data_nef_c19522_2mej save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 19520 BMRB 19521 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 2 84 HIS ND1 3 1 ZN ZN 2 147 CYS SG 3 1 ZN ZN stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 HIS middle . . 3 A 3 SER middle . . 4 A 4 MET middle . . 5 A 5 SER middle . . 6 A 6 GLN middle . . 7 A 7 SER middle . . 8 A 8 ASN middle . . 9 A 9 ARG middle . . 10 A 10 GLU middle . . 11 A 11 LEU middle . . 12 A 12 VAL middle . . 13 A 13 VAL middle . . 14 A 14 ASP middle . . 15 A 15 PHE middle . . 16 A 16 LEU middle . . 17 A 17 SER middle . . 18 A 18 TYR middle . . 19 A 19 LYS middle . . 20 A 20 LEU middle . . 21 A 21 SER middle . . 22 A 22 GLN middle . . 23 A 23 LYS middle . . 24 A 24 GLY middle . false 25 A 25 TYR middle . . 26 A 26 SER middle . . 27 A 27 TRP middle . . 28 A 28 SER middle . . 29 A 29 GLN middle . . 30 A 30 PHE middle . . 31 A 31 SER middle . . 32 A 32 ASP middle . . 33 A 33 VAL middle . . 34 A 34 GLU middle . . 35 A 35 GLU middle . . 36 A 36 ASN middle . . 37 A 37 ARG middle . . 38 A 38 THR middle . . 39 A 39 GLU middle . . 40 A 40 ALA middle . . 41 A 41 PRO middle . false 42 A 42 GLU middle . . 43 A 43 GLY middle . false 44 A 44 THR middle . . 45 A 45 GLU middle . . 46 A 46 SER middle . . 47 A 47 GLU middle . . 48 A 48 MET middle . . 49 A 49 GLU middle . . 50 A 50 THR middle . . 51 A 51 PRO middle . false 52 A 52 SER middle . . 53 A 53 ALA middle . . 54 A 54 ILE middle . . 55 A 55 ASN middle . . 56 A 56 GLY middle . false 57 A 57 ASN middle . . 58 A 58 PRO middle . false 59 A 59 SER middle . . 60 A 60 TRP middle . . 61 A 61 HIS middle . . 62 A 62 LEU middle . . 63 A 63 ALA middle . . 64 A 64 ASP middle . . 65 A 65 SER middle . . 66 A 66 PRO middle . false 67 A 67 ALA middle . . 68 A 68 VAL middle . . 69 A 69 ASN middle . . 70 A 70 GLY middle . false 71 A 71 ALA middle . . 72 A 72 THR middle . . 73 A 73 GLY middle . false 74 A 74 HIS middle . . 75 A 75 SER middle . . 76 A 76 SER middle . . 77 A 77 SER middle . . 78 A 78 LEU middle . . 79 A 79 ASP middle . . 80 A 80 ALA middle . . 81 A 81 ARG middle . . 82 A 82 GLU middle . . 83 A 83 VAL middle . . 84 A 84 ILE middle . . 85 A 85 PRO middle . false 86 A 86 MET middle . . 87 A 87 ALA middle . . 88 A 88 ALA middle . . 89 A 89 VAL middle . . 90 A 90 LYS middle . . 91 A 91 GLN middle . . 92 A 92 ALA middle . . 93 A 93 LEU middle . . 94 A 94 ARG middle . . 95 A 95 GLU middle . . 96 A 96 ALA middle . . 97 A 97 GLY middle . false 98 A 98 ASP middle . . 99 A 99 GLU middle . . 100 A 100 PHE middle . . 101 A 101 GLU middle . . 102 A 102 LEU middle . . 103 A 103 ARG middle . . 104 A 104 TYR middle . . 105 A 105 ARG middle . . 106 A 106 ARG middle . . 107 A 107 ALA middle . . 108 A 108 PHE middle . . 109 A 109 SER middle . . 110 A 110 ASP middle . . 111 A 111 LEU middle . . 112 A 112 THR middle . . 113 A 113 SER middle . . 114 A 114 GLN middle . . 115 A 115 LEU middle . . 116 A 116 HIS middle . . 117 A 117 ILE middle . . 118 A 118 THR middle . . 119 A 119 PRO middle . false 120 A 120 GLY middle . false 121 A 121 THR middle . . 122 A 122 ALA middle . . 123 A 123 TYR middle . . 124 A 124 GLN middle . . 125 A 125 SER middle . . 126 A 126 PHE middle . . 127 A 127 GLU middle . . 128 A 128 GLN middle . . 129 A 129 VAL middle . . 130 A 130 VAL middle . . 131 A 131 ASN middle . . 132 A 132 GLU middle . . 133 A 133 LEU middle . . 134 A 134 PHE middle . . 135 A 135 ARG middle . . 136 A 136 ASP middle . . 137 A 137 GLY middle . false 138 A 138 VAL middle . . 139 A 139 ASN middle . . 140 A 140 TRP middle . . 141 A 141 GLY middle . false 142 A 142 ARG middle . . 143 A 143 ILE middle . . 144 A 144 VAL middle . . 145 A 145 ALA middle . . 146 A 146 PHE middle . . 147 A 147 PHE middle . . 148 A 148 SER middle . . 149 A 149 PHE middle . . 150 A 150 GLY middle . false 151 A 151 GLY middle . false 152 A 152 ALA middle . . 153 A 153 LEU middle . . 154 A 154 CYS middle . . 155 A 155 VAL middle . . 156 A 156 GLU middle . . 157 A 157 SER middle . . 158 A 158 VAL middle . . 159 A 159 ASP middle . . 160 A 160 LYS middle . . 161 A 161 GLU middle . . 162 A 162 MET middle . . 163 A 163 GLN middle . . 164 A 164 VAL middle . . 165 A 165 LEU middle . . 166 A 166 VAL middle . . 167 A 167 SER middle . . 168 A 168 ARG middle . . 169 A 169 ILE middle . . 170 A 170 ALA middle . . 171 A 171 ALA middle . . 172 A 172 TRP middle . . 173 A 173 MET middle . . 174 A 174 ALA middle . . 175 A 175 THR middle . . 176 A 176 TYR middle . . 177 A 177 LEU middle . . 178 A 178 ASN middle . . 179 A 179 ASP middle . . 180 A 180 HIS middle . . 181 A 181 LEU middle . . 182 A 182 GLU middle . . 183 A 183 PRO middle . false 184 A 184 TRP middle . . 185 A 185 ILE middle . . 186 A 186 GLN middle . . 187 A 187 GLU middle . . 188 A 188 ASN middle . . 189 A 189 GLY middle . false 190 A 190 GLY middle . false 191 A 191 TRP middle . . 192 A 192 ASP middle . . 193 A 193 THR middle . . 194 A 194 PHE middle . . 195 A 195 VAL middle . . 196 A 196 GLU middle . . 197 A 197 LEU middle . . 198 A 198 TYR middle . . 199 A 199 GLY middle . false 200 A 200 ASN middle . . 201 A 201 ASN middle . . 202 A 202 ALA middle . . 203 A 203 ALA middle . . 204 A 204 ALA middle . . 205 A 205 GLU middle . . 206 A 206 SER middle . . 207 A 207 ARG middle . . 208 A 208 LYS middle . . 209 A 209 GLY middle . false 210 A 210 GLN middle . . 211 A 211 GLU middle . . 212 A 212 ARG end . . 213 B 96 SER start . . 214 B 97 VAL middle . . 215 B 98 PRO middle . false 216 B 99 SER middle . . 217 B 100 GLN middle . . 218 B 101 LYS middle . . 219 B 102 THR middle . . 220 B 103 TYR middle . . 221 B 104 GLN middle . . 222 B 105 GLY middle . false 223 B 106 SER middle . . 224 B 107 TYR middle . . 225 B 108 GLY middle . false 226 B 109 PHE middle . . 227 B 110 ARG middle . . 228 B 111 LEU middle . . 229 B 112 GLY middle . false 230 B 113 PHE middle . . 231 B 114 LEU middle . . 232 B 115 HIS middle . . 233 B 116 SER middle . . 234 B 117 GLY middle . false 235 B 118 THR middle . . 236 B 119 ALA middle . . 237 B 120 LYS middle . . 238 B 121 SER middle . . 239 B 122 VAL middle . . 240 B 123 THR middle . . 241 B 124 CYS middle . . 242 B 125 THR middle . . 243 B 126 TYR middle . . 244 B 127 SER middle . . 245 B 128 PRO middle . false 246 B 129 ALA middle . . 247 B 130 LEU middle . . 248 B 131 ASN middle . . 249 B 132 LYS middle . . 250 B 133 MET middle . . 251 B 134 PHE middle . . 252 B 135 CYS middle . . 253 B 136 GLN middle . . 254 B 137 LEU middle . . 255 B 138 ALA middle . . 256 B 139 LYS middle . . 257 B 140 THR middle . . 258 B 141 CYS middle . . 259 B 142 PRO middle . false 260 B 143 VAL middle . . 261 B 144 GLN middle . . 262 B 145 LEU middle . . 263 B 146 TRP middle . . 264 B 147 VAL middle . . 265 B 148 ASP middle . . 266 B 149 SER middle . . 267 B 150 THR middle . . 268 B 151 PRO middle . false 269 B 152 PRO middle . false 270 B 153 PRO middle . false 271 B 154 GLY middle . false 272 B 155 THR middle . . 273 B 156 ARG middle . . 274 B 157 VAL middle . . 275 B 158 ARG middle . . 276 B 159 ALA middle . . 277 B 160 MET middle . . 278 B 161 ALA middle . . 279 B 162 ILE middle . . 280 B 163 TYR middle . . 281 B 164 LYS middle . . 282 B 165 GLN middle . . 283 B 166 SER middle . . 284 B 167 GLN middle . . 285 B 168 HIS middle . . 286 B 169 MET middle . . 287 B 170 THR middle . . 288 B 171 GLU middle . . 289 B 172 VAL middle . . 290 B 173 VAL middle . . 291 B 174 ARG middle . . 292 B 175 ARG middle . . 293 B 176 CYS middle . . 294 B 177 PRO middle . false 295 B 178 HIS middle . . 296 B 179 HIS middle -HD1 . 297 B 180 GLU middle . . 298 B 181 ARG middle . . 299 B 182 CYS middle . . 300 B 183 SER middle . . 301 B 184 ASP middle . . 302 B 185 SER middle . . 303 B 186 ASP middle . . 304 B 187 GLY middle . false 305 B 188 LEU middle . . 306 B 189 ALA middle . . 307 B 190 PRO middle . false 308 B 191 PRO middle . false 309 B 192 GLN middle . . 310 B 193 HIS middle . . 311 B 194 LEU middle . . 312 B 195 ILE middle . . 313 B 196 ARG middle . . 314 B 197 VAL middle . . 315 B 198 GLU middle . . 316 B 199 GLY middle . false 317 B 200 ASN middle . . 318 B 201 LEU middle . . 319 B 202 ARG middle . . 320 B 203 VAL middle . . 321 B 204 GLU middle . . 322 B 205 TYR middle . . 323 B 206 LEU middle . . 324 B 207 ASP middle . . 325 B 208 ASP middle . . 326 B 209 ARG middle . . 327 B 210 ASN middle . . 328 B 211 THR middle . . 329 B 212 PHE middle . . 330 B 213 ARG middle . . 331 B 214 HIS middle . . 332 B 215 SER middle . . 333 B 216 VAL middle . . 334 B 217 VAL middle . . 335 B 218 VAL middle . . 336 B 219 PRO middle . false 337 B 220 TYR middle . . 338 B 221 GLU middle . . 339 B 222 PRO middle . false 340 B 223 PRO middle . false 341 B 224 GLU middle . . 342 B 225 VAL middle . . 343 B 226 GLY middle . false 344 B 227 SER middle . . 345 B 228 ASP middle . . 346 B 229 CYS middle . . 347 B 230 THR middle . . 348 B 231 THR middle . . 349 B 232 ILE middle . . 350 B 233 HIS middle . . 351 B 234 TYR middle . . 352 B 235 ASN middle . . 353 B 236 TYR middle . . 354 B 237 MET middle . . 355 B 238 CYS middle . . 356 B 239 ASN middle . . 357 B 240 SER middle . . 358 B 241 SER middle . . 359 B 242 CYS middle -HG . 360 B 243 MET middle . . 361 B 244 GLY middle . false 362 B 245 GLY middle . false 363 B 246 MET middle . . 364 B 247 ASN middle . . 365 B 248 ARG middle . . 366 B 249 ARG middle . . 367 B 250 PRO middle . false 368 B 251 ILE middle . . 369 B 252 LEU middle . . 370 B 253 THR middle . . 371 B 254 ILE middle . . 372 B 255 ILE middle . . 373 B 256 THR middle . . 374 B 257 LEU middle . . 375 B 258 GLU middle . . 376 B 259 ASP middle . . 377 B 260 SER middle . . 378 B 261 SER middle . . 379 B 262 GLY middle . false 380 B 263 ASN middle . . 381 B 264 LEU middle . . 382 B 265 LEU middle . . 383 B 266 GLY middle . false 384 B 267 ARG middle . . 385 B 268 ASN middle . . 386 B 269 SER middle . . 387 B 270 PHE middle . . 388 B 271 GLU middle . . 389 B 272 VAL middle . . 390 B 273 ARG middle . . 391 B 274 VAL middle . . 392 B 275 CYS middle . . 393 B 276 ALA middle . . 394 B 277 CYS middle . . 395 B 278 PRO middle . false 396 B 279 GLY middle . false 397 B 280 ARG middle . . 398 B 281 ASP middle . . 399 B 282 ARG middle . . 400 B 283 ARG middle . . 401 B 284 THR middle . . 402 B 285 GLU middle . . 403 B 286 GLU middle . . 404 B 287 GLU middle . . 405 B 288 ASN middle . . 406 B 289 LEU middle . . 407 B 290 ARG middle . . 408 B 291 LYS middle . . 409 B 292 LYS middle . . 410 B 293 GLY middle . false 411 B 294 GLU middle . . 412 B 295 PRO middle . false 413 B 296 HIS middle . . 414 B 297 HIS middle . . 415 B 298 GLU middle . . 416 B 299 LEU middle . . 417 B 300 PRO middle . false 418 B 301 PRO middle . false 419 B 302 GLY middle . false 420 B 303 SER middle . . 421 B 304 THR middle . . 422 B 305 LYS middle . . 423 B 306 ARG middle . . 424 B 307 ALA middle . . 425 B 308 LEU middle . . 426 B 309 PRO middle . false 427 B 310 ASN middle . . 428 B 311 ASN middle . . 429 B 312 THR end . . 430 C 1 ZN . . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 HIS H H 1 7.419 0.020 A 2 HIS CA C 13 56.562 0.3 A 2 HIS CB C 13 38.023 0.3 A 2 HIS N N 15 117.497 0.3 A 4 MET H H 1 8.115 0.020 A 4 MET C C 13 176.438 0.3 A 4 MET CA C 13 55.341 0.3 A 4 MET CB C 13 29.313 0.3 A 4 MET N N 15 119.344 0.3 A 5 SER H H 1 8.224 0.020 A 5 SER C C 13 174.320 0.3 A 5 SER CA C 13 57.898 0.3 A 5 SER CB C 13 62.533 0.3 A 5 SER N N 15 116.171 0.3 A 6 GLN H H 1 8.337 0.020 A 6 GLN C C 13 176.418 0.3 A 6 GLN CA C 13 55.900 0.3 A 6 GLN CB C 13 28.810 0.3 A 6 GLN N N 15 122.369 0.3 A 7 SER H H 1 8.221 0.020 A 7 SER C C 13 175.859 0.3 A 7 SER CA C 13 56.260 0.3 A 7 SER CB C 13 61.916 0.3 A 7 SER N N 15 116.584 0.3 A 8 ASN H H 1 8.375 0.020 A 8 ASN C C 13 177.259 0.3 A 8 ASN CA C 13 53.207 0.3 A 8 ASN CB C 13 36.664 0.3 A 8 ASN N N 15 119.373 0.3 A 9 ARG H H 1 7.815 0.020 A 9 ARG C C 13 176.977 0.3 A 9 ARG CA C 13 58.006 0.3 A 9 ARG CB C 13 31.310 0.3 A 9 ARG N N 15 119.039 0.3 A 10 GLU H H 1 7.949 0.020 A 10 GLU C C 13 179.475 0.3 A 10 GLU CA C 13 55.497 0.3 A 10 GLU CB C 13 28.993 0.3 A 10 GLU N N 15 117.158 0.3 A 11 LEU H H 1 7.807 0.020 A 11 LEU HD1% H 1 0.173 0.020 A 11 LEU HD2% H 1 -0.156 0.020 A 11 LEU C C 13 178.096 0.3 A 11 LEU CA C 13 57.201 0.3 A 11 LEU CB C 13 39.918 0.3 A 11 LEU CD1 C 13 23.055 0.3 A 11 LEU CD2 C 13 23.669 0.3 A 11 LEU N N 15 119.880 0.3 A 12 VAL H H 1 7.690 0.020 A 12 VAL HG1% H 1 1.041 0.020 A 12 VAL HG2% H 1 1.162 0.020 A 12 VAL C C 13 176.377 0.3 A 12 VAL CA C 13 67.088 0.3 A 12 VAL CB C 13 30.968 0.3 A 12 VAL CG1 C 13 23.364 0.3 A 12 VAL CG2 C 13 22.237 0.3 A 12 VAL N N 15 117.702 0.3 A 13 VAL H H 1 8.225 0.020 A 13 VAL HG1% H 1 0.875 0.020 A 13 VAL HG2% H 1 0.854 0.020 A 13 VAL C C 13 178.416 0.3 A 13 VAL CA C 13 65.912 0.3 A 13 VAL CB C 13 28.593 0.3 A 13 VAL CG1 C 13 19.916 0.3 A 13 VAL CG2 C 13 19.998 0.3 A 13 VAL N N 15 116.258 0.3 A 14 ASP H H 1 7.967 0.020 A 14 ASP C C 13 177.040 0.3 A 14 ASP CA C 13 57.978 0.3 A 14 ASP CB C 13 42.258 0.3 A 14 ASP N N 15 120.362 0.3 A 15 PHE H H 1 8.308 0.020 A 15 PHE C C 13 177.876 0.3 A 15 PHE CA C 13 62.475 0.3 A 15 PHE CB C 13 38.582 0.3 A 15 PHE N N 15 119.747 0.3 A 16 LEU H H 1 8.718 0.020 A 16 LEU HD1% H 1 0.868 0.020 A 16 LEU HD2% H 1 0.845 0.020 A 16 LEU C C 13 175.618 0.3 A 16 LEU CA C 13 57.578 0.3 A 16 LEU CB C 13 40.340 0.3 A 16 LEU CD1 C 13 21.357 0.3 A 16 LEU CD2 C 13 24.704 0.3 A 16 LEU N N 15 116.203 0.3 A 17 SER H H 1 8.338 0.020 A 17 SER C C 13 176.980 0.3 A 17 SER CA C 13 62.150 0.3 A 17 SER CB C 13 60.854 0.3 A 17 SER N N 15 113.607 0.3 A 18 TYR H H 1 8.228 0.020 A 18 TYR C C 13 177.996 0.3 A 18 TYR CA C 13 59.279 0.3 A 18 TYR CB C 13 36.345 0.3 A 18 TYR N N 15 124.591 0.3 A 19 LYS H H 1 8.230 0.020 A 19 LYS C C 13 179.841 0.3 A 19 LYS CA C 13 56.083 0.3 A 19 LYS CB C 13 28.650 0.3 A 19 LYS N N 15 119.761 0.3 A 20 LEU H H 1 8.534 0.020 A 20 LEU HD1% H 1 0.756 0.020 A 20 LEU HD2% H 1 0.706 0.020 A 20 LEU C C 13 179.654 0.3 A 20 LEU CA C 13 57.978 0.3 A 20 LEU CB C 13 39.438 0.3 A 20 LEU CD1 C 13 25.656 0.3 A 20 LEU CD2 C 13 25.702 0.3 A 20 LEU N N 15 118.077 0.3 A 21 SER H H 1 8.239 0.020 A 21 SER C C 13 178.204 0.3 A 21 SER CA C 13 60.375 0.3 A 21 SER CB C 13 61.836 0.3 A 21 SER N N 15 117.073 0.3 A 22 GLN H H 1 7.632 0.020 A 22 GLN C C 13 176.997 0.3 A 22 GLN CA C 13 57.578 0.3 A 22 GLN CB C 13 27.132 0.3 A 22 GLN N N 15 122.767 0.3 A 23 LYS H H 1 7.167 0.020 A 23 LYS C C 13 175.419 0.3 A 23 LYS CA C 13 52.943 0.3 A 23 LYS CB C 13 31.048 0.3 A 23 LYS N N 15 116.016 0.3 A 24 GLY H H 1 7.504 0.020 A 24 GLY C C 13 173.680 0.3 A 24 GLY CA C 13 44.313 0.3 A 24 GLY N N 15 105.329 0.3 A 25 TYR H H 1 7.817 0.020 A 25 TYR C C 13 174.779 0.3 A 25 TYR CA C 13 57.761 0.3 A 25 TYR CB C 13 39.301 0.3 A 25 TYR N N 15 119.528 0.3 A 26 SER H H 1 8.475 0.020 A 26 SER C C 13 173.860 0.3 A 26 SER CA C 13 56.083 0.3 A 26 SER CB C 13 63.275 0.3 A 26 SER N N 15 115.815 0.3 A 27 TRP H H 1 8.720 0.020 A 27 TRP HE1 H 1 10.165 0.020 A 27 TRP C C 13 174.141 0.3 A 27 TRP CA C 13 58.400 0.3 A 27 TRP CB C 13 29.210 0.3 A 27 TRP N N 15 126.476 0.3 A 27 TRP NE1 N 15 128.423 0.3 A 28 SER H H 1 8.034 0.020 A 28 SER C C 13 172.859 0.3 A 28 SER CA C 13 66.186 0.3 A 28 SER CB C 13 61.996 0.3 A 28 SER N N 15 114.011 0.3 A 29 GLN H H 1 7.323 0.020 A 29 GLN C C 13 177.250 0.3 A 29 GLN CA C 13 55.170 0.3 A 29 GLN CB C 13 28.339 0.3 A 29 GLN N N 15 120.138 0.3 A 30 PHE H H 1 6.778 0.020 A 30 PHE C C 13 176.814 0.3 A 30 PHE CA C 13 56.163 0.3 A 30 PHE CB C 13 37.840 0.3 A 30 PHE N N 15 113.775 0.3 A 31 SER H H 1 7.530 0.020 A 31 SER C C 13 173.487 0.3 A 31 SER CA C 13 57.841 0.3 A 31 SER CB C 13 63.275 0.3 A 31 SER N N 15 113.941 0.3 A 32 ASP H H 1 8.223 0.020 A 32 ASP C C 13 175.938 0.3 A 32 ASP CA C 13 53.446 0.3 A 32 ASP CB C 13 39.701 0.3 A 32 ASP N N 15 122.131 0.3 A 33 VAL H H 1 7.813 0.020 A 33 VAL HG1% H 1 0.833 0.020 A 33 VAL HG2% H 1 0.844 0.020 A 33 VAL C C 13 176.001 0.3 A 33 VAL CA C 13 61.574 0.3 A 33 VAL CB C 13 31.310 0.3 A 33 VAL CG1 C 13 19.971 0.3 A 33 VAL CG2 C 13 20.651 0.3 A 33 VAL N N 15 118.703 0.3 A 34 GLU H H 1 8.295 0.020 A 34 GLU C C 13 176.340 0.3 A 34 GLU CA C 13 55.523 0.3 A 34 GLU CB C 13 28.993 0.3 A 34 GLU N N 15 123.764 0.3 A 35 GLU H H 1 8.017 0.020 A 35 GLU C C 13 175.838 0.3 A 35 GLU CA C 13 56.163 0.3 A 35 GLU CB C 13 28.913 0.3 A 35 GLU N N 15 121.359 0.3 A 36 ASN H H 1 8.355 0.020 A 36 ASN C C 13 174.719 0.3 A 36 ASN CA C 13 52.704 0.3 A 36 ASN CB C 13 37.680 0.3 A 36 ASN N N 15 119.106 0.3 A 37 ARG H H 1 8.202 0.020 A 37 ARG C C 13 176.158 0.3 A 37 ARG CA C 13 55.261 0.3 A 37 ARG CB C 13 29.290 0.3 A 37 ARG N N 15 121.744 0.3 A 38 THR H H 1 8.165 0.020 A 38 THR C C 13 174.120 0.3 A 38 THR CA C 13 61.254 0.3 A 38 THR CB C 13 68.686 0.3 A 38 THR N N 15 115.798 0.3 A 39 GLU H H 1 8.286 0.020 A 39 GLU C C 13 175.359 0.3 A 39 GLU CA C 13 55.341 0.3 A 39 GLU CB C 13 29.050 0.3 A 39 GLU N N 15 123.018 0.3 A 40 ALA H H 1 8.266 0.020 A 40 ALA CA C 13 49.587 0.3 A 40 ALA CB C 13 16.824 0.3 A 40 ALA N N 15 126.206 0.3 A 42 GLU H H 1 8.449 0.020 A 42 GLU C C 13 176.857 0.3 A 42 GLU CA C 13 56.322 0.3 A 42 GLU CB C 13 29.233 0.3 A 42 GLU N N 15 121.227 0.3 A 43 GLY H H 1 8.404 0.020 A 43 GLY C C 13 174.180 0.3 A 43 GLY CA C 13 44.496 0.3 A 43 GLY N N 15 110.018 0.3 A 44 THR H H 1 7.960 0.020 A 44 THR C C 13 174.599 0.3 A 44 THR CA C 13 61.174 0.3 A 44 THR CB C 13 68.766 0.3 A 44 THR N N 15 113.043 0.3 A 45 GLU H H 1 8.520 0.020 A 45 GLU C C 13 177.119 0.3 A 45 GLU CA C 13 56.915 0.3 A 45 GLU CB C 13 28.571 0.3 A 45 GLU N N 15 122.967 0.3 A 46 SER H H 1 8.044 0.020 A 46 SER C C 13 176.105 0.3 A 46 SER CA C 13 58.240 0.3 A 46 SER CB C 13 62.236 0.3 A 46 SER N N 15 115.037 0.3 A 47 GLU H H 1 8.455 0.020 A 47 GLU C C 13 177.319 0.3 A 47 GLU CA C 13 56.882 0.3 A 47 GLU CB C 13 27.155 0.3 A 47 GLU N N 15 122.848 0.3 A 48 MET H H 1 8.112 0.020 A 48 MET C C 13 176.280 0.3 A 48 MET CA C 13 55.204 0.3 A 48 MET CB C 13 28.993 0.3 A 48 MET N N 15 119.852 0.3 A 49 GLU H H 1 8.313 0.020 A 49 GLU C C 13 175.978 0.3 A 49 GLU CA C 13 55.843 0.3 A 49 GLU CB C 13 28.970 0.3 A 49 GLU N N 15 121.577 0.3 A 50 THR H H 1 8.150 0.020 A 50 THR CA C 13 58.959 0.3 A 50 THR CB C 13 68.606 0.3 A 50 THR N N 15 117.663 0.3 A 52 SER H H 1 8.273 0.020 A 52 SER C C 13 174.200 0.3 A 52 SER CA C 13 57.818 0.3 A 52 SER CB C 13 62.613 0.3 A 52 SER N N 15 115.578 0.3 A 53 ALA H H 1 8.198 0.020 A 53 ALA C C 13 177.676 0.3 A 53 ALA CA C 13 51.665 0.3 A 53 ALA CB C 13 17.783 0.3 A 53 ALA N N 15 125.481 0.3 A 54 ILE H H 1 7.934 0.020 A 54 ILE HD1% H 1 0.808 0.020 A 54 ILE C C 13 174.277 0.3 A 54 ILE CA C 13 61.494 0.3 A 54 ILE CB C 13 37.304 0.3 A 54 ILE CD1 C 13 12.363 0.3 A 54 ILE N N 15 118.586 0.3 A 55 ASN H H 1 8.340 0.020 A 55 ASN C C 13 175.159 0.3 A 55 ASN CA C 13 52.646 0.3 A 55 ASN CB C 13 37.783 0.3 A 55 ASN N N 15 121.388 0.3 A 56 GLY H H 1 8.135 0.020 A 56 GLY C C 13 173.083 0.3 A 56 GLY CA C 13 44.393 0.3 A 56 GLY N N 15 108.575 0.3 A 57 ASN H H 1 8.023 0.020 A 57 ASN CA C 13 58.115 0.3 A 57 ASN CB C 13 37.828 0.3 A 57 ASN N N 15 118.964 0.3 A 59 SER H H 1 8.196 0.020 A 59 SER C C 13 174.182 0.3 A 59 SER CA C 13 58.217 0.3 A 59 SER CB C 13 62.133 0.3 A 59 SER N N 15 114.720 0.3 A 60 TRP H H 1 7.739 0.020 A 60 TRP HE1 H 1 10.044 0.020 A 60 TRP C C 13 177.557 0.3 A 60 TRP CA C 13 56.482 0.3 A 60 TRP CB C 13 28.274 0.3 A 60 TRP N N 15 121.715 0.3 A 60 TRP NE1 N 15 129.191 0.3 A 61 HIS H H 1 7.861 0.020 A 61 HIS C C 13 177.557 0.3 A 61 HIS CA C 13 56.379 0.3 A 61 HIS CB C 13 30.032 0.3 A 61 HIS N N 15 126.423 0.3 A 62 LEU H H 1 7.807 0.020 A 62 LEU HD1% H 1 0.774 0.020 A 62 LEU C C 13 176.717 0.3 A 62 LEU CA C 13 53.982 0.3 A 62 LEU CB C 13 40.477 0.3 A 62 LEU CD1 C 13 23.127 0.3 A 62 LEU N N 15 122.945 0.3 A 63 ALA H H 1 8.086 0.020 A 63 ALA C C 13 179.954 0.3 A 63 ALA CA C 13 51.448 0.3 A 63 ALA CB C 13 17.383 0.3 A 63 ALA N N 15 123.850 0.3 A 64 ASP H H 1 8.100 0.020 A 64 ASP C C 13 175.601 0.3 A 64 ASP CA C 13 53.366 0.3 A 64 ASP CB C 13 39.941 0.3 A 64 ASP N N 15 118.641 0.3 A 65 SER H H 1 7.990 0.020 A 65 SER CA C 13 55.443 0.3 A 65 SER CB C 13 62.396 0.3 A 65 SER N N 15 116.272 0.3 A 67 ALA H H 1 8.169 0.020 A 67 ALA C C 13 175.914 0.3 A 67 ALA CA C 13 51.528 0.3 A 67 ALA CB C 13 17.566 0.3 A 67 ALA N N 15 123.345 0.3 A 68 VAL H H 1 7.909 0.020 A 68 VAL HG1% H 1 0.857 0.020 A 68 VAL CA C 13 61.037 0.3 A 68 VAL CB C 13 31.310 0.3 A 68 VAL CG1 C 13 20.825 0.3 A 68 VAL N N 15 118.753 0.3 A 69 ASN H H 1 8.369 0.020 A 69 ASN C C 13 175.399 0.3 A 69 ASN CA C 13 52.726 0.3 A 69 ASN CB C 13 37.783 0.3 A 69 ASN N N 15 121.462 0.3 A 70 GLY H H 1 8.248 0.020 A 70 GLY C C 13 177.057 0.3 A 70 GLY CA C 13 44.553 0.3 A 70 GLY N N 15 109.223 0.3 A 71 ALA H H 1 8.065 0.020 A 71 ALA C C 13 175.459 0.3 A 71 ALA CA C 13 51.767 0.3 A 71 ALA CB C 13 17.543 0.3 A 71 ALA N N 15 123.297 0.3 A 72 THR H H 1 8.024 0.020 A 72 THR C C 13 174.999 0.3 A 72 THR CA C 13 61.094 0.3 A 72 THR CB C 13 68.766 0.3 A 72 THR N N 15 112.143 0.3 A 73 GLY H H 1 8.227 0.020 A 73 GLY C C 13 177.297 0.3 A 73 GLY CA C 13 44.473 0.3 A 73 GLY N N 15 110.366 0.3 A 74 HIS H H 1 7.853 0.020 A 74 HIS C C 13 177.414 0.3 A 74 HIS CA C 13 58.006 0.3 A 74 HIS CB C 13 27.155 0.3 A 74 HIS N N 15 117.513 0.3 A 75 SER H H 1 8.169 0.020 A 75 SER C C 13 175.832 0.3 A 75 SER CA C 13 60.514 0.3 A 75 SER CB C 13 62.156 0.3 A 75 SER N N 15 116.418 0.3 A 76 SER H H 1 8.253 0.020 A 76 SER C C 13 176.360 0.3 A 76 SER CA C 13 60.398 0.3 A 76 SER CB C 13 61.676 0.3 A 76 SER N N 15 117.428 0.3 A 77 SER H H 1 8.240 0.020 A 77 SER C C 13 174.420 0.3 A 77 SER CA C 13 58.160 0.3 A 77 SER CB C 13 62.156 0.3 A 77 SER N N 15 116.656 0.3 A 78 LEU H H 1 8.125 0.020 A 78 LEU HD1% H 1 0.785 0.020 A 78 LEU C C 13 176.960 0.3 A 78 LEU CA C 13 54.484 0.3 A 78 LEU CB C 13 40.877 0.3 A 78 LEU CD1 C 13 22.937 0.3 A 78 LEU N N 15 123.323 0.3 A 79 ASP H H 1 8.080 0.020 A 79 ASP C C 13 175.698 0.3 A 79 ASP CA C 13 53.685 0.3 A 79 ASP CB C 13 40.260 0.3 A 79 ASP N N 15 120.229 0.3 A 80 ALA H H 1 8.021 0.020 A 80 ALA C C 13 174.240 0.3 A 80 ALA CA C 13 51.745 0.3 A 80 ALA CB C 13 17.783 0.3 A 80 ALA N N 15 124.162 0.3 A 81 ARG H H 1 7.988 0.020 A 81 ARG C C 13 175.961 0.3 A 81 ARG CA C 13 60.398 0.3 A 81 ARG CB C 13 31.390 0.3 A 81 ARG N N 15 119.064 0.3 A 82 GLU H H 1 8.269 0.020 A 82 GLU C C 13 175.858 0.3 A 82 GLU CA C 13 55.843 0.3 A 82 GLU CB C 13 28.993 0.3 A 82 GLU N N 15 121.381 0.3 A 83 VAL H H 1 8.664 0.020 A 83 VAL HG1% H 1 0.831 0.020 A 83 VAL HG2% H 1 0.889 0.020 A 83 VAL C C 13 176.340 0.3 A 83 VAL CA C 13 61.197 0.3 A 83 VAL CB C 13 29.392 0.3 A 83 VAL CG1 C 13 20.844 0.3 A 83 VAL CG2 C 13 20.263 0.3 A 83 VAL N N 15 122.576 0.3 A 84 ILE H H 1 8.282 0.020 A 84 ILE HD1% H 1 0.785 0.020 A 84 ILE CA C 13 57.738 0.3 A 84 ILE CB C 13 37.121 0.3 A 84 ILE CD1 C 13 12.480 0.3 A 84 ILE N N 15 125.510 0.3 A 86 MET H H 1 8.264 0.020 A 86 MET C C 13 174.882 0.3 A 86 MET CA C 13 55.580 0.3 A 86 MET CB C 13 28.890 0.3 A 86 MET N N 15 121.740 0.3 A 87 ALA H H 1 8.079 0.020 A 87 ALA C C 13 175.941 0.3 A 87 ALA CA C 13 49.850 0.3 A 87 ALA CB C 13 17.566 0.3 A 87 ALA N N 15 124.732 0.3 A 88 ALA H H 1 7.951 0.020 A 88 ALA C C 13 177.523 0.3 A 88 ALA CA C 13 56.151 0.3 A 88 ALA CB C 13 17.463 0.3 A 88 ALA N N 15 121.664 0.3 A 89 VAL H H 1 8.161 0.020 A 89 VAL HG1% H 1 0.274 0.020 A 89 VAL HG2% H 1 0.471 0.020 A 89 VAL C C 13 176.857 0.3 A 89 VAL CA C 13 61.836 0.3 A 89 VAL CB C 13 31.071 0.3 A 89 VAL CG1 C 13 19.881 0.3 A 89 VAL CG2 C 13 22.282 0.3 A 89 VAL N N 15 119.415 0.3 A 90 LYS H H 1 8.529 0.020 A 90 LYS C C 13 175.559 0.3 A 90 LYS CA C 13 56.083 0.3 A 90 LYS CB C 13 28.913 0.3 A 90 LYS N N 15 121.221 0.3 A 91 GLN H H 1 7.973 0.020 A 91 GLN C C 13 176.950 0.3 A 91 GLN CA C 13 57.921 0.3 A 91 GLN CB C 13 27.235 0.3 A 91 GLN N N 15 115.879 0.3 A 92 ALA H H 1 7.661 0.020 A 92 ALA C C 13 179.537 0.3 A 92 ALA CA C 13 54.245 0.3 A 92 ALA CB C 13 16.767 0.3 A 92 ALA N N 15 119.538 0.3 A 93 LEU H H 1 8.544 0.020 A 93 LEU HD1% H 1 -0.423 0.020 A 93 LEU HD2% H 1 0.099 0.020 A 93 LEU C C 13 179.075 0.3 A 93 LEU CA C 13 57.787 0.3 A 93 LEU CB C 13 40.557 0.3 A 93 LEU CD1 C 13 22.806 0.3 A 93 LEU CD2 C 13 23.163 0.3 A 93 LEU N N 15 120.236 0.3 A 94 ARG H H 1 8.057 0.020 A 94 ARG C C 13 178.396 0.3 A 94 ARG CA C 13 59.736 0.3 A 94 ARG CB C 13 28.091 0.3 A 94 ARG N N 15 118.361 0.3 A 95 GLU H H 1 7.737 0.020 A 95 GLU C C 13 179.794 0.3 A 95 GLU CA C 13 58.217 0.3 A 95 GLU CB C 13 28.091 0.3 A 95 GLU N N 15 115.851 0.3 A 96 ALA H H 1 8.824 0.020 A 96 ALA C C 13 181.313 0.3 A 96 ALA CA C 13 54.302 0.3 A 96 ALA CB C 13 17.703 0.3 A 96 ALA N N 15 122.958 0.3 A 97 GLY H H 1 9.088 0.020 A 97 GLY C C 13 178.177 0.3 A 97 GLY CA C 13 45.991 0.3 A 97 GLY N N 15 108.363 0.3 A 98 ASP H H 1 8.102 0.020 A 98 ASP C C 13 178.715 0.3 A 98 ASP CA C 13 57.019 0.3 A 98 ASP CB C 13 38.479 0.3 A 98 ASP N N 15 122.197 0.3 A 99 GLU H H 1 8.115 0.020 A 99 GLU C C 13 179.513 0.3 A 99 GLU CA C 13 53.752 0.3 A 99 GLU CB C 13 28.491 0.3 A 99 GLU N N 15 120.103 0.3 A 100 PHE H H 1 8.535 0.020 A 100 PHE C C 13 178.618 0.3 A 100 PHE CA C 13 57.460 0.3 A 100 PHE CB C 13 40.336 0.3 A 100 PHE N N 15 120.218 0.3 A 101 GLU H H 1 8.032 0.020 A 101 GLU C C 13 177.339 0.3 A 101 GLU CA C 13 57.601 0.3 A 101 GLU CB C 13 28.593 0.3 A 101 GLU N N 15 117.531 0.3 A 102 LEU H H 1 7.369 0.020 A 102 LEU HD1% H 1 0.830 0.020 A 102 LEU HD2% H 1 0.539 0.020 A 102 LEU CA C 13 56.588 0.3 A 102 LEU CB C 13 40.773 0.3 A 102 LEU CD1 C 13 23.801 0.3 A 102 LEU CD2 C 13 25.051 0.3 A 102 LEU N N 15 116.641 0.3 A 103 ARG H H 1 7.472 0.020 A 103 ARG C C 13 177.605 0.3 A 103 ARG CA C 13 58.987 0.3 A 103 ARG CB C 13 31.150 0.3 A 103 ARG N N 15 115.854 0.3 A 104 TYR H H 1 7.904 0.020 A 104 TYR C C 13 174.962 0.3 A 104 TYR CA C 13 60.841 0.3 A 104 TYR CB C 13 36.628 0.3 A 104 TYR N N 15 119.078 0.3 A 105 ARG H H 1 7.195 0.020 A 105 ARG C C 13 178.395 0.3 A 105 ARG CA C 13 57.921 0.3 A 105 ARG CB C 13 27.794 0.3 A 105 ARG N N 15 119.378 0.3 A 106 ARG H H 1 8.452 0.020 A 106 ARG C C 13 177.257 0.3 A 106 ARG CA C 13 56.915 0.3 A 106 ARG CB C 13 27.554 0.3 A 106 ARG N N 15 118.875 0.3 A 107 ALA H H 1 7.839 0.020 A 107 ALA C C 13 175.701 0.3 A 107 ALA CA C 13 54.644 0.3 A 107 ALA CB C 13 17.063 0.3 A 107 ALA N N 15 121.864 0.3 A 108 PHE H H 1 8.392 0.020 A 108 PHE C C 13 174.982 0.3 A 108 PHE CA C 13 57.042 0.3 A 108 PHE CB C 13 39.838 0.3 A 108 PHE N N 15 121.984 0.3 A 109 SER H H 1 7.810 0.020 A 109 SER C C 13 175.421 0.3 A 109 SER CA C 13 55.044 0.3 A 109 SER CB C 13 63.241 0.3 A 109 SER N N 15 114.585 0.3 A 110 ASP H H 1 8.380 0.020 A 110 ASP C C 13 178.196 0.3 A 110 ASP CA C 13 55.980 0.3 A 110 ASP CB C 13 37.840 0.3 A 110 ASP N N 15 119.725 0.3 A 111 LEU H H 1 7.783 0.020 A 111 LEU HD1% H 1 0.582 0.020 A 111 LEU HD2% H 1 0.533 0.020 A 111 LEU C C 13 178.804 0.3 A 111 LEU CA C 13 57.099 0.3 A 111 LEU CB C 13 40.797 0.3 A 111 LEU CD1 C 13 23.856 0.3 A 111 LEU CD2 C 13 23.784 0.3 A 111 LEU N N 15 120.827 0.3 A 112 THR H H 1 8.331 0.020 A 112 THR C C 13 177.157 0.3 A 112 THR CA C 13 64.690 0.3 A 112 THR CB C 13 67.407 0.3 A 112 THR N N 15 109.101 0.3 A 113 SER H H 1 7.645 0.020 A 113 SER C C 13 175.319 0.3 A 113 SER CA C 13 59.736 0.3 A 113 SER CB C 13 62.213 0.3 A 113 SER N N 15 115.811 0.3 A 114 GLN H H 1 7.614 0.020 A 114 GLN C C 13 175.978 0.3 A 114 GLN CA C 13 56.459 0.3 A 114 GLN CB C 13 28.011 0.3 A 114 GLN N N 15 118.421 0.3 A 115 LEU H H 1 7.383 0.020 A 115 LEU HD1% H 1 0.505 0.020 A 115 LEU HD2% H 1 0.855 0.020 A 115 LEU C C 13 176.198 0.3 A 115 LEU CA C 13 54.804 0.3 A 115 LEU CB C 13 42.555 0.3 A 115 LEU CD1 C 13 23.799 0.3 A 115 LEU CD2 C 13 23.992 0.3 A 115 LEU N N 15 118.236 0.3 A 116 HIS H H 1 8.158 0.020 A 116 HIS C C 13 174.122 0.3 A 116 HIS CA C 13 56.379 0.3 A 116 HIS CB C 13 28.251 0.3 A 116 HIS N N 15 119.694 0.3 A 117 ILE H H 1 8.658 0.020 A 117 ILE HD1% H 1 0.863 0.020 A 117 ILE C C 13 176.377 0.3 A 117 ILE CA C 13 60.717 0.3 A 117 ILE CB C 13 37.224 0.3 A 117 ILE CD1 C 13 13.394 0.3 A 117 ILE N N 15 122.347 0.3 A 118 THR H H 1 8.227 0.020 A 118 THR CA C 13 57.921 0.3 A 118 THR CB C 13 63.434 0.3 A 118 THR N N 15 115.798 0.3 A 120 GLY H H 1 8.429 0.020 A 120 GLY C C 13 180.495 0.3 A 120 GLY CA C 13 44.393 0.3 A 120 GLY N N 15 109.574 0.3 A 121 THR H H 1 7.774 0.020 A 121 THR C C 13 178.096 0.3 A 121 THR CA C 13 62.041 0.3 A 121 THR CB C 13 63.994 0.3 A 121 THR N N 15 113.419 0.3 A 122 ALA H H 1 7.944 0.020 A 122 ALA C C 13 177.397 0.3 A 122 ALA CA C 13 52.624 0.3 A 122 ALA CB C 13 18.525 0.3 A 122 ALA N N 15 121.876 0.3 A 123 TYR H H 1 8.748 0.020 A 123 TYR C C 13 176.060 0.3 A 123 TYR CA C 13 60.055 0.3 A 123 TYR CB C 13 36.482 0.3 A 123 TYR N N 15 120.931 0.3 A 124 GLN H H 1 8.454 0.020 A 124 GLN C C 13 178.098 0.3 A 124 GLN CA C 13 58.640 0.3 A 124 GLN CB C 13 26.516 0.3 A 124 GLN N N 15 115.002 0.3 A 125 SER H H 1 7.283 0.020 A 125 SER C C 13 179.557 0.3 A 125 SER CA C 13 61.357 0.3 A 125 SER CB C 13 61.357 0.3 A 125 SER N N 15 114.135 0.3 A 126 PHE H H 1 6.606 0.020 A 126 PHE C C 13 174.879 0.3 A 126 PHE CA C 13 61.117 0.3 A 126 PHE CB C 13 37.703 0.3 A 126 PHE N N 15 113.327 0.3 A 127 GLU H H 1 8.546 0.020 A 127 GLU C C 13 176.857 0.3 A 127 GLU CA C 13 58.058 0.3 A 127 GLU CB C 13 28.890 0.3 A 127 GLU N N 15 119.398 0.3 A 128 GLN H H 1 7.525 0.020 A 128 GLN C C 13 178.356 0.3 A 128 GLN CA C 13 58.080 0.3 A 128 GLN CB C 13 26.995 0.3 A 128 GLN N N 15 114.754 0.3 A 129 VAL H H 1 7.036 0.020 A 129 VAL HG1% H 1 0.938 0.020 A 129 VAL HG2% H 1 0.962 0.020 A 129 VAL C C 13 177.756 0.3 A 129 VAL CA C 13 65.090 0.3 A 129 VAL CB C 13 30.249 0.3 A 129 VAL CG1 C 13 22.739 0.3 A 129 VAL CG2 C 13 22.479 0.3 A 129 VAL N N 15 118.194 0.3 A 130 VAL H H 1 7.831 0.020 A 130 VAL HG1% H 1 0.070 0.020 A 130 VAL HG2% H 1 -0.083 0.020 A 130 VAL C C 13 177.714 0.3 A 130 VAL CA C 13 65.409 0.3 A 130 VAL CB C 13 29.472 0.3 A 130 VAL CG1 C 13 22.816 0.3 A 130 VAL CG2 C 13 21.942 0.3 A 130 VAL N N 15 119.459 0.3 A 131 ASN H H 1 8.374 0.020 A 131 ASN C C 13 178.775 0.3 A 131 ASN CA C 13 54.644 0.3 A 131 ASN CB C 13 36.265 0.3 A 131 ASN N N 15 117.212 0.3 A 132 GLU H H 1 7.226 0.020 A 132 GLU C C 13 179.097 0.3 A 132 GLU CA C 13 57.978 0.3 A 132 GLU CB C 13 27.372 0.3 A 132 GLU N N 15 118.393 0.3 A 133 LEU H H 1 7.467 0.020 A 133 LEU HD1% H 1 0.448 0.020 A 133 LEU HD2% H 1 0.350 0.020 A 133 LEU C C 13 178.016 0.3 A 133 LEU CA C 13 56.802 0.3 A 133 LEU CB C 13 39.781 0.3 A 133 LEU CD1 C 13 23.560 0.3 A 133 LEU CD2 C 13 23.559 0.3 A 133 LEU N N 15 120.835 0.3 A 134 PHE H H 1 6.926 0.020 A 134 PHE C C 13 176.258 0.3 A 134 PHE CA C 13 56.539 0.3 A 134 PHE CB C 13 37.863 0.3 A 134 PHE N N 15 112.847 0.3 A 135 ARG H H 1 7.144 0.020 A 135 ARG C C 13 176.957 0.3 A 135 ARG CA C 13 58.937 0.3 A 135 ARG CB C 13 28.011 0.3 A 135 ARG N N 15 123.664 0.3 A 136 ASP H H 1 8.607 0.020 A 136 ASP C C 13 175.339 0.3 A 136 ASP CA C 13 53.343 0.3 A 136 ASP CB C 13 39.598 0.3 A 136 ASP N N 15 116.448 0.3 A 137 GLY H H 1 7.468 0.020 A 137 GLY C C 13 172.324 0.3 A 137 GLY CA C 13 42.795 0.3 A 137 GLY N N 15 108.506 0.3 A 138 VAL H H 1 8.181 0.020 A 138 VAL HG1% H 1 0.282 0.020 A 138 VAL HG2% H 1 -0.747 0.020 A 138 VAL C C 13 174.160 0.3 A 138 VAL CA C 13 61.893 0.3 A 138 VAL CB C 13 30.808 0.3 A 138 VAL CG1 C 13 20.496 0.3 A 138 VAL CG2 C 13 22.297 0.3 A 138 VAL N N 15 120.519 0.3 A 139 ASN H H 1 6.261 0.020 A 139 ASN C C 13 174.959 0.3 A 139 ASN CA C 13 51.025 0.3 A 139 ASN CB C 13 38.639 0.3 A 139 ASN N N 15 115.573 0.3 A 140 TRP H H 1 8.413 0.020 A 140 TRP HE1 H 1 9.411 0.020 A 140 TRP C C 13 177.976 0.3 A 140 TRP CA C 13 60.135 0.3 A 140 TRP CB C 13 29.609 0.3 A 140 TRP N N 15 118.231 0.3 A 140 TRP NE1 N 15 129.166 0.3 A 141 GLY H H 1 8.494 0.020 A 141 GLY C C 13 177.297 0.3 A 141 GLY CA C 13 46.471 0.3 A 141 GLY N N 15 106.238 0.3 A 142 ARG H H 1 8.104 0.020 A 142 ARG C C 13 177.457 0.3 A 142 ARG CA C 13 57.498 0.3 A 142 ARG CB C 13 29.609 0.3 A 142 ARG N N 15 121.156 0.3 A 143 ILE H H 1 7.696 0.020 A 143 ILE HD1% H 1 0.234 0.020 A 143 ILE C C 13 177.756 0.3 A 143 ILE CA C 13 65.889 0.3 A 143 ILE CB C 13 35.603 0.3 A 143 ILE CD1 C 13 13.402 0.3 A 143 ILE N N 15 120.888 0.3 A 144 VAL H H 1 8.229 0.020 A 144 VAL HG1% H 1 1.046 0.020 A 144 VAL HG2% H 1 0.788 0.020 A 144 VAL C C 13 177.557 0.3 A 144 VAL CA C 13 67.088 0.3 A 144 VAL CB C 13 30.089 0.3 A 144 VAL CG1 C 13 23.044 0.3 A 144 VAL CG2 C 13 22.646 0.3 A 144 VAL N N 15 120.958 0.3 A 145 ALA H H 1 7.579 0.020 A 145 ALA C C 13 177.999 0.3 A 145 ALA CA C 13 54.062 0.3 A 145 ALA CB C 13 16.983 0.3 A 145 ALA N N 15 121.229 0.3 A 146 PHE H H 1 7.985 0.020 A 146 PHE C C 13 179.432 0.3 A 146 PHE CA C 13 61.169 0.3 A 146 PHE CB C 13 37.863 0.3 A 146 PHE N N 15 119.338 0.3 A 147 PHE H H 1 7.824 0.020 A 147 PHE C C 13 177.399 0.3 A 147 PHE CA C 13 59.119 0.3 A 147 PHE CB C 13 39.438 0.3 A 147 PHE N N 15 119.900 0.3 A 148 SER H H 1 8.423 0.020 A 148 SER C C 13 177.357 0.3 A 148 SER CA C 13 63.115 0.3 A 148 SER CB C 13 61.893 0.3 A 148 SER N N 15 114.725 0.3 A 149 PHE H H 1 9.097 0.020 A 149 PHE C C 13 176.338 0.3 A 149 PHE CA C 13 59.336 0.3 A 149 PHE CB C 13 37.281 0.3 A 149 PHE N N 15 124.361 0.3 A 150 GLY H H 1 7.937 0.020 A 150 GLY C C 13 176.398 0.3 A 150 GLY CA C 13 47.030 0.3 A 150 GLY N N 15 105.935 0.3 A 151 GLY H H 1 8.803 0.020 A 151 GLY C C 13 174.300 0.3 A 151 GLY CA C 13 46.950 0.3 A 151 GLY N N 15 107.449 0.3 A 152 ALA H H 1 8.232 0.020 A 152 ALA C C 13 177.636 0.3 A 152 ALA CA C 13 54.142 0.3 A 152 ALA CB C 13 17.063 0.3 A 152 ALA N N 15 124.384 0.3 A 153 LEU H H 1 8.159 0.020 A 153 LEU HD1% H 1 0.822 0.020 A 153 LEU HD2% H 1 0.789 0.020 A 153 LEU C C 13 179.937 0.3 A 153 LEU CA C 13 56.588 0.3 A 153 LEU CB C 13 40.660 0.3 A 153 LEU CD1 C 13 23.123 0.3 A 153 LEU CD2 C 13 22.943 0.3 A 153 LEU N N 15 118.871 0.3 A 154 CYS H H 1 8.049 0.020 A 154 CYS HG H 1 2.363 0.020 A 154 CYS C C 13 177.332 0.3 A 154 CYS CA C 13 60.296 0.3 A 154 CYS CB C 13 25.237 0.3 A 154 CYS N N 15 118.554 0.3 A 155 VAL H H 1 8.016 0.020 A 155 VAL HG1% H 1 0.945 0.020 A 155 VAL HG2% H 1 0.976 0.020 A 155 VAL C C 13 175.723 0.3 A 155 VAL CA C 13 66.129 0.3 A 155 VAL CB C 13 30.728 0.3 A 155 VAL CG1 C 13 22.055 0.3 A 155 VAL CG2 C 13 21.560 0.3 A 155 VAL N N 15 118.474 0.3 A 156 GLU H H 1 8.025 0.020 A 156 GLU C C 13 178.036 0.3 A 156 GLU CA C 13 61.278 0.3 A 156 GLU CB C 13 27.452 0.3 A 156 GLU N N 15 119.114 0.3 A 157 SER H H 1 7.629 0.020 A 157 SER C C 13 175.299 0.3 A 157 SER CA C 13 62.373 0.3 A 157 SER CB C 13 60.854 0.3 A 157 SER N N 15 113.391 0.3 A 158 VAL H H 1 7.374 0.020 A 158 VAL HG1% H 1 0.124 0.020 A 158 VAL HG2% H 1 0.349 0.020 A 158 VAL C C 13 173.977 0.3 A 158 VAL CA C 13 65.729 0.3 A 158 VAL CB C 13 29.609 0.3 A 158 VAL CG1 C 13 20.840 0.3 A 158 VAL CG2 C 13 22.200 0.3 A 158 VAL N N 15 120.493 0.3 A 159 ASP H H 1 8.309 0.020 A 159 ASP C C 13 177.696 0.3 A 159 ASP CA C 13 56.619 0.3 A 159 ASP CB C 13 39.918 0.3 A 159 ASP N N 15 123.215 0.3 A 160 LYS H H 1 7.541 0.020 A 160 LYS C C 13 174.839 0.3 A 160 LYS CA C 13 55.101 0.3 A 160 LYS CB C 13 30.488 0.3 A 160 LYS N N 15 115.648 0.3 A 161 GLU H H 1 7.842 0.020 A 161 GLU C C 13 175.781 0.3 A 161 GLU CA C 13 56.779 0.3 A 161 GLU CB C 13 25.054 0.3 A 161 GLU N N 15 113.911 0.3 A 162 MET H H 1 8.420 0.020 A 162 MET C C 13 176.597 0.3 A 162 MET CA C 13 52.646 0.3 A 162 MET CB C 13 30.488 0.3 A 162 MET N N 15 118.882 0.3 A 163 GLN H H 1 8.615 0.020 A 163 GLN C C 13 177.397 0.3 A 163 GLN CA C 13 59.176 0.3 A 163 GLN CB C 13 26.093 0.3 A 163 GLN N N 15 119.366 0.3 A 164 VAL H H 1 7.938 0.020 A 164 VAL HG1% H 1 0.820 0.020 A 164 VAL HG2% H 1 0.843 0.020 A 164 VAL C C 13 175.459 0.3 A 164 VAL CA C 13 62.852 0.3 A 164 VAL CB C 13 30.089 0.3 A 164 VAL CG1 C 13 19.534 0.3 A 164 VAL CG2 C 13 19.634 0.3 A 164 VAL N N 15 116.957 0.3 A 165 LEU H H 1 7.741 0.020 A 165 LEU HD1% H 1 0.607 0.020 A 165 LEU HD2% H 1 0.658 0.020 A 165 LEU C C 13 177.714 0.3 A 165 LEU CA C 13 55.683 0.3 A 165 LEU CB C 13 39.678 0.3 A 165 LEU CD1 C 13 22.134 0.3 A 165 LEU CD2 C 13 23.471 0.3 A 165 LEU N N 15 117.124 0.3 A 166 VAL H H 1 7.342 0.020 A 166 VAL HG1% H 1 0.233 0.020 A 166 VAL HG2% H 1 0.430 0.020 A 166 VAL C C 13 176.817 0.3 A 166 VAL CA C 13 66.848 0.3 A 166 VAL CB C 13 29.370 0.3 A 166 VAL CG1 C 13 20.865 0.3 A 166 VAL CG2 C 13 22.658 0.3 A 166 VAL N N 15 119.434 0.3 A 167 SER H H 1 8.099 0.020 A 167 SER C C 13 176.737 0.3 A 167 SER CA C 13 60.215 0.3 A 167 SER CB C 13 61.654 0.3 A 167 SER N N 15 110.775 0.3 A 168 ARG H H 1 6.596 0.020 A 168 ARG C C 13 175.439 0.3 A 168 ARG CA C 13 60.615 0.3 A 168 ARG CB C 13 28.011 0.3 A 168 ARG N N 15 122.916 0.3 A 169 ILE H H 1 7.928 0.020 A 169 ILE HD1% H 1 0.450 0.020 A 169 ILE C C 13 177.779 0.3 A 169 ILE CA C 13 64.131 0.3 A 169 ILE CB C 13 36.961 0.3 A 169 ILE CD1 C 13 13.950 0.3 A 169 ILE N N 15 118.335 0.3 A 170 ALA H H 1 7.672 0.020 A 170 ALA C C 13 179.195 0.3 A 170 ALA CA C 13 53.902 0.3 A 170 ALA CB C 13 16.824 0.3 A 170 ALA N N 15 119.271 0.3 A 171 ALA H H 1 7.258 0.020 A 171 ALA C C 13 180.833 0.3 A 171 ALA CA C 13 54.142 0.3 A 171 ALA CB C 13 16.504 0.3 A 171 ALA N N 15 120.393 0.3 A 172 TRP H H 1 8.936 0.020 A 172 TRP HE1 H 1 10.046 0.020 A 172 TRP C C 13 179.350 0.3 A 172 TRP CA C 13 57.019 0.3 A 172 TRP CB C 13 27.292 0.3 A 172 TRP N N 15 121.501 0.3 A 172 TRP NE1 N 15 126.408 0.3 A 173 MET H H 1 8.885 0.020 A 173 MET C C 13 176.158 0.3 A 173 MET CA C 13 60.238 0.3 A 173 MET CB C 13 28.833 0.3 A 173 MET N N 15 117.211 0.3 A 174 ALA H H 1 8.206 0.020 A 174 ALA C C 13 178.875 0.3 A 174 ALA CA C 13 54.861 0.3 A 174 ALA CB C 13 16.687 0.3 A 174 ALA N N 15 120.901 0.3 A 175 THR H H 1 8.530 0.020 A 175 THR C C 13 174.782 0.3 A 175 THR CA C 13 66.209 0.3 A 175 THR CB C 13 68.046 0.3 A 175 THR N N 15 116.591 0.3 A 176 TYR H H 1 8.822 0.020 A 176 TYR C C 13 179.255 0.3 A 176 TYR CA C 13 62.373 0.3 A 176 TYR CB C 13 37.863 0.3 A 176 TYR N N 15 123.375 0.3 A 177 LEU H H 1 8.759 0.020 A 177 LEU HD1% H 1 1.090 0.020 A 177 LEU HD2% H 1 1.077 0.020 A 177 LEU C C 13 177.979 0.3 A 177 LEU CA C 13 58.457 0.3 A 177 LEU CB C 13 41.276 0.3 A 177 LEU CD1 C 13 25.497 0.3 A 177 LEU CD2 C 13 25.717 0.3 A 177 LEU N N 15 119.511 0.3 A 178 ASN H H 1 8.333 0.020 A 178 ASN C C 13 176.021 0.3 A 178 ASN CA C 13 55.843 0.3 A 178 ASN CB C 13 38.103 0.3 A 178 ASN N N 15 117.233 0.3 A 179 ASP H H 1 8.451 0.020 A 179 ASP C C 13 177.557 0.3 A 179 ASP CA C 13 55.900 0.3 A 179 ASP CB C 13 39.279 0.3 A 179 ASP N N 15 115.264 0.3 A 180 HIS H H 1 8.073 0.020 A 180 HIS C C 13 175.479 0.3 A 180 HIS CA C 13 55.421 0.3 A 180 HIS CB C 13 29.609 0.3 A 180 HIS N N 15 111.728 0.3 A 181 LEU H H 1 7.183 0.020 A 181 LEU HD1% H 1 -0.304 0.020 A 181 LEU HD2% H 1 0.193 0.020 A 181 LEU C C 13 176.160 0.3 A 181 LEU CA C 13 55.021 0.3 A 181 LEU CB C 13 41.756 0.3 A 181 LEU CD1 C 13 21.353 0.3 A 181 LEU CD2 C 13 24.085 0.3 A 181 LEU N N 15 116.833 0.3 A 182 GLU H H 1 8.596 0.020 A 182 GLU CA C 13 61.014 0.3 A 182 GLU CB C 13 25.956 0.3 A 182 GLU N N 15 121.364 0.3 A 184 TRP H H 1 7.070 0.020 A 184 TRP HE1 H 1 9.835 0.020 A 184 TRP C C 13 179.217 0.3 A 184 TRP CA C 13 65.672 0.3 A 184 TRP CB C 13 29.073 0.3 A 184 TRP N N 15 117.804 0.3 A 184 TRP NE1 N 15 128.558 0.3 A 185 ILE H H 1 8.396 0.020 A 185 ILE HD1% H 1 0.504 0.020 A 185 ILE C C 13 178.655 0.3 A 185 ILE CA C 13 65.272 0.3 A 185 ILE CB C 13 35.945 0.3 A 185 ILE CD1 C 13 13.179 0.3 A 185 ILE N N 15 121.825 0.3 A 186 GLN H H 1 8.374 0.020 A 186 GLN C C 13 179.035 0.3 A 186 GLN CA C 13 57.818 0.3 A 186 GLN CB C 13 26.813 0.3 A 186 GLN N N 15 116.489 0.3 A 187 GLU H H 1 7.515 0.020 A 187 GLU C C 13 176.458 0.3 A 187 GLU CA C 13 57.019 0.3 A 187 GLU CB C 13 28.411 0.3 A 187 GLU N N 15 118.764 0.3 A 188 ASN H H 1 7.092 0.020 A 188 ASN C C 13 173.620 0.3 A 188 ASN CA C 13 52.863 0.3 A 188 ASN CB C 13 36.721 0.3 A 188 ASN N N 15 116.561 0.3 A 189 GLY H H 1 7.339 0.020 A 189 GLY C C 13 175.658 0.3 A 189 GLY CA C 13 44.792 0.3 A 189 GLY N N 15 104.897 0.3 A 190 GLY H H 1 8.462 0.020 A 190 GLY C C 13 173.021 0.3 A 190 GLY CA C 13 43.354 0.3 A 190 GLY N N 15 108.292 0.3 A 191 TRP H H 1 8.673 0.020 A 191 TRP HE1 H 1 10.500 0.020 A 191 TRP C C 13 178.136 0.3 A 191 TRP CA C 13 59.416 0.3 A 191 TRP CB C 13 28.650 0.3 A 191 TRP N N 15 118.031 0.3 A 191 TRP NE1 N 15 128.607 0.3 A 192 ASP H H 1 8.846 0.020 A 192 ASP C C 13 179.058 0.3 A 192 ASP CA C 13 56.859 0.3 A 192 ASP CB C 13 39.279 0.3 A 192 ASP N N 15 117.298 0.3 A 193 THR H H 1 7.431 0.020 A 193 THR C C 13 174.979 0.3 A 193 THR CA C 13 65.649 0.3 A 193 THR CB C 13 67.327 0.3 A 193 THR N N 15 116.061 0.3 A 194 PHE H H 1 6.527 0.020 A 194 PHE C C 13 176.418 0.3 A 194 PHE CA C 13 61.014 0.3 A 194 PHE CB C 13 36.881 0.3 A 194 PHE N N 15 121.789 0.3 A 195 VAL H H 1 7.747 0.020 A 195 VAL HG1% H 1 0.842 0.020 A 195 VAL HG2% H 1 1.055 0.020 A 195 VAL C C 13 178.078 0.3 A 195 VAL CA C 13 65.752 0.3 A 195 VAL CB C 13 30.488 0.3 A 195 VAL CG1 C 13 21.294 0.3 A 195 VAL CG2 C 13 24.227 0.3 A 195 VAL N N 15 116.988 0.3 A 196 GLU H H 1 7.497 0.020 A 196 GLU C C 13 177.976 0.3 A 196 GLU CA C 13 58.320 0.3 A 196 GLU CB C 13 28.673 0.3 A 196 GLU N N 15 120.171 0.3 A 197 LEU H H 1 7.626 0.020 A 197 LEU HD1% H 1 0.813 0.020 A 197 LEU HD2% H 1 0.848 0.020 A 197 LEU C C 13 178.376 0.3 A 197 LEU CA C 13 55.900 0.3 A 197 LEU CB C 13 42.395 0.3 A 197 LEU CD1 C 13 25.079 0.3 A 197 LEU CD2 C 13 22.192 0.3 A 197 LEU N N 15 117.210 0.3 A 198 TYR H H 1 8.081 0.020 A 198 TYR C C 13 176.577 0.3 A 198 TYR CA C 13 58.377 0.3 A 198 TYR CB C 13 37.521 0.3 A 198 TYR N N 15 115.681 0.3 A 199 GLY H H 1 8.032 0.020 A 199 GLY C C 13 173.640 0.3 A 199 GLY CA C 13 44.553 0.3 A 199 GLY N N 15 108.201 0.3 A 200 ASN H H 1 8.300 0.020 A 200 ASN C C 13 175.081 0.3 A 200 ASN CA C 13 52.784 0.3 A 200 ASN CB C 13 37.441 0.3 A 200 ASN N N 15 118.385 0.3 A 201 ASN H H 1 8.351 0.020 A 201 ASN C C 13 175.239 0.3 A 201 ASN CA C 13 55.660 0.3 A 201 ASN CB C 13 37.441 0.3 A 201 ASN N N 15 118.772 0.3 A 202 ALA H H 1 8.096 0.020 A 202 ALA C C 13 178.056 0.3 A 202 ALA CA C 13 52.384 0.3 A 202 ALA CB C 13 17.543 0.3 A 202 ALA N N 15 123.312 0.3 A 203 ALA H H 1 8.048 0.020 A 203 ALA C C 13 178.056 0.3 A 203 ALA CA C 13 52.224 0.3 A 203 ALA CB C 13 17.303 0.3 A 203 ALA N N 15 121.596 0.3 A 204 ALA H H 1 7.948 0.020 A 204 ALA C C 13 178.516 0.3 A 204 ALA CA C 13 52.384 0.3 A 204 ALA CB C 13 17.303 0.3 A 204 ALA N N 15 122.138 0.3 A 205 GLU H H 1 8.204 0.020 A 205 GLU C C 13 177.137 0.3 A 205 GLU CA C 13 56.699 0.3 A 205 GLU CB C 13 28.411 0.3 A 205 GLU N N 15 118.578 0.3 A 206 SER H H 1 8.045 0.020 A 206 SER C C 13 174.719 0.3 A 206 SER CA C 13 58.377 0.3 A 206 SER CB C 13 62.373 0.3 A 206 SER N N 15 115.312 0.3 A 207 ARG H H 1 7.999 0.020 A 207 ARG C C 13 175.978 0.3 A 207 ARG CA C 13 55.740 0.3 A 207 ARG CB C 13 28.571 0.3 A 207 ARG N N 15 121.799 0.3 A 208 LYS H H 1 8.164 0.020 A 208 LYS C C 13 177.157 0.3 A 208 LYS CA C 13 56.220 0.3 A 208 LYS CB C 13 31.128 0.3 A 208 LYS N N 15 121.165 0.3 A 209 GLY H H 1 8.342 0.020 A 209 GLY C C 13 173.900 0.3 A 209 GLY CA C 13 44.553 0.3 A 209 GLY N N 15 109.505 0.3 A 210 GLN H H 1 8.060 0.020 A 210 GLN C C 13 176.877 0.3 A 210 GLN CA C 13 55.101 0.3 A 210 GLN CB C 13 28.011 0.3 A 210 GLN N N 15 119.207 0.3 A 211 GLU H H 1 8.517 0.020 A 211 GLU C C 13 175.741 0.3 A 211 GLU CA C 13 56.300 0.3 A 211 GLU CB C 13 28.913 0.3 A 211 GLU N N 15 121.150 0.3 A 212 ARG H H 1 8.397 0.020 A 212 ARG CA C 13 55.900 0.3 A 212 ARG CB C 13 29.050 0.3 A 212 ARG N N 15 122.133 0.3 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin undefined save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin undefined save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin undefined save_