ? -2.831 -2.076 -18.338 1.00 72.68 1 G 1 HETATM 5496 C C36 . JD9 G 7 . ? -7.067 0.685 -16.755 1.00 51.01 1 G 1 HETATM 5497 C C37 . JD9 G 7 . ? -5.281 -0.567 -11.135 1.00 55.63 1 G 1 HETATM 5498 C C38 . JD9 G 7 . ? -5.171 -4.233 -12.892 1.00 57.99 1 G 1 HETATM 5499 C C39 . JD9 G 7 . ? -5.682 -5.189 -16.695 1.00 56.88 1 G 1 HETATM 5500 C C13 . JD9 H 8 . ? 15.757 -2.534 2.488 1.00 62.31 1 H 1 HETATM 5501 C C15 . JD9 H 8 . ? 14.999 -0.253 3.929 1.00 81.56 1 H 1 HETATM 5502 C C17 . JD9 H 8 . ? 18.037 3.606 2.655 1.00 65.92 1 H 1 HETATM 5503 C C20 . JD9 H 8 . ? 16.524 -1.357 2.383 1.00 73.59 1 H 1 HETATM 5504 C C21 . JD9 H 8 . ? 16.122 -0.171 3.040 1.00 82.41 1 H 1 HETATM 5505 C C22 . JD9 H 8 . ? 15.674 2.705 6.040 1.00 77.08 1 H 1 HETATM 5506 C C24 . JD9 H 8 . ? 14.661 0.859 4.761 1.00 83.31 1 H 1 HETATM 5507 C C26 . JD9 H 8 . ? 13.005 -1.424 4.750 1.00 67.57 1 H 1 HETATM 5508 C C28 . JD9 H 8 . ? 17.018 4.293 4.784 1.00 66.31 1 H 1 HETATM 5509 O O01 . JD9 H 8 . ? 17.743 0.545 0.742 1.00 67.23 1 H 1 HETATM 5510 O O02 . JD9 H 8 . ? 17.593 5.440 4.725 1.00 57.34 1 H 1 HETATM 5511 O O03 . JD9 H 8 . ? 16.088 4.904 6.885 1.00 60.14 1 H 1 HETATM 5512 O O04 . JD9 H 8 . ? 17.620 -1.417 1.709 1.00 63.65 1 H 1 HETATM 5513 O O05 . JD9 H 8 . ? 11.433 -0.248 6.139 1.00 60.57 1 H 1 HETATM 5514 O O06 . JD9 H 8 . ? 12.252 -2.451 4.784 1.00 59.63 1 H 1 HETATM 5515 O O07 . JD9 H 8 . ? 18.621 4.752 2.580 1.00 57.31 1 H 1 HETATM 5516 O O08 . JD9 H 8 . ? 13.868 -3.651 3.370 1.00 57.75 1 H 1 HETATM 5517 O O09 . JD9 H 8 . ? 13.065 3.799 4.482 1.00 57.51 1 H 1 HETATM 5518 O O10 . JD9 H 8 . ? 17.669 1.315 7.580 1.00 54.03 1 H 1 HETATM 5519 C C11 . JD9 H 8 . ? 18.952 0.558 -0.002 1.00 55.87 1 H 1 HETATM 5520 C C12 . JD9 H 8 . ? 14.589 -2.571 3.269 1.00 64.29 1 H 1 HETATM 5521 C C14 . JD9 H 8 . ? 12.144 3.140 5.263 1.00 66.28 1 H 1 HETATM 5522 C C16 . JD9 H 8 . ? 13.409 0.875 5.461 1.00 77.52 1 H 1 HETATM 5523 C C18 . JD9 H 8 . ? 12.613 -0.254 5.455 1.00 70.41 1 H 1 HETATM 5524 C C19 . JD9 H 8 . ? 15.427 2.144 7.437 1.00 66.56 1 H 1 HETATM 5525 C C23 . JD9 H 8 . ? 17.591 1.416 1.746 1.00 73.61 1 H 1 HETATM 5526 C C25 . JD9 H 8 . ? 12.837 2.115 6.177 1.00 71.61 1 H 1 HETATM 5527 C C27 . JD9 H 8 . ? 16.209 3.981 5.912 1.00 71.03 1 H 1 HETATM 5528 C C29 . JD9 H 8 . ? 15.583 1.890 4.878 1.00 83.55 1 H 1 HETATM 5529 C C30 . JD9 H 8 . ? 16.510 2.102 3.813 1.00 81.73 1 H 1 HETATM 5530 C C31 . JD9 H 8 . ? 14.197 -1.423 3.991 1.00 72.73 1 H 1 HETATM 5531 C C32 . JD9 H 8 . ? 18.215 2.641 1.662 1.00 65.63 1 H 1 HETATM 5532 C C33 . JD9 H 8 . ? 16.748 1.094 2.843 1.00 80.48 1 H 1 HETATM 5533 C C34 . JD9 H 8 . ? 16.387 1.024 7.920 1.00 62.56 1 H 1 HETATM 5534 C C35 . JD9 H 8 . ? 17.198 3.335 3.754 1.00 71.96 1 H 1 HETATM 5535 C C36 . JD9 H 8 . ? 15.963 -0.346 7.370 1.00 52.40 1 H 1 HETATM 5536 C C37 . JD9 H 8 . ? 10.298 0.219 5.434 1.00 56.81 1 H 1 HETATM 5537 C C38 . JD9 H 8 . ? 11.372 4.109 6.080 1.00 58.42 1 H 1 HETATM 5538 C C39 . JD9 H 8 . ? 14.890 5.588 6.944 1.00 57.73 1 H 1 #