NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | item_count |
378434 | 1ha8 | 4979 | cing | recoord | 4-filtered-FRED | STAR | entry | full | 612 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1ha8 # This FRED archive file contains, for PDB entry <1ha8>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1ha8 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1ha8 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 5089.40 loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 . 1 $PHEROMONE A . 1 1 stop_ save_ save_PHEROMONE _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name PHEROMONE _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GECEQCFSDGGDCTTCFNNGTGPCANCLAGYPAGCSNSDCTAFLSQCYGGC _Entity.Number_of_monomers 51 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 GLU . 1 1 3 CYS . 1 1 4 GLU . 1 1 5 GLN . 1 1 6 CYS . 1 1 7 PHE . 1 1 8 SER . 1 1 9 ASP . 1 1 10 GLY . 1 1 11 GLY . 1 1 12 ASP . 1 1 13 CYS . 1 1 14 THR . 1 1 15 THR . 1 1 16 CYS . 1 1 17 PHE . 1 1 18 ASN . 1 1 19 ASN . 1 1 20 GLY . 1 1 21 THR . 1 1 22 GLY . 1 1 23 PRO . 1 1 24 CYS . 1 1 25 ALA . 1 1 26 ASN . 1 1 27 CYS . 1 1 28 LEU . 1 1 29 ALA . 1 1 30 GLY . 1 1 31 TYR . 1 1 32 PRO . 1 1 33 ALA . 1 1 34 GLY . 1 1 35 CYS . 1 1 36 SER . 1 1 37 ASN . 1 1 38 SER . 1 1 39 ASP . 1 1 40 CYS . 1 1 41 THR . 1 1 42 ALA . 1 1 43 PHE . 1 1 44 LEU . 1 1 45 SER . 1 1 46 GLN . 1 1 47 CYS . 1 1 48 TYR . 1 1 49 GLY . 1 1 50 GLY . 1 1 51 CYS . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 GLU 2 2 1 1 CYS 3 3 1 1 GLU 4 4 1 1 GLN 5 5 1 1 CYS 6 6 1 1 PHE 7 7 1 1 SER 8 8 1 1 ASP 9 9 1 1 GLY 10 10 1 1 GLY 11 11 1 1 ASP 12 12 1 1 CYS 13 13 1 1 THR 14 14 1 1 THR 15 15 1 1 CYS 16 16 1 1 PHE 17 17 1 1 ASN 18 18 1 1 ASN 19 19 1 1 GLY 20 20 1 1 THR 21 21 1 1 GLY 22 22 1 1 PRO 23 23 1 1 CYS 24 24 1 1 ALA 25 25 1 1 ASN 26 26 1 1 CYS 27 27 1 1 LEU 28 28 1 1 ALA 29 29 1 1 GLY 30 30 1 1 TYR 31 31 1 1 PRO 32 32 1 1 ALA 33 33 1 1 GLY 34 34 1 1 CYS 35 35 1 1 SER 36 36 1 1 ASN 37 37 1 1 SER 38 38 1 1 ASP 39 39 1 1 CYS 40 40 1 1 THR 41 41 1 1 ALA 42 42 1 1 PHE 43 43 1 1 LEU 44 44 1 1 SER 45 45 1 1 GLN 46 46 1 1 CYS 47 47 1 1 TYR 48 48 1 1 GLY 49 49 1 1 GLY 50 50 1 1 CYS 51 51 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 394 1 . . . 1 1 395 1 . . . 1 1 396 1 . . . 1 1 397 1 . . . 1 1 398 1 . . . 1 1 399 1 . . . 1 1 400 1 . . . 1 1 401 1 . . . 1 1 402 1 . . . 1 1 403 1 . . . 1 1 404 1 . . . 1 1 405 1 . . . 1 1 406 1 . . . 1 1 407 1 . . . 1 1 408 1 . . . 1 1 409 1 . . . 1 1 410 1 . . . 1 1 411 1 . . . 1 1 412 1 . . . 1 1 413 1 . . . 1 1 414 1 . . . 1 1 415 1 . . . 1 1 416 1 . . . 1 1 417 1 . . . 1 1 418 1 . . . 1 1 419 1 . . . 1 1 420 1 . . . 1 1 421 1 . . . 1 1 422 1 . . . 1 1 423 1 . . . 1 1 424 1 . . . 1 1 425 1 . . . 1 1 426 1 . . . 1 1 427 1 . . . 1 1 428 1 . . . 1 1 429 1 . . . 1 1 430 1 . . . 1 1 431 1 . . . 1 1 432 1 . . . 1 1 433 1 . . . 1 1 434 1 . . . 1 1 435 1 . . . 1 1 436 1 . . . 1 1 437 1 . . . 1 1 438 1 . . . 1 1 439 1 . . . 1 1 440 1 . . . 1 1 441 1 . . . 1 1 442 1 . . . 1 1 443 1 . . . 1 1 444 1 . . . 1 1 445 1 . . . 1 1 446 1 . . . 1 1 447 1 . . . 1 1 448 1 . . . 1 1 449 1 . . . 1 1 450 1 . . . 1 1 451 1 . . . 1 1 452 1 . . . 1 1 453 1 . . . 1 1 454 1 . . . 1 1 455 1 . . . 1 1 456 1 . . . 1 1 457 1 . . . 1 1 458 1 . . . 1 1 459 1 . . . 1 1 460 1 . . . 1 1 461 1 . . . 1 1 462 1 . . . 1 1 463 1 . . . 1 1 464 1 . . . 1 1 465 1 . . . 1 1 466 1 . . . 1 1 467 1 . . . 1 1 468 1 . . . 1 1 469 1 . . . 1 1 470 1 . . . 1 1 471 1 . . . 1 1 472 1 . . . 1 1 473 1 . . . 1 1 474 1 . . . 1 1 475 1 . . . 1 1 476 1 . . . 1 1 477 1 . . . 1 1 478 1 . . . 1 1 479 1 . . . 1 1 480 1 . . . 1 1 481 1 . . . 1 1 482 1 . . . 1 1 483 1 . . . 1 1 484 1 . . . 1 1 485 1 . . . 1 1 486 1 . . . 1 1 487 1 . . . 1 1 488 1 . . . 1 1 489 1 . . . 1 1 490 1 . . . 1 1 491 1 . . . 1 1 492 1 . . . 1 1 493 1 . . . 1 1 494 1 . . . 1 1 495 1 . . . 1 1 496 1 . . . 1 1 497 1 . . . 1 1 498 1 . . . 1 1 499 1 . . . 1 1 500 1 . . . 1 1 501 1 . . . 1 1 502 1 . . . 1 1 503 1 . . . 1 1 504 1 . . . 1 1 505 1 . . . 1 1 506 1 . . . 1 1 507 1 . . . 1 1 508 1 . . . 1 1 509 1 . . . 1 1 510 1 . . . 1 1 511 1 . . . 1 1 512 1 . . . 1 1 513 1 . . . 1 1 514 1 . . . 1 1 515 1 . . . 1 1 516 1 . . . 1 1 517 1 . . . 1 1 518 1 . . . 1 1 519 1 . . . 1 1 520 1 . . . 1 1 521 1 . . . 1 1 522 1 . . . 1 1 523 1 . . . 1 1 524 1 . . . 1 1 525 1 . . . 1 1 526 1 . . . 1 1 527 1 . . . 1 1 528 1 . . . 1 1 529 1 . . . 1 1 530 1 . . . 1 1 531 1 . . . 1 1 532 1 . . . 1 1 533 1 . . . 1 1 534 1 . . . 1 1 535 1 . . . 1 1 536 1 . . . 1 1 537 1 . . . 1 1 538 1 . . . 1 1 539 1 . . . 1 1 540 1 . . . 1 1 541 1 . . . 1 1 542 1 . . . 1 1 543 1 . . . 1 1 544 1 . . . 1 1 545 1 . . . 1 1 546 1 . . . 1 1 547 1 . . . 1 1 548 1 . . . 1 1 549 1 . . . 1 1 550 1 . . . 1 1 551 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 GLY HA2 . 1 GLY HA1 1 1 1 1 2 1 1 2 GLU H . 2 GLU HN 1 1 2 1 1 1 1 1 GLY HA3 . 1 GLY HA2 1 1 2 1 2 1 1 2 GLU H . 2 GLU HN 1 1 3 1 1 1 1 1 GLY HA3 . 1 GLY HA2 1 1 3 1 2 1 1 3 CYS H . 3 CYSS HN 1 1 4 1 1 1 1 2 GLU H . 2 GLU HN 1 1 4 1 2 1 1 2 GLU QB . 2 GLU QB 1 1 5 1 1 1 1 2 GLU H . 2 GLU HN 1 1 5 1 2 1 1 2 GLU HG3 . 2 GLU HG2 1 1 6 1 1 1 1 2 GLU H . 2 GLU HN 1 1 6 1 2 1 1 2 GLU HG2 . 2 GLU HG3 1 1 7 1 1 1 1 2 GLU H . 2 GLU HN 1 1 7 1 2 1 1 3 CYS H . 3 CYSS HN 1 1 8 1 1 1 1 2 GLU HA . 2 GLU HA 1 1 8 1 2 1 1 2 GLU QB . 2 GLU QB 1 1 9 1 1 1 1 2 GLU HA . 2 GLU HA 1 1 9 1 2 1 1 2 GLU HG3 . 2 GLU HG2 1 1 10 1 1 1 1 2 GLU HA . 2 GLU HA 1 1 10 1 2 1 1 2 GLU HG2 . 2 GLU HG3 1 1 11 1 1 1 1 2 GLU HA . 2 GLU HA 1 1 11 1 2 1 1 4 GLU H . 4 GLU HN 1 1 12 1 1 1 1 2 GLU HA . 2 GLU HA 1 1 12 1 2 1 1 5 GLN H . 5 GLN HN 1 1 13 1 1 1 1 2 GLU HA . 2 GLU HA 1 1 13 1 2 1 1 5 GLN HB2 . 5 GLN HB2 1 1 14 1 1 1 1 2 GLU HA . 2 GLU HA 1 1 14 1 2 1 1 5 GLN HB3 . 5 GLN HB3 1 1 15 1 1 1 1 2 GLU HA . 2 GLU HA 1 1 15 1 2 1 1 6 CYS H . 6 CYSS HN 1 1 16 1 1 1 1 2 GLU QB . 2 GLU QB 1 1 16 1 2 1 1 3 CYS H . 3 CYSS HN 1 1 17 1 1 1 1 2 GLU QB . 2 GLU QB 1 1 17 1 2 1 1 3 CYS HA . 3 CYSS HA 1 1 18 1 1 1 1 2 GLU QB . 2 GLU QB 1 1 18 1 2 1 1 23 PRO HA . 23 PRO HA 1 1 19 1 1 1 1 2 GLU QB . 2 GLU QB 1 1 19 1 2 1 1 23 PRO HB2 . 23 PRO HB2 1 1 20 1 1 1 1 2 GLU HG3 . 2 GLU HG2 1 1 20 1 2 1 1 3 CYS H . 3 CYSS HN 1 1 21 1 1 1 1 2 GLU HG3 . 2 GLU HG2 1 1 21 1 2 1 1 23 PRO HB2 . 23 PRO HB2 1 1 22 1 1 1 1 2 GLU HG2 . 2 GLU HG3 1 1 22 1 2 1 1 3 CYS H . 3 CYSS HN 1 1 23 1 1 1 1 3 CYS H . 3 CYSS HN 1 1 23 1 2 1 1 3 CYS HB2 . 3 CYSS HB2 1 1 24 1 1 1 1 3 CYS H . 3 CYSS HN 1 1 24 1 2 1 1 3 CYS HB3 . 3 CYSS HB3 1 1 25 1 1 1 1 3 CYS H . 3 CYSS HN 1 1 25 1 2 1 1 4 GLU H . 4 GLU HN 1 1 26 1 1 1 1 3 CYS H . 3 CYSS HN 1 1 26 1 2 1 1 5 GLN H . 5 GLN HN 1 1 27 1 1 1 1 3 CYS H . 3 CYSS HN 1 1 27 1 2 1 1 23 PRO HB2 . 23 PRO HB2 1 1 28 1 1 1 1 3 CYS HA . 3 CYSS HA 1 1 28 1 2 1 1 6 CYS H . 6 CYSS HN 1 1 29 1 1 1 1 3 CYS HA . 3 CYSS HA 1 1 29 1 2 1 1 6 CYS HB2 . 6 CYSS HB2 1 1 30 1 1 1 1 3 CYS HA . 3 CYSS HA 1 1 30 1 2 1 1 23 PRO HB2 . 23 PRO HB2 1 1 31 1 1 1 1 3 CYS HA . 3 CYSS HA 1 1 31 1 2 1 1 23 PRO HG2 . 23 PRO HG2 1 1 32 1 1 1 1 3 CYS HA . 3 CYSS HA 1 1 32 1 2 1 1 24 CYS QB . 24 CYSS QB 1 1 33 1 1 1 1 3 CYS HB2 . 3 CYSS HB2 1 1 33 1 2 1 1 23 PRO HB2 . 23 PRO HB2 1 1 34 1 1 1 1 3 CYS HB2 . 3 CYSS HB2 1 1 34 1 2 1 1 24 CYS QB . 24 CYSS QB 1 1 35 1 1 1 1 4 GLU H . 4 GLU HN 1 1 35 1 2 1 1 4 GLU HB3 . 4 GLU HB3 1 1 36 1 1 1 1 4 GLU H . 4 GLU HN 1 1 36 1 2 1 1 4 GLU HG3 . 4 GLU HG2 1 1 37 1 1 1 1 4 GLU H . 4 GLU HN 1 1 37 1 2 1 1 4 GLU HG2 . 4 GLU HG3 1 1 38 1 1 1 1 4 GLU H . 4 GLU HN 1 1 38 1 2 1 1 5 GLN H . 5 GLN HN 1 1 39 1 1 1 1 4 GLU H . 4 GLU HN 1 1 39 1 2 1 1 6 CYS H . 6 CYSS HN 1 1 40 1 1 1 1 4 GLU H . 4 GLU HN 1 1 40 1 2 1 1 39 ASP HA . 39 ASP HA 1 1 41 1 1 1 1 4 GLU HA . 4 GLU HA 1 1 41 1 2 1 1 4 GLU HG3 . 4 GLU HG2 1 1 42 1 1 1 1 4 GLU HA . 4 GLU HA 1 1 42 1 2 1 1 4 GLU HG2 . 4 GLU HG3 1 1 43 1 1 1 1 4 GLU HA . 4 GLU HA 1 1 43 1 2 1 1 7 PHE HB2 . 7 PHE HB2 1 1 44 1 1 1 1 4 GLU HA . 4 GLU HA 1 1 44 1 2 1 1 7 PHE QD . 7 PHE QD 1 1 45 1 1 1 1 4 GLU HB2 . 4 GLU HB2 1 1 45 1 2 1 1 4 GLU HG2 . 4 GLU HG3 1 1 46 1 1 1 1 4 GLU HB3 . 4 GLU HB3 1 1 46 1 2 1 1 4 GLU HG2 . 4 GLU HG3 1 1 47 1 1 1 1 4 GLU HB3 . 4 GLU HB3 1 1 47 1 2 1 1 5 GLN H . 5 GLN HN 1 1 48 1 1 1 1 4 GLU HB3 . 4 GLU HB3 1 1 48 1 2 1 1 39 ASP HA . 39 ASP HA 1 1 49 1 1 1 1 4 GLU HG3 . 4 GLU HG2 1 1 49 1 2 1 1 39 ASP HA . 39 ASP HA 1 1 50 1 1 1 1 4 GLU HG2 . 4 GLU HG3 1 1 50 1 2 1 1 5 GLN H . 5 GLN HN 1 1 51 1 1 1 1 4 GLU HG2 . 4 GLU HG3 1 1 51 1 2 1 1 39 ASP HA . 39 ASP HA 1 1 52 1 1 1 1 5 GLN H . 5 GLN HN 1 1 52 1 2 1 1 5 GLN HB2 . 5 GLN HB2 1 1 53 1 1 1 1 5 GLN H . 5 GLN HN 1 1 53 1 2 1 1 5 GLN HB3 . 5 GLN HB3 1 1 54 1 1 1 1 5 GLN H . 5 GLN HN 1 1 54 1 2 1 1 5 GLN QG . 5 GLN QG 1 1 55 1 1 1 1 5 GLN H . 5 GLN HN 1 1 55 1 2 1 1 6 CYS H . 6 CYSS HN 1 1 56 1 1 1 1 5 GLN HA . 5 GLN HA 1 1 56 1 2 1 1 5 GLN QG . 5 GLN QG 1 1 57 1 1 1 1 5 GLN HA . 5 GLN HA 1 1 57 1 2 1 1 5 GLN HE21 . 5 GLN HE21 1 1 58 1 1 1 1 5 GLN HA . 5 GLN HA 1 1 58 1 2 1 1 8 SER H . 8 SER HN 1 1 59 1 1 1 1 5 GLN HA . 5 GLN HA 1 1 59 1 2 1 1 9 ASP H . 9 ASP HN 1 1 60 1 1 1 1 5 GLN HB2 . 5 GLN HB2 1 1 60 1 2 1 1 6 CYS H . 6 CYSS HN 1 1 61 1 1 1 1 5 GLN HB2 . 5 GLN HB2 1 1 61 1 2 1 1 8 SER QB . 8 SER QB 1 1 62 1 1 1 1 5 GLN HB3 . 5 GLN HB3 1 1 62 1 2 1 1 6 CYS H . 6 CYSS HN 1 1 63 1 1 1 1 5 GLN HE21 . 5 GLN HE21 1 1 63 1 2 1 1 5 GLN QG . 5 GLN QG 1 1 64 1 1 1 1 5 GLN HE21 . 5 GLN HE21 1 1 64 1 2 1 1 8 SER QB . 8 SER QB 1 1 65 1 1 1 1 5 GLN HE22 . 5 GLN HE22 1 1 65 1 2 1 1 8 SER QB . 8 SER QB 1 1 66 1 1 1 1 6 CYS H . 6 CYSS HN 1 1 66 1 2 1 1 6 CYS HB2 . 6 CYSS HB2 1 1 67 1 1 1 1 6 CYS H . 6 CYSS HN 1 1 67 1 2 1 1 6 CYS HB3 . 6 CYSS HB3 1 1 68 1 1 1 1 6 CYS H . 6 CYSS HN 1 1 68 1 2 1 1 7 PHE H . 7 PHE HN 1 1 69 1 1 1 1 6 CYS H . 6 CYSS HN 1 1 69 1 2 1 1 8 SER H . 8 SER HN 1 1 70 1 1 1 1 6 CYS HA . 6 CYSS HA 1 1 70 1 2 1 1 6 CYS HB2 . 6 CYSS HB2 1 1 71 1 1 1 1 6 CYS HA . 6 CYSS HA 1 1 71 1 2 1 1 8 SER H . 8 SER HN 1 1 72 1 1 1 1 6 CYS HA . 6 CYSS HA 1 1 72 1 2 1 1 9 ASP H . 9 ASP HN 1 1 73 1 1 1 1 6 CYS HA . 6 CYSS HA 1 1 73 1 2 1 1 9 ASP HB2 . 9 ASP HB2 1 1 74 1 1 1 1 6 CYS HA . 6 CYSS HA 1 1 74 1 2 1 1 9 ASP HB3 . 9 ASP HB3 1 1 75 1 1 1 1 6 CYS HA . 6 CYSS HA 1 1 75 1 2 1 1 23 PRO HG3 . 23 PRO HG3 1 1 76 1 1 1 1 6 CYS HB2 . 6 CYSS HB2 1 1 76 1 2 1 1 7 PHE H . 7 PHE HN 1 1 77 1 1 1 1 6 CYS HB2 . 6 CYSS HB2 1 1 77 1 2 1 1 7 PHE QD . 7 PHE QD 1 1 78 1 1 1 1 6 CYS HB2 . 6 CYSS HB2 1 1 78 1 2 1 1 23 PRO HB2 . 23 PRO HB2 1 1 79 1 1 1 1 6 CYS HB2 . 6 CYSS HB2 1 1 79 1 2 1 1 23 PRO HB3 . 23 PRO HB3 1 1 80 1 1 1 1 6 CYS HB2 . 6 CYSS HB2 1 1 80 1 2 1 1 23 PRO HG2 . 23 PRO HG2 1 1 81 1 1 1 1 6 CYS HB2 . 6 CYSS HB2 1 1 81 1 2 1 1 23 PRO HG3 . 23 PRO HG3 1 1 82 1 1 1 1 6 CYS HB3 . 6 CYSS HB3 1 1 82 1 2 1 1 7 PHE H . 7 PHE HN 1 1 83 1 1 1 1 6 CYS HB3 . 6 CYSS HB3 1 1 83 1 2 1 1 7 PHE QD . 7 PHE QD 1 1 84 1 1 1 1 6 CYS HB3 . 6 CYSS HB3 1 1 84 1 2 1 1 23 PRO HB2 . 23 PRO HB2 1 1 85 1 1 1 1 6 CYS HB3 . 6 CYSS HB3 1 1 85 1 2 1 1 23 PRO HG2 . 23 PRO HG2 1 1 86 1 1 1 1 6 CYS HB3 . 6 CYSS HB3 1 1 86 1 2 1 1 23 PRO HG3 . 23 PRO HG3 1 1 87 1 1 1 1 7 PHE H . 7 PHE HN 1 1 87 1 2 1 1 7 PHE HB2 . 7 PHE HB2 1 1 88 1 1 1 1 7 PHE H . 7 PHE HN 1 1 88 1 2 1 1 7 PHE HB3 . 7 PHE HB3 1 1 89 1 1 1 1 7 PHE H . 7 PHE HN 1 1 89 1 2 1 1 7 PHE QD . 7 PHE QD 1 1 90 1 1 1 1 7 PHE H . 7 PHE HN 1 1 90 1 2 1 1 8 SER H . 8 SER HN 1 1 91 1 1 1 1 7 PHE HA . 7 PHE HA 1 1 91 1 2 1 1 7 PHE QD . 7 PHE QD 1 1 92 1 1 1 1 7 PHE HA . 7 PHE HA 1 1 92 1 2 1 1 7 PHE QE . 7 PHE QE 1 1 93 1 1 1 1 7 PHE HA . 7 PHE HA 1 1 93 1 2 1 1 10 GLY H . 10 GLY HN 1 1 94 1 1 1 1 7 PHE HA . 7 PHE HA 1 1 94 1 2 1 1 11 GLY H . 11 GLY HN 1 1 95 1 1 1 1 7 PHE HA . 7 PHE HA 1 1 95 1 2 1 1 11 GLY HA2 . 11 GLY HA2 1 1 96 1 1 1 1 7 PHE HB2 . 7 PHE HB2 1 1 96 1 2 1 1 8 SER H . 8 SER HN 1 1 97 1 1 1 1 7 PHE HB3 . 7 PHE HB3 1 1 97 1 2 1 1 8 SER H . 8 SER HN 1 1 98 1 1 1 1 7 PHE QD . 7 PHE QD 1 1 98 1 2 1 1 12 ASP HA . 12 ASP HA 1 1 99 1 1 1 1 7 PHE QD . 7 PHE QD 1 1 99 1 2 1 1 16 CYS HB2 . 16 CYSS HB2 1 1 100 1 1 1 1 7 PHE QD . 7 PHE QD 1 1 100 1 2 1 1 16 CYS HB3 . 16 CYSS HB3 1 1 101 1 1 1 1 7 PHE QD . 7 PHE QD 1 1 101 1 2 1 1 42 ALA MB . 42 ALA QB 1 1 102 1 1 1 1 7 PHE QD . 7 PHE QD 1 1 102 1 2 1 1 43 PHE HA . 43 PHE HA 1 1 103 1 1 1 1 7 PHE QD . 7 PHE QD 1 1 103 1 2 1 1 43 PHE HB2 . 43 PHE HB2 1 1 104 1 1 1 1 7 PHE QD . 7 PHE QD 1 1 104 1 2 1 1 43 PHE HB3 . 43 PHE HB3 1 1 105 1 1 1 1 7 PHE QE . 7 PHE QE 1 1 105 1 2 1 1 12 ASP HA . 12 ASP HA 1 1 106 1 1 1 1 7 PHE QE . 7 PHE QE 1 1 106 1 2 1 1 43 PHE HA . 43 PHE HA 1 1 107 1 1 1 1 7 PHE HZ . 7 PHE HZ 1 1 107 1 2 1 1 12 ASP HA . 12 ASP HA 1 1 108 1 1 1 1 7 PHE HZ . 7 PHE HZ 1 1 108 1 2 1 1 43 PHE HA . 43 PHE HA 1 1 109 1 1 1 1 7 PHE HZ . 7 PHE HZ 1 1 109 1 2 1 1 43 PHE HB2 . 43 PHE HB2 1 1 110 1 1 1 1 7 PHE HZ . 7 PHE HZ 1 1 110 1 2 1 1 46 GLN HB2 . 46 GLN HB2 1 1 111 1 1 1 1 7 PHE HZ . 7 PHE HZ 1 1 111 1 2 1 1 46 GLN HB3 . 46 GLN HB3 1 1 112 1 1 1 1 8 SER H . 8 SER HN 1 1 112 1 2 1 1 8 SER QB . 8 SER QB 1 1 113 1 1 1 1 8 SER H . 8 SER HN 1 1 113 1 2 1 1 9 ASP H . 9 ASP HN 1 1 114 1 1 1 1 8 SER HA . 8 SER HA 1 1 114 1 2 1 1 8 SER QB . 8 SER QB 1 1 115 1 1 1 1 8 SER HA . 8 SER HA 1 1 115 1 2 1 1 10 GLY H . 10 GLY HN 1 1 116 1 1 1 1 8 SER QB . 8 SER QB 1 1 116 1 2 1 1 9 ASP H . 9 ASP HN 1 1 117 1 1 1 1 9 ASP H . 9 ASP HN 1 1 117 1 2 1 1 9 ASP HB2 . 9 ASP HB2 1 1 118 1 1 1 1 9 ASP H . 9 ASP HN 1 1 118 1 2 1 1 9 ASP HB3 . 9 ASP HB3 1 1 119 1 1 1 1 9 ASP H . 9 ASP HN 1 1 119 1 2 1 1 10 GLY H . 10 GLY HN 1 1 120 1 1 1 1 9 ASP HA . 9 ASP HA 1 1 120 1 2 1 1 9 ASP HB2 . 9 ASP HB2 1 1 121 1 1 1 1 9 ASP HB3 . 9 ASP HB3 1 1 121 1 2 1 1 10 GLY H . 10 GLY HN 1 1 122 1 1 1 1 10 GLY H . 10 GLY HN 1 1 122 1 2 1 1 10 GLY HA2 . 10 GLY HA1 1 1 123 1 1 1 1 10 GLY H . 10 GLY HN 1 1 123 1 2 1 1 11 GLY H . 11 GLY HN 1 1 124 1 1 1 1 11 GLY H . 11 GLY HN 1 1 124 1 2 1 1 11 GLY HA2 . 11 GLY HA2 1 1 125 1 1 1 1 11 GLY HA3 . 11 GLY HA1 1 1 125 1 2 1 1 12 ASP H . 12 ASP HN 1 1 126 1 1 1 1 11 GLY HA3 . 11 GLY HA1 1 1 126 1 2 1 1 15 THR MG . 15 THR QG2 1 1 127 1 1 1 1 11 GLY HA2 . 11 GLY HA2 1 1 127 1 2 1 1 12 ASP H . 12 ASP HN 1 1 128 1 1 1 1 11 GLY HA2 . 11 GLY HA2 1 1 128 1 2 1 1 15 THR MG . 15 THR QG2 1 1 129 1 1 1 1 12 ASP H . 12 ASP HN 1 1 129 1 2 1 1 15 THR H . 15 THR HN 1 1 130 1 1 1 1 12 ASP H . 12 ASP HN 1 1 130 1 2 1 1 15 THR HB . 15 THR HB 1 1 131 1 1 1 1 12 ASP H . 12 ASP HN 1 1 131 1 2 1 1 15 THR MG . 15 THR QG2 1 1 132 1 1 1 1 12 ASP QB . 12 ASP HB2 1 1 132 1 2 1 1 13 CYS H . 13 CYSS HN 1 1 133 1 1 1 1 12 ASP QB . 12 ASP HB3 1 1 133 1 2 1 1 14 THR H . 14 THR HN 1 1 134 1 1 1 1 13 CYS H . 13 CYSS HN 1 1 134 1 2 1 1 13 CYS HB2 . 13 CYSS HB2 1 1 135 1 1 1 1 13 CYS H . 13 CYSS HN 1 1 135 1 2 1 1 13 CYS HB3 . 13 CYSS HB3 1 1 136 1 1 1 1 13 CYS H . 13 CYSS HN 1 1 136 1 2 1 1 14 THR H . 14 THR HN 1 1 137 1 1 1 1 13 CYS HA . 13 CYSS HA 1 1 137 1 2 1 1 16 CYS H . 16 CYSS HN 1 1 138 1 1 1 1 13 CYS HA . 13 CYSS HA 1 1 138 1 2 1 1 16 CYS HB2 . 16 CYSS HB2 1 1 139 1 1 1 1 13 CYS HA . 13 CYSS HA 1 1 139 1 2 1 1 47 CYS QB . 47 CYSS HB3 1 1 140 1 1 1 1 13 CYS HB2 . 13 CYSS HB2 1 1 140 1 2 1 1 14 THR H . 14 THR HN 1 1 141 1 1 1 1 13 CYS HB2 . 13 CYSS HB2 1 1 141 1 2 1 1 47 CYS QB . 47 CYSS HB3 1 1 142 1 1 1 1 13 CYS HB3 . 13 CYSS HB3 1 1 142 1 2 1 1 14 THR H . 14 THR HN 1 1 143 1 1 1 1 13 CYS HB3 . 13 CYSS HB3 1 1 143 1 2 1 1 47 CYS QB . 47 CYSS HB3 1 1 144 1 1 1 1 14 THR H . 14 THR HN 1 1 144 1 2 1 1 14 THR HB . 14 THR HB 1 1 145 1 1 1 1 14 THR H . 14 THR HN 1 1 145 1 2 1 1 14 THR MG . 14 THR QG2 1 1 146 1 1 1 1 14 THR H . 14 THR HN 1 1 146 1 2 1 1 15 THR H . 15 THR HN 1 1 147 1 1 1 1 14 THR HA . 14 THR HA 1 1 147 1 2 1 1 14 THR MG . 14 THR QG2 1 1 148 1 1 1 1 14 THR HB . 14 THR HB 1 1 148 1 2 1 1 15 THR H . 15 THR HN 1 1 149 1 1 1 1 15 THR H . 15 THR HN 1 1 149 1 2 1 1 15 THR HB . 15 THR HB 1 1 150 1 1 1 1 15 THR H . 15 THR HN 1 1 150 1 2 1 1 15 THR MG . 15 THR QG2 1 1 151 1 1 1 1 15 THR H . 15 THR HN 1 1 151 1 2 1 1 16 CYS H . 16 CYSS HN 1 1 152 1 1 1 1 15 THR MG . 15 THR QG2 1 1 152 1 2 1 1 16 CYS H . 16 CYSS HN 1 1 153 1 1 1 1 16 CYS H . 16 CYSS HN 1 1 153 1 2 1 1 16 CYS HB2 . 16 CYSS HB2 1 1 154 1 1 1 1 16 CYS H . 16 CYSS HN 1 1 154 1 2 1 1 16 CYS HB3 . 16 CYSS HB3 1 1 155 1 1 1 1 16 CYS H . 16 CYSS HN 1 1 155 1 2 1 1 17 PHE H . 17 PHE HN 1 1 156 1 1 1 1 16 CYS HA . 16 CYSS HA 1 1 156 1 2 1 1 23 PRO HG2 . 23 PRO HG2 1 1 157 1 1 1 1 16 CYS HA . 16 CYSS HA 1 1 157 1 2 1 1 23 PRO HD2 . 23 PRO HD2 1 1 158 1 1 1 1 16 CYS HA . 16 CYSS HA 1 1 158 1 2 1 1 23 PRO HD3 . 23 PRO HD3 1 1 159 1 1 1 1 16 CYS HB2 . 16 CYSS HB2 1 1 159 1 2 1 1 17 PHE H . 17 PHE HN 1 1 160 1 1 1 1 16 CYS HB2 . 16 CYSS HB2 1 1 160 1 2 1 1 43 PHE QD . 43 PHE QD 1 1 161 1 1 1 1 16 CYS HB3 . 16 CYSS HB3 1 1 161 1 2 1 1 17 PHE H . 17 PHE HN 1 1 162 1 1 1 1 16 CYS HB3 . 16 CYSS HB3 1 1 162 1 2 1 1 23 PRO HG2 . 23 PRO HG2 1 1 163 1 1 1 1 16 CYS HB3 . 16 CYSS HB3 1 1 163 1 2 1 1 23 PRO HG3 . 23 PRO HG3 1 1 164 1 1 1 1 16 CYS HB3 . 16 CYSS HB3 1 1 164 1 2 1 1 23 PRO HD2 . 23 PRO HD2 1 1 165 1 1 1 1 16 CYS HB3 . 16 CYSS HB3 1 1 165 1 2 1 1 24 CYS H . 24 CYSS HN 1 1 166 1 1 1 1 16 CYS HB3 . 16 CYSS HB3 1 1 166 1 2 1 1 24 CYS QB . 24 CYSS QB 1 1 167 1 1 1 1 16 CYS HB3 . 16 CYSS HB3 1 1 167 1 2 1 1 43 PHE QD . 43 PHE QD 1 1 168 1 1 1 1 17 PHE H . 17 PHE HN 1 1 168 1 2 1 1 17 PHE QB . 17 PHE QB 1 1 169 1 1 1 1 17 PHE H . 17 PHE HN 1 1 169 1 2 1 1 18 ASN H . 18 ASN HN 1 1 170 1 1 1 1 17 PHE HA . 17 PHE HA 1 1 170 1 2 1 1 17 PHE QD . 17 PHE QD 1 1 171 1 1 1 1 17 PHE HA . 17 PHE HA 1 1 171 1 2 1 1 17 PHE QE . 17 PHE QE 1 1 172 1 1 1 1 17 PHE HA . 17 PHE HA 1 1 172 1 2 1 1 25 ALA HA . 25 ALA HA 1 1 173 1 1 1 1 17 PHE HA . 17 PHE HA 1 1 173 1 2 1 1 25 ALA MB . 25 ALA QB 1 1 174 1 1 1 1 17 PHE HA . 17 PHE HA 1 1 174 1 2 1 1 43 PHE HZ . 43 PHE HZ 1 1 175 1 1 1 1 17 PHE QB . 17 PHE QB 1 1 175 1 2 1 1 18 ASN H . 18 ASN HN 1 1 176 1 1 1 1 17 PHE QB . 17 PHE QB 1 1 176 1 2 1 1 19 ASN H . 19 ASN HN 1 1 177 1 1 1 1 17 PHE QB . 17 PHE QB 1 1 177 1 2 1 1 43 PHE HZ . 43 PHE HZ 1 1 178 1 1 1 1 17 PHE QD . 17 PHE QD 1 1 178 1 2 1 1 18 ASN H . 18 ASN HN 1 1 179 1 1 1 1 17 PHE QD . 17 PHE QD 1 1 179 1 2 1 1 19 ASN H . 19 ASN HN 1 1 180 1 1 1 1 17 PHE QD . 17 PHE QD 1 1 180 1 2 1 1 19 ASN HA . 19 ASN HA 1 1 181 1 1 1 1 17 PHE QD . 17 PHE QD 1 1 181 1 2 1 1 19 ASN HB2 . 19 ASN HB3 1 1 182 1 1 1 1 17 PHE QD . 17 PHE QD 1 1 182 1 2 1 1 20 GLY H . 20 GLY HN 1 1 183 1 1 1 1 17 PHE QD . 17 PHE QD 1 1 183 1 2 1 1 20 GLY HA3 . 20 GLY HA1 1 1 184 1 1 1 1 17 PHE QD . 17 PHE QD 1 1 184 1 2 1 1 24 CYS QB . 24 CYSS QB 1 1 185 1 1 1 1 17 PHE QD . 17 PHE QD 1 1 185 1 2 1 1 25 ALA HA . 25 ALA HA 1 1 186 1 1 1 1 17 PHE QD . 17 PHE QD 1 1 186 1 2 1 1 25 ALA MB . 25 ALA QB 1 1 187 1 1 1 1 17 PHE QD . 17 PHE QD 1 1 187 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 1 188 1 1 1 1 17 PHE QD . 17 PHE QD 1 1 188 1 2 1 1 28 LEU HG . 28 LEU HG 1 1 189 1 1 1 1 17 PHE QD . 17 PHE QD 1 1 189 1 2 1 1 28 LEU QD . 28 LEU QD1 1 1 190 1 1 1 1 17 PHE QE . 17 PHE QE 1 1 190 1 2 1 1 19 ASN H . 19 ASN HN 1 1 191 1 1 1 1 17 PHE QE . 17 PHE QE 1 1 191 1 2 1 1 19 ASN HA . 19 ASN HA 1 1 192 1 1 1 1 17 PHE QE . 17 PHE QE 1 1 192 1 2 1 1 19 ASN HB2 . 19 ASN HB3 1 1 193 1 1 1 1 17 PHE QE . 17 PHE QE 1 1 193 1 2 1 1 20 GLY H . 20 GLY HN 1 1 194 1 1 1 1 17 PHE QE . 17 PHE QE 1 1 194 1 2 1 1 20 GLY HA3 . 20 GLY HA1 1 1 195 1 1 1 1 17 PHE QE . 17 PHE QE 1 1 195 1 2 1 1 20 GLY HA2 . 20 GLY HA2 1 1 196 1 1 1 1 17 PHE QE . 17 PHE QE 1 1 196 1 2 1 1 25 ALA HA . 25 ALA HA 1 1 197 1 1 1 1 17 PHE QE . 17 PHE QE 1 1 197 1 2 1 1 25 ALA MB . 25 ALA QB 1 1 198 1 1 1 1 17 PHE QE . 17 PHE QE 1 1 198 1 2 1 1 26 ASN HA . 26 ASN HA 1 1 199 1 1 1 1 17 PHE QE . 17 PHE QE 1 1 199 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 1 200 1 1 1 1 17 PHE QE . 17 PHE QE 1 1 200 1 2 1 1 28 LEU HB3 . 28 LEU HB3 1 1 201 1 1 1 1 17 PHE QE . 17 PHE QE 1 1 201 1 2 1 1 28 LEU HG . 28 LEU HG 1 1 202 1 1 1 1 17 PHE QE . 17 PHE QE 1 1 202 1 2 1 1 28 LEU QD . 28 LEU QD1 1 1 203 1 1 1 1 17 PHE HZ . 17 PHE HZ 1 1 203 1 2 1 1 19 ASN HA . 19 ASN HA 1 1 204 1 1 1 1 17 PHE HZ . 17 PHE HZ 1 1 204 1 2 1 1 20 GLY H . 20 GLY HN 1 1 205 1 1 1 1 17 PHE HZ . 17 PHE HZ 1 1 205 1 2 1 1 20 GLY HA3 . 20 GLY HA1 1 1 206 1 1 1 1 17 PHE HZ . 17 PHE HZ 1 1 206 1 2 1 1 20 GLY HA2 . 20 GLY HA2 1 1 207 1 1 1 1 17 PHE HZ . 17 PHE HZ 1 1 207 1 2 1 1 25 ALA HA . 25 ALA HA 1 1 208 1 1 1 1 17 PHE HZ . 17 PHE HZ 1 1 208 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 1 209 1 1 1 1 17 PHE HZ . 17 PHE HZ 1 1 209 1 2 1 1 28 LEU HB3 . 28 LEU HB3 1 1 210 1 1 1 1 17 PHE HZ . 17 PHE HZ 1 1 210 1 2 1 1 28 LEU HG . 28 LEU HG 1 1 211 1 1 1 1 17 PHE HZ . 17 PHE HZ 1 1 211 1 2 1 1 28 LEU QD . 28 LEU QD1 1 1 212 1 1 1 1 17 PHE HZ . 17 PHE HZ 1 1 212 1 2 1 1 29 ALA MB . 29 ALA QB 1 1 213 1 1 1 1 18 ASN H . 18 ASN HN 1 1 213 1 2 1 1 18 ASN HA . 18 ASN HA 1 1 214 1 1 1 1 18 ASN H . 18 ASN HN 1 1 214 1 2 1 1 18 ASN HB2 . 18 ASN HB2 1 1 215 1 1 1 1 18 ASN H . 18 ASN HN 1 1 215 1 2 1 1 19 ASN H . 19 ASN HN 1 1 216 1 1 1 1 18 ASN HA . 18 ASN HA 1 1 216 1 2 1 1 19 ASN HB2 . 19 ASN HB3 1 1 217 1 1 1 1 18 ASN HB2 . 18 ASN HB2 1 1 217 1 2 1 1 22 GLY H . 22 GLY HN 1 1 218 1 1 1 1 18 ASN HB2 . 18 ASN HB2 1 1 218 1 2 1 1 22 GLY HA3 . 22 GLY HA1 1 1 219 1 1 1 1 18 ASN HB2 . 18 ASN HB2 1 1 219 1 2 1 1 22 GLY HA2 . 22 GLY HA2 1 1 220 1 1 1 1 18 ASN HB3 . 18 ASN HB3 1 1 220 1 2 1 1 18 ASN HD21 . 18 ASN HD21 1 1 221 1 1 1 1 18 ASN HB3 . 18 ASN HB3 1 1 221 1 2 1 1 19 ASN H . 19 ASN HN 1 1 222 1 1 1 1 18 ASN HB3 . 18 ASN HB3 1 1 222 1 2 1 1 19 ASN HA . 19 ASN HA 1 1 223 1 1 1 1 18 ASN HB3 . 18 ASN HB3 1 1 223 1 2 1 1 22 GLY H . 22 GLY HN 1 1 224 1 1 1 1 18 ASN HB3 . 18 ASN HB3 1 1 224 1 2 1 1 22 GLY HA3 . 22 GLY HA1 1 1 225 1 1 1 1 19 ASN H . 19 ASN HN 1 1 225 1 2 1 1 19 ASN HA . 19 ASN HA 1 1 226 1 1 1 1 19 ASN H . 19 ASN HN 1 1 226 1 2 1 1 19 ASN HB3 . 19 ASN HB2 1 1 227 1 1 1 1 19 ASN H . 19 ASN HN 1 1 227 1 2 1 1 20 GLY H . 20 GLY HN 1 1 228 1 1 1 1 19 ASN HA . 19 ASN HA 1 1 228 1 2 1 1 19 ASN HB2 . 19 ASN HB3 1 1 229 1 1 1 1 19 ASN HA . 19 ASN HA 1 1 229 1 2 1 1 20 GLY H . 20 GLY HN 1 1 230 1 1 1 1 19 ASN HB3 . 19 ASN HB2 1 1 230 1 2 1 1 19 ASN HD21 . 19 ASN HD21 1 1 231 1 1 1 1 20 GLY H . 20 GLY HN 1 1 231 1 2 1 1 20 GLY HA2 . 20 GLY HA2 1 1 232 1 1 1 1 20 GLY H . 20 GLY HN 1 1 232 1 2 1 1 21 THR H . 21 THR HN 1 1 233 1 1 1 1 20 GLY H . 20 GLY HN 1 1 233 1 2 1 1 22 GLY H . 22 GLY HN 1 1 234 1 1 1 1 20 GLY H . 20 GLY HN 1 1 234 1 2 1 1 25 ALA MB . 25 ALA QB 1 1 235 1 1 1 1 20 GLY HA3 . 20 GLY HA1 1 1 235 1 2 1 1 25 ALA MB . 25 ALA QB 1 1 236 1 1 1 1 20 GLY HA2 . 20 GLY HA2 1 1 236 1 2 1 1 21 THR H . 21 THR HN 1 1 237 1 1 1 1 21 THR H . 21 THR HN 1 1 237 1 2 1 1 21 THR MG . 21 THR QG2 1 1 238 1 1 1 1 21 THR H . 21 THR HN 1 1 238 1 2 1 1 22 GLY H . 22 GLY HN 1 1 239 1 1 1 1 21 THR H . 21 THR HN 1 1 239 1 2 1 1 25 ALA MB . 25 ALA QB 1 1 240 1 1 1 1 21 THR HA . 21 THR HA 1 1 240 1 2 1 1 21 THR HB . 21 THR HB 1 1 241 1 1 1 1 21 THR HA . 21 THR HA 1 1 241 1 2 1 1 21 THR MG . 21 THR QG2 1 1 242 1 1 1 1 21 THR HA . 21 THR HA 1 1 242 1 2 1 1 25 ALA MB . 25 ALA QB 1 1 243 1 1 1 1 21 THR HB . 21 THR HB 1 1 243 1 2 1 1 22 GLY H . 22 GLY HN 1 1 244 1 1 1 1 21 THR MG . 21 THR QG2 1 1 244 1 2 1 1 22 GLY H . 22 GLY HN 1 1 245 1 1 1 1 22 GLY H . 22 GLY HN 1 1 245 1 2 1 1 22 GLY HA2 . 22 GLY HA2 1 1 246 1 1 1 1 22 GLY H . 22 GLY HN 1 1 246 1 2 1 1 25 ALA MB . 25 ALA QB 1 1 247 1 1 1 1 22 GLY HA3 . 22 GLY HA1 1 1 247 1 2 1 1 23 PRO HG3 . 23 PRO HG3 1 1 248 1 1 1 1 22 GLY HA3 . 22 GLY HA1 1 1 248 1 2 1 1 23 PRO HD3 . 23 PRO HD3 1 1 249 1 1 1 1 22 GLY HA2 . 22 GLY HA2 1 1 249 1 2 1 1 23 PRO HG2 . 23 PRO HG2 1 1 250 1 1 1 1 22 GLY HA2 . 22 GLY HA2 1 1 250 1 2 1 1 23 PRO HD2 . 23 PRO HD2 1 1 251 1 1 1 1 22 GLY HA2 . 22 GLY HA2 1 1 251 1 2 1 1 23 PRO HD3 . 23 PRO HD3 1 1 252 1 1 1 1 22 GLY HA2 . 22 GLY HA2 1 1 252 1 2 1 1 25 ALA MB . 25 ALA QB 1 1 253 1 1 1 1 23 PRO HB2 . 23 PRO HB2 1 1 253 1 2 1 1 24 CYS H . 24 CYSS HN 1 1 254 1 1 1 1 23 PRO HB2 . 23 PRO HB2 1 1 254 1 2 1 1 24 CYS HA . 24 CYSS HA 1 1 255 1 1 1 1 23 PRO HG2 . 23 PRO HG2 1 1 255 1 2 1 1 24 CYS H . 24 CYSS HN 1 1 256 1 1 1 1 23 PRO HD2 . 23 PRO HD2 1 1 256 1 2 1 1 24 CYS H . 24 CYSS HN 1 1 257 1 1 1 1 23 PRO HD3 . 23 PRO HD3 1 1 257 1 2 1 1 24 CYS H . 24 CYSS HN 1 1 258 1 1 1 1 24 CYS H . 24 CYSS HN 1 1 258 1 2 1 1 24 CYS QB . 24 CYSS QB 1 1 259 1 1 1 1 24 CYS H . 24 CYSS HN 1 1 259 1 2 1 1 25 ALA H . 25 ALA HN 1 1 260 1 1 1 1 24 CYS H . 24 CYSS HN 1 1 260 1 2 1 1 25 ALA MB . 25 ALA QB 1 1 261 1 1 1 1 24 CYS QB . 24 CYSS QB 1 1 261 1 2 1 1 25 ALA H . 25 ALA HN 1 1 262 1 1 1 1 24 CYS QB . 24 CYSS QB 1 1 262 1 2 1 1 43 PHE HB2 . 43 PHE HB2 1 1 263 1 1 1 1 24 CYS QB . 24 CYSS QB 1 1 263 1 2 1 1 43 PHE HB3 . 43 PHE HB3 1 1 264 1 1 1 1 24 CYS QB . 24 CYSS QB 1 1 264 1 2 1 1 43 PHE QD . 43 PHE QD 1 1 265 1 1 1 1 24 CYS QB . 24 CYSS QB 1 1 265 1 2 1 1 43 PHE HZ . 43 PHE HZ 1 1 266 1 1 1 1 25 ALA H . 25 ALA HN 1 1 266 1 2 1 1 25 ALA MB . 25 ALA QB 1 1 267 1 1 1 1 25 ALA H . 25 ALA HN 1 1 267 1 2 1 1 26 ASN H . 26 ASN HN 1 1 268 1 1 1 1 25 ALA HA . 25 ALA HA 1 1 268 1 2 1 1 27 CYS H . 27 CYSS HN 1 1 269 1 1 1 1 25 ALA HA . 25 ALA HA 1 1 269 1 2 1 1 28 LEU H . 28 LEU HN 1 1 270 1 1 1 1 25 ALA HA . 25 ALA HA 1 1 270 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 1 271 1 1 1 1 25 ALA HA . 25 ALA HA 1 1 271 1 2 1 1 28 LEU QD . 28 LEU QD1 1 1 272 1 1 1 1 25 ALA MB . 25 ALA QB 1 1 272 1 2 1 1 26 ASN H . 26 ASN HN 1 1 273 1 1 1 1 25 ALA MB . 25 ALA QB 1 1 273 1 2 1 1 26 ASN HA . 26 ASN HA 1 1 274 1 1 1 1 25 ALA MB . 25 ALA QB 1 1 274 1 2 1 1 27 CYS H . 27 CYSS HN 1 1 275 1 1 1 1 25 ALA MB . 25 ALA QB 1 1 275 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 1 276 1 1 1 1 26 ASN H . 26 ASN HN 1 1 276 1 2 1 1 26 ASN QB . 26 ASN QB 1 1 277 1 1 1 1 26 ASN H . 26 ASN HN 1 1 277 1 2 1 1 26 ASN HD22 . 26 ASN HD22 1 1 278 1 1 1 1 26 ASN H . 26 ASN HN 1 1 278 1 2 1 1 27 CYS H . 27 CYSS HN 1 1 279 1 1 1 1 26 ASN H . 26 ASN HN 1 1 279 1 2 1 1 28 LEU H . 28 LEU HN 1 1 280 1 1 1 1 26 ASN HA . 26 ASN HA 1 1 280 1 2 1 1 26 ASN QB . 26 ASN QB 1 1 281 1 1 1 1 26 ASN HA . 26 ASN HA 1 1 281 1 2 1 1 28 LEU H . 28 LEU HN 1 1 282 1 1 1 1 26 ASN HA . 26 ASN HA 1 1 282 1 2 1 1 29 ALA H . 29 ALA HN 1 1 283 1 1 1 1 26 ASN HA . 26 ASN HA 1 1 283 1 2 1 1 29 ALA MB . 29 ALA QB 1 1 284 1 1 1 1 26 ASN QB . 26 ASN QB 1 1 284 1 2 1 1 27 CYS H . 27 CYSS HN 1 1 285 1 1 1 1 26 ASN QB . 26 ASN QB 1 1 285 1 2 1 1 27 CYS HA . 27 CYSS HA 1 1 286 1 1 1 1 26 ASN QB . 26 ASN QB 1 1 286 1 2 1 1 29 ALA MB . 29 ALA QB 1 1 287 1 1 1 1 27 CYS H . 27 CYSS HN 1 1 287 1 2 1 1 27 CYS HB2 . 27 CYSS HB2 1 1 288 1 1 1 1 27 CYS H . 27 CYSS HN 1 1 288 1 2 1 1 27 CYS HB3 . 27 CYSS HB3 1 1 289 1 1 1 1 27 CYS H . 27 CYSS HN 1 1 289 1 2 1 1 28 LEU H . 28 LEU HN 1 1 290 1 1 1 1 27 CYS HA . 27 CYSS HA 1 1 290 1 2 1 1 40 CYS HB3 . 40 CYSS HB3 1 1 291 1 1 1 1 27 CYS HA . 27 CYSS HA 1 1 291 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 292 1 1 1 1 27 CYS HB2 . 27 CYSS HB2 1 1 292 1 2 1 1 28 LEU H . 28 LEU HN 1 1 293 1 1 1 1 27 CYS HB2 . 27 CYSS HB2 1 1 293 1 2 1 1 28 LEU HA . 28 LEU HA 1 1 294 1 1 1 1 27 CYS HB2 . 27 CYSS HB2 1 1 294 1 2 1 1 28 LEU QD . 28 LEU QD2 1 1 295 1 1 1 1 27 CYS HB2 . 27 CYSS HB2 1 1 295 1 2 1 1 40 CYS HB3 . 40 CYSS HB3 1 1 296 1 1 1 1 27 CYS HB2 . 27 CYSS HB2 1 1 296 1 2 1 1 44 LEU H . 44 LEU HN 1 1 297 1 1 1 1 27 CYS HB2 . 27 CYSS HB2 1 1 297 1 2 1 1 44 LEU HG . 44 LEU HG 1 1 298 1 1 1 1 27 CYS HB2 . 27 CYSS HB2 1 1 298 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 299 1 1 1 1 27 CYS HB2 . 27 CYSS HB2 1 1 299 1 2 1 1 44 LEU MD2 . 44 LEU QD2 1 1 300 1 1 1 1 27 CYS HB3 . 27 CYSS HB3 1 1 300 1 2 1 1 28 LEU QD . 28 LEU QD2 1 1 301 1 1 1 1 27 CYS HB3 . 27 CYSS HB3 1 1 301 1 2 1 1 44 LEU HG . 44 LEU HG 1 1 302 1 1 1 1 27 CYS HB3 . 27 CYSS HB3 1 1 302 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 303 1 1 1 1 27 CYS HB3 . 27 CYSS HB3 1 1 303 1 2 1 1 44 LEU MD2 . 44 LEU QD2 1 1 304 1 1 1 1 28 LEU H . 28 LEU HN 1 1 304 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 1 305 1 1 1 1 28 LEU H . 28 LEU HN 1 1 305 1 2 1 1 28 LEU HG . 28 LEU HG 1 1 306 1 1 1 1 28 LEU H . 28 LEU HN 1 1 306 1 2 1 1 28 LEU QD . 28 LEU QD1 1 1 307 1 1 1 1 28 LEU H . 28 LEU HN 1 1 307 1 2 1 1 29 ALA H . 29 ALA HN 1 1 308 1 1 1 1 28 LEU H . 28 LEU HN 1 1 308 1 2 1 1 29 ALA MB . 29 ALA QB 1 1 309 1 1 1 1 28 LEU H . 28 LEU HN 1 1 309 1 2 1 1 44 LEU MD2 . 44 LEU QD2 1 1 310 1 1 1 1 28 LEU HA . 28 LEU HA 1 1 310 1 2 1 1 28 LEU QD . 28 LEU QD1 1 1 311 1 1 1 1 28 LEU HA . 28 LEU HA 1 1 311 1 2 1 1 31 TYR HB2 . 31 TYR HB2 1 1 312 1 1 1 1 28 LEU HA . 28 LEU HA 1 1 312 1 2 1 1 31 TYR HB3 . 31 TYR HB3 1 1 313 1 1 1 1 28 LEU HA . 28 LEU HA 1 1 313 1 2 1 1 31 TYR QD . 31 TYR QD 1 1 314 1 1 1 1 28 LEU HA . 28 LEU HA 1 1 314 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 315 1 1 1 1 28 LEU HA . 28 LEU HA 1 1 315 1 2 1 1 44 LEU MD2 . 44 LEU QD2 1 1 316 1 1 1 1 28 LEU HA . 28 LEU HA 1 1 316 1 2 1 1 48 TYR QE . 48 TYR QE 1 1 317 1 1 1 1 28 LEU HB2 . 28 LEU HB2 1 1 317 1 2 1 1 28 LEU HG . 28 LEU HG 1 1 318 1 1 1 1 28 LEU HB2 . 28 LEU HB2 1 1 318 1 2 1 1 28 LEU QD . 28 LEU QD1 1 1 319 1 1 1 1 28 LEU HB2 . 28 LEU HB2 1 1 319 1 2 1 1 29 ALA H . 29 ALA HN 1 1 320 1 1 1 1 28 LEU HB2 . 28 LEU HB2 1 1 320 1 2 1 1 29 ALA MB . 29 ALA QB 1 1 321 1 1 1 1 28 LEU HB2 . 28 LEU HB2 1 1 321 1 2 1 1 31 TYR HB3 . 31 TYR HB3 1 1 322 1 1 1 1 28 LEU HB2 . 28 LEU HB2 1 1 322 1 2 1 1 48 TYR QE . 48 TYR QE 1 1 323 1 1 1 1 28 LEU HB3 . 28 LEU HB3 1 1 323 1 2 1 1 29 ALA H . 29 ALA HN 1 1 324 1 1 1 1 28 LEU HB3 . 28 LEU HB3 1 1 324 1 2 1 1 48 TYR QE . 48 TYR QE 1 1 325 1 1 1 1 28 LEU HG . 28 LEU HG 1 1 325 1 2 1 1 29 ALA H . 29 ALA HN 1 1 326 1 1 1 1 28 LEU HG . 28 LEU HG 1 1 326 1 2 1 1 43 PHE HZ . 43 PHE HZ 1 1 327 1 1 1 1 28 LEU HG . 28 LEU HG 1 1 327 1 2 1 1 48 TYR QE . 48 TYR QE 1 1 328 1 1 1 1 28 LEU QD . 28 LEU QD1 1 1 328 1 2 1 1 31 TYR HB3 . 31 TYR HB3 1 1 329 1 1 1 1 28 LEU QD . 28 LEU QD1 1 1 329 1 2 1 1 31 TYR QD . 31 TYR QD 1 1 330 1 1 1 1 28 LEU QD . 28 LEU QD1 1 1 330 1 2 1 1 31 TYR QE . 31 TYR QE 1 1 331 1 1 1 1 28 LEU QD . 28 LEU QD1 1 1 331 1 2 1 1 43 PHE HZ . 43 PHE HZ 1 1 332 1 1 1 1 28 LEU QD . 28 LEU QD1 1 1 332 1 2 1 1 44 LEU MD2 . 44 LEU QD2 1 1 333 1 1 1 1 28 LEU QD . 28 LEU QD1 1 1 333 1 2 1 1 48 TYR QD . 48 TYR QD 1 1 334 1 1 1 1 28 LEU QD . 28 LEU QD1 1 1 334 1 2 1 1 48 TYR QE . 48 TYR QE 1 1 335 1 1 1 1 28 LEU QD . 28 LEU QD2 1 1 335 1 2 1 1 43 PHE QD . 43 PHE QD 1 1 336 1 1 1 1 28 LEU QD . 28 LEU QD2 1 1 336 1 2 1 1 44 LEU HA . 44 LEU HA 1 1 337 1 1 1 1 29 ALA H . 29 ALA HN 1 1 337 1 2 1 1 29 ALA MB . 29 ALA QB 1 1 338 1 1 1 1 29 ALA MB . 29 ALA QB 1 1 338 1 2 1 1 30 GLY H . 30 GLY HN 1 1 339 1 1 1 1 29 ALA MB . 29 ALA QB 1 1 339 1 2 1 1 30 GLY HA2 . 30 GLY HA1 1 1 340 1 1 1 1 29 ALA MB . 29 ALA QB 1 1 340 1 2 1 1 30 GLY HA3 . 30 GLY HA2 1 1 341 1 1 1 1 31 TYR H . 31 TYR HN 1 1 341 1 2 1 1 31 TYR HB3 . 31 TYR HB3 1 1 342 1 1 1 1 31 TYR H . 31 TYR HN 1 1 342 1 2 1 1 31 TYR QD . 31 TYR QD 1 1 343 1 1 1 1 31 TYR H . 31 TYR HN 1 1 343 1 2 1 1 33 ALA H . 33 ALA HN 1 1 344 1 1 1 1 31 TYR HA . 31 TYR HA 1 1 344 1 2 1 1 31 TYR HB3 . 31 TYR HB3 1 1 345 1 1 1 1 31 TYR HA . 31 TYR HA 1 1 345 1 2 1 1 31 TYR QD . 31 TYR QD 1 1 346 1 1 1 1 31 TYR HA . 31 TYR HA 1 1 346 1 2 1 1 33 ALA MB . 33 ALA QB 1 1 347 1 1 1 1 31 TYR HA . 31 TYR HA 1 1 347 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 348 1 1 1 1 31 TYR HB2 . 31 TYR HB2 1 1 348 1 2 1 1 32 PRO QD . 32 PRO QD 1 1 349 1 1 1 1 31 TYR HB2 . 31 TYR HB2 1 1 349 1 2 1 1 48 TYR QE . 48 TYR QE 1 1 350 1 1 1 1 31 TYR HB3 . 31 TYR HB3 1 1 350 1 2 1 1 44 LEU MD2 . 44 LEU QD2 1 1 351 1 1 1 1 31 TYR QD . 31 TYR QD 1 1 351 1 2 1 1 32 PRO HA . 32 PRO HA 1 1 352 1 1 1 1 31 TYR QD . 31 TYR QD 1 1 352 1 2 1 1 32 PRO HB3 . 32 PRO HB3 1 1 353 1 1 1 1 31 TYR QD . 31 TYR QD 1 1 353 1 2 1 1 32 PRO HG3 . 32 PRO HG3 1 1 354 1 1 1 1 31 TYR QD . 31 TYR QD 1 1 354 1 2 1 1 32 PRO QD . 32 PRO QD 1 1 355 1 1 1 1 31 TYR QD . 31 TYR QD 1 1 355 1 2 1 1 33 ALA H . 33 ALA HN 1 1 356 1 1 1 1 31 TYR QD . 31 TYR QD 1 1 356 1 2 1 1 44 LEU HB3 . 44 LEU HB3 1 1 357 1 1 1 1 31 TYR QD . 31 TYR QD 1 1 357 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 358 1 1 1 1 31 TYR QD . 31 TYR QD 1 1 358 1 2 1 1 44 LEU MD2 . 44 LEU QD2 1 1 359 1 1 1 1 31 TYR QD . 31 TYR QD 1 1 359 1 2 1 1 48 TYR QD . 48 TYR QD 1 1 360 1 1 1 1 31 TYR QD . 31 TYR QD 1 1 360 1 2 1 1 48 TYR QE . 48 TYR QE 1 1 361 1 1 1 1 31 TYR QE . 31 TYR QE 1 1 361 1 2 1 1 32 PRO HA . 32 PRO HA 1 1 362 1 1 1 1 31 TYR QE . 31 TYR QE 1 1 362 1 2 1 1 44 LEU HB2 . 44 LEU HB2 1 1 363 1 1 1 1 31 TYR QE . 31 TYR QE 1 1 363 1 2 1 1 44 LEU HB3 . 44 LEU HB3 1 1 364 1 1 1 1 31 TYR QE . 31 TYR QE 1 1 364 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 365 1 1 1 1 31 TYR QE . 31 TYR QE 1 1 365 1 2 1 1 44 LEU MD2 . 44 LEU QD2 1 1 366 1 1 1 1 31 TYR QE . 31 TYR QE 1 1 366 1 2 1 1 48 TYR HA . 48 TYR HA 1 1 367 1 1 1 1 31 TYR QE . 31 TYR QE 1 1 367 1 2 1 1 48 TYR HB2 . 48 TYR HB2 1 1 368 1 1 1 1 31 TYR QE . 31 TYR QE 1 1 368 1 2 1 1 50 GLY HA3 . 50 GLY HA1 1 1 369 1 1 1 1 31 TYR QE . 31 TYR QE 1 1 369 1 2 1 1 51 CYS H . 51 CYSS HN 1 1 370 1 1 1 1 31 TYR QE . 31 TYR QE 1 1 370 1 2 1 1 51 CYS HA . 51 CYSS HA 1 1 371 1 1 1 1 32 PRO HA . 32 PRO HA 1 1 371 1 2 1 1 33 ALA MB . 33 ALA QB 1 1 372 1 1 1 1 32 PRO HA . 32 PRO HA 1 1 372 1 2 1 1 34 GLY H . 34 GLY HN 1 1 373 1 1 1 1 32 PRO HG2 . 32 PRO HG2 1 1 373 1 2 1 1 33 ALA H . 33 ALA HN 1 1 374 1 1 1 1 32 PRO QD . 32 PRO QD 1 1 374 1 2 1 1 33 ALA H . 33 ALA HN 1 1 375 1 1 1 1 33 ALA H . 33 ALA HN 1 1 375 1 2 1 1 33 ALA MB . 33 ALA QB 1 1 376 1 1 1 1 33 ALA H . 33 ALA HN 1 1 376 1 2 1 1 34 GLY H . 34 GLY HN 1 1 377 1 1 1 1 33 ALA HA . 33 ALA HA 1 1 377 1 2 1 1 35 CYS H . 35 CYSS HN 1 1 378 1 1 1 1 33 ALA MB . 33 ALA QB 1 1 378 1 2 1 1 34 GLY H . 34 GLY HN 1 1 379 1 1 1 1 33 ALA MB . 33 ALA QB 1 1 379 1 2 1 1 35 CYS H . 35 CYSS HN 1 1 380 1 1 1 1 34 GLY H . 34 GLY HN 1 1 380 1 2 1 1 35 CYS H . 35 CYSS HN 1 1 381 1 1 1 1 34 GLY H . 34 GLY HN 1 1 381 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 382 1 1 1 1 34 GLY HA3 . 34 GLY HA1 1 1 382 1 2 1 1 36 SER H . 36 SER HN 1 1 383 1 1 1 1 34 GLY HA3 . 34 GLY HA1 1 1 383 1 2 1 1 37 ASN H . 37 ASN HN 1 1 384 1 1 1 1 34 GLY HA3 . 34 GLY HA1 1 1 384 1 2 1 1 37 ASN HB2 . 37 ASN HB2 1 1 385 1 1 1 1 34 GLY HA3 . 34 GLY HA1 1 1 385 1 2 1 1 37 ASN HB3 . 37 ASN HB3 1 1 386 1 1 1 1 34 GLY HA3 . 34 GLY HA1 1 1 386 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 387 1 1 1 1 34 GLY HA2 . 34 GLY HA2 1 1 387 1 2 1 1 37 ASN HB2 . 37 ASN HB2 1 1 388 1 1 1 1 34 GLY HA2 . 34 GLY HA2 1 1 388 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 389 1 1 1 1 35 CYS H . 35 CYSS HN 1 1 389 1 2 1 1 35 CYS QB . 35 CYSS HB2 1 1 390 1 1 1 1 35 CYS H . 35 CYSS HN 1 1 390 1 2 1 1 36 SER H . 36 SER HN 1 1 391 1 1 1 1 35 CYS H . 35 CYSS HN 1 1 391 1 2 1 1 44 LEU HB2 . 44 LEU HB2 1 1 392 1 1 1 1 35 CYS H . 35 CYSS HN 1 1 392 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 393 1 1 1 1 35 CYS HA . 35 CYSS HA 1 1 393 1 2 1 1 37 ASN H . 37 ASN HN 1 1 394 1 1 1 1 35 CYS HA . 35 CYSS HA 1 1 394 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 395 1 1 1 1 35 CYS QB . 35 CYSS HB2 1 1 395 1 2 1 1 36 SER H . 36 SER HN 1 1 396 1 1 1 1 35 CYS QB . 35 CYSS HB2 1 1 396 1 2 1 1 36 SER HA . 36 SER HA 1 1 397 1 1 1 1 35 CYS QB . 35 CYSS HB2 1 1 397 1 2 1 1 41 THR MG . 41 THR QG2 1 1 398 1 1 1 1 35 CYS QB . 35 CYSS HB3 1 1 398 1 2 1 1 36 SER QB . 36 SER HB2 1 1 399 1 1 1 1 36 SER H . 36 SER HN 1 1 399 1 2 1 1 36 SER QB . 36 SER HB2 1 1 400 1 1 1 1 36 SER HA . 36 SER HA 1 1 400 1 2 1 1 37 ASN H . 37 ASN HN 1 1 401 1 1 1 1 36 SER QB . 36 SER HB2 1 1 401 1 2 1 1 37 ASN H . 37 ASN HN 1 1 402 1 1 1 1 37 ASN H . 37 ASN HN 1 1 402 1 2 1 1 37 ASN HB2 . 37 ASN HB2 1 1 403 1 1 1 1 37 ASN H . 37 ASN HN 1 1 403 1 2 1 1 37 ASN HB3 . 37 ASN HB3 1 1 404 1 1 1 1 37 ASN H . 37 ASN HN 1 1 404 1 2 1 1 38 SER H . 38 SER HN 1 1 405 1 1 1 1 37 ASN HA . 37 ASN HA 1 1 405 1 2 1 1 38 SER H . 38 SER HN 1 1 406 1 1 1 1 37 ASN HB2 . 37 ASN HB2 1 1 406 1 2 1 1 37 ASN HD21 . 37 ASN HD21 1 1 407 1 1 1 1 37 ASN HB2 . 37 ASN HB2 1 1 407 1 2 1 1 40 CYS H . 40 CYSS HN 1 1 408 1 1 1 1 37 ASN HB2 . 37 ASN HB2 1 1 408 1 2 1 1 40 CYS HB2 . 40 CYSS HB2 1 1 409 1 1 1 1 37 ASN HB3 . 37 ASN HB3 1 1 409 1 2 1 1 37 ASN HD21 . 37 ASN HD21 1 1 410 1 1 1 1 37 ASN HB3 . 37 ASN HB3 1 1 410 1 2 1 1 38 SER H . 38 SER HN 1 1 411 1 1 1 1 37 ASN HB3 . 37 ASN HB3 1 1 411 1 2 1 1 40 CYS HB2 . 40 CYSS HB2 1 1 412 1 1 1 1 37 ASN HD21 . 37 ASN HD21 1 1 412 1 2 1 1 39 ASP H . 39 ASP HN 1 1 413 1 1 1 1 37 ASN HD22 . 37 ASN HD22 1 1 413 1 2 1 1 39 ASP H . 39 ASP HN 1 1 414 1 1 1 1 37 ASN HD22 . 37 ASN HD22 1 1 414 1 2 1 1 39 ASP HB3 . 39 ASP HB3 1 1 415 1 1 1 1 38 SER H . 38 SER HN 1 1 415 1 2 1 1 38 SER HB2 . 38 SER HB2 1 1 416 1 1 1 1 38 SER H . 38 SER HN 1 1 416 1 2 1 1 38 SER HB3 . 38 SER HB3 1 1 417 1 1 1 1 38 SER H . 38 SER HN 1 1 417 1 2 1 1 39 ASP H . 39 ASP HN 1 1 418 1 1 1 1 38 SER HA . 38 SER HA 1 1 418 1 2 1 1 38 SER HB2 . 38 SER HB2 1 1 419 1 1 1 1 38 SER HA . 38 SER HA 1 1 419 1 2 1 1 38 SER HB3 . 38 SER HB3 1 1 420 1 1 1 1 38 SER HA . 38 SER HA 1 1 420 1 2 1 1 40 CYS H . 40 CYSS HN 1 1 421 1 1 1 1 38 SER HA . 38 SER HA 1 1 421 1 2 1 1 41 THR H . 41 THR HN 1 1 422 1 1 1 1 38 SER HA . 38 SER HA 1 1 422 1 2 1 1 41 THR MG . 41 THR QG2 1 1 423 1 1 1 1 38 SER HB2 . 38 SER HB2 1 1 423 1 2 1 1 39 ASP H . 39 ASP HN 1 1 424 1 1 1 1 39 ASP H . 39 ASP HN 1 1 424 1 2 1 1 39 ASP HB2 . 39 ASP HB2 1 1 425 1 1 1 1 39 ASP H . 39 ASP HN 1 1 425 1 2 1 1 39 ASP HB3 . 39 ASP HB3 1 1 426 1 1 1 1 39 ASP H . 39 ASP HN 1 1 426 1 2 1 1 40 CYS H . 40 CYSS HN 1 1 427 1 1 1 1 39 ASP HB2 . 39 ASP HB2 1 1 427 1 2 1 1 40 CYS H . 40 CYSS HN 1 1 428 1 1 1 1 39 ASP HB3 . 39 ASP HB3 1 1 428 1 2 1 1 40 CYS H . 40 CYSS HN 1 1 429 1 1 1 1 40 CYS H . 40 CYSS HN 1 1 429 1 2 1 1 40 CYS HB2 . 40 CYSS HB2 1 1 430 1 1 1 1 40 CYS H . 40 CYSS HN 1 1 430 1 2 1 1 40 CYS HB3 . 40 CYSS HB3 1 1 431 1 1 1 1 40 CYS H . 40 CYSS HN 1 1 431 1 2 1 1 41 THR H . 41 THR HN 1 1 432 1 1 1 1 40 CYS H . 40 CYSS HN 1 1 432 1 2 1 1 41 THR MG . 41 THR QG2 1 1 433 1 1 1 1 40 CYS H . 40 CYSS HN 1 1 433 1 2 1 1 42 ALA H . 42 ALA HN 1 1 434 1 1 1 1 40 CYS HA . 40 CYSS HA 1 1 434 1 2 1 1 43 PHE H . 43 PHE HN 1 1 435 1 1 1 1 40 CYS HA . 40 CYSS HA 1 1 435 1 2 1 1 43 PHE HB2 . 43 PHE HB2 1 1 436 1 1 1 1 40 CYS HA . 40 CYSS HA 1 1 436 1 2 1 1 43 PHE HB3 . 43 PHE HB3 1 1 437 1 1 1 1 40 CYS HA . 40 CYSS HA 1 1 437 1 2 1 1 44 LEU H . 44 LEU HN 1 1 438 1 1 1 1 40 CYS HA . 40 CYSS HA 1 1 438 1 2 1 1 44 LEU HG . 44 LEU HG 1 1 439 1 1 1 1 40 CYS HA . 40 CYSS HA 1 1 439 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 440 1 1 1 1 40 CYS HB2 . 40 CYSS HB2 1 1 440 1 2 1 1 41 THR H . 41 THR HN 1 1 441 1 1 1 1 40 CYS HB2 . 40 CYSS HB2 1 1 441 1 2 1 1 44 LEU HG . 44 LEU HG 1 1 442 1 1 1 1 40 CYS HB2 . 40 CYSS HB2 1 1 442 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 443 1 1 1 1 40 CYS HB3 . 40 CYSS HB3 1 1 443 1 2 1 1 41 THR H . 41 THR HN 1 1 444 1 1 1 1 40 CYS HB3 . 40 CYSS HB3 1 1 444 1 2 1 1 41 THR HA . 41 THR HA 1 1 445 1 1 1 1 40 CYS HB3 . 40 CYSS HB3 1 1 445 1 2 1 1 44 LEU HG . 44 LEU HG 1 1 446 1 1 1 1 40 CYS HB3 . 40 CYSS HB3 1 1 446 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 447 1 1 1 1 40 CYS HB3 . 40 CYSS HB3 1 1 447 1 2 1 1 44 LEU MD2 . 44 LEU QD2 1 1 448 1 1 1 1 41 THR H . 41 THR HN 1 1 448 1 2 1 1 41 THR HB . 41 THR HB 1 1 449 1 1 1 1 41 THR H . 41 THR HN 1 1 449 1 2 1 1 41 THR MG . 41 THR QG2 1 1 450 1 1 1 1 41 THR H . 41 THR HN 1 1 450 1 2 1 1 42 ALA H . 42 ALA HN 1 1 451 1 1 1 1 41 THR H . 41 THR HN 1 1 451 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 452 1 1 1 1 41 THR HA . 41 THR HA 1 1 452 1 2 1 1 41 THR MG . 41 THR QG2 1 1 453 1 1 1 1 41 THR HA . 41 THR HA 1 1 453 1 2 1 1 44 LEU HB2 . 44 LEU HB2 1 1 454 1 1 1 1 41 THR HA . 41 THR HA 1 1 454 1 2 1 1 44 LEU HG . 44 LEU HG 1 1 455 1 1 1 1 41 THR HA . 41 THR HA 1 1 455 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 456 1 1 1 1 41 THR HA . 41 THR HA 1 1 456 1 2 1 1 45 SER H . 45 SER HN 1 1 457 1 1 1 1 41 THR HB . 41 THR HB 1 1 457 1 2 1 1 42 ALA H . 42 ALA HN 1 1 458 1 1 1 1 41 THR HB . 41 THR HB 1 1 458 1 2 1 1 42 ALA MB . 42 ALA QB 1 1 459 1 1 1 1 41 THR MG . 41 THR QG2 1 1 459 1 2 1 1 42 ALA H . 42 ALA HN 1 1 460 1 1 1 1 41 THR MG . 41 THR QG2 1 1 460 1 2 1 1 42 ALA HA . 42 ALA HA 1 1 461 1 1 1 1 41 THR MG . 41 THR QG2 1 1 461 1 2 1 1 43 PHE H . 43 PHE HN 1 1 462 1 1 1 1 41 THR MG . 41 THR QG2 1 1 462 1 2 1 1 45 SER H . 45 SER HN 1 1 463 1 1 1 1 41 THR MG . 41 THR QG2 1 1 463 1 2 1 1 45 SER HB2 . 45 SER HB2 1 1 464 1 1 1 1 41 THR MG . 41 THR QG2 1 1 464 1 2 1 1 45 SER HB3 . 45 SER HB3 1 1 465 1 1 1 1 42 ALA H . 42 ALA HN 1 1 465 1 2 1 1 42 ALA MB . 42 ALA QB 1 1 466 1 1 1 1 42 ALA HA . 42 ALA HA 1 1 466 1 2 1 1 45 SER H . 45 SER HN 1 1 467 1 1 1 1 42 ALA HA . 42 ALA HA 1 1 467 1 2 1 1 45 SER HB2 . 45 SER HB2 1 1 468 1 1 1 1 42 ALA HA . 42 ALA HA 1 1 468 1 2 1 1 45 SER HB3 . 45 SER HB3 1 1 469 1 1 1 1 42 ALA MB . 42 ALA QB 1 1 469 1 2 1 1 43 PHE H . 43 PHE HN 1 1 470 1 1 1 1 42 ALA MB . 42 ALA QB 1 1 470 1 2 1 1 43 PHE HA . 43 PHE HA 1 1 471 1 1 1 1 42 ALA MB . 42 ALA QB 1 1 471 1 2 1 1 45 SER HB2 . 45 SER HB2 1 1 472 1 1 1 1 42 ALA MB . 42 ALA QB 1 1 472 1 2 1 1 46 GLN HE21 . 46 GLN HE21 1 1 473 1 1 1 1 42 ALA MB . 42 ALA QB 1 1 473 1 2 1 1 46 GLN HE22 . 46 GLN HE22 1 1 474 1 1 1 1 43 PHE H . 43 PHE HN 1 1 474 1 2 1 1 43 PHE HB2 . 43 PHE HB2 1 1 475 1 1 1 1 43 PHE H . 43 PHE HN 1 1 475 1 2 1 1 43 PHE HB3 . 43 PHE HB3 1 1 476 1 1 1 1 43 PHE H . 43 PHE HN 1 1 476 1 2 1 1 44 LEU H . 44 LEU HN 1 1 477 1 1 1 1 43 PHE HA . 43 PHE HA 1 1 477 1 2 1 1 46 GLN HB2 . 46 GLN HB2 1 1 478 1 1 1 1 43 PHE HA . 43 PHE HA 1 1 478 1 2 1 1 47 CYS H . 47 CYSS HN 1 1 479 1 1 1 1 43 PHE HB2 . 43 PHE HB2 1 1 479 1 2 1 1 44 LEU H . 44 LEU HN 1 1 480 1 1 1 1 43 PHE HB3 . 43 PHE HB3 1 1 480 1 2 1 1 44 LEU H . 44 LEU HN 1 1 481 1 1 1 1 43 PHE HB3 . 43 PHE HB3 1 1 481 1 2 1 1 44 LEU HA . 44 LEU HA 1 1 482 1 1 1 1 43 PHE QD . 43 PHE QD 1 1 482 1 2 1 1 44 LEU HG . 44 LEU HG 1 1 483 1 1 1 1 43 PHE QD . 43 PHE QD 1 1 483 1 2 1 1 44 LEU MD2 . 44 LEU QD2 1 1 484 1 1 1 1 43 PHE HZ . 43 PHE HZ 1 1 484 1 2 1 1 44 LEU MD2 . 44 LEU QD2 1 1 485 1 1 1 1 44 LEU H . 44 LEU HN 1 1 485 1 2 1 1 44 LEU HB2 . 44 LEU HB2 1 1 486 1 1 1 1 44 LEU H . 44 LEU HN 1 1 486 1 2 1 1 44 LEU HB3 . 44 LEU HB3 1 1 487 1 1 1 1 44 LEU H . 44 LEU HN 1 1 487 1 2 1 1 44 LEU HG . 44 LEU HG 1 1 488 1 1 1 1 44 LEU H . 44 LEU HN 1 1 488 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 489 1 1 1 1 44 LEU H . 44 LEU HN 1 1 489 1 2 1 1 44 LEU MD2 . 44 LEU QD2 1 1 490 1 1 1 1 44 LEU H . 44 LEU HN 1 1 490 1 2 1 1 45 SER H . 45 SER HN 1 1 491 1 1 1 1 44 LEU HA . 44 LEU HA 1 1 491 1 2 1 1 44 LEU HB3 . 44 LEU HB3 1 1 492 1 1 1 1 44 LEU HA . 44 LEU HA 1 1 492 1 2 1 1 44 LEU HG . 44 LEU HG 1 1 493 1 1 1 1 44 LEU HA . 44 LEU HA 1 1 493 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 494 1 1 1 1 44 LEU HA . 44 LEU HA 1 1 494 1 2 1 1 44 LEU MD2 . 44 LEU QD2 1 1 495 1 1 1 1 44 LEU HA . 44 LEU HA 1 1 495 1 2 1 1 47 CYS H . 47 CYSS HN 1 1 496 1 1 1 1 44 LEU HA . 44 LEU HA 1 1 496 1 2 1 1 47 CYS QB . 47 CYSS HB2 1 1 497 1 1 1 1 44 LEU HA . 44 LEU HA 1 1 497 1 2 1 1 48 TYR H . 48 TYR HN 1 1 498 1 1 1 1 44 LEU HA . 44 LEU HA 1 1 498 1 2 1 1 48 TYR QD . 48 TYR QD 1 1 499 1 1 1 1 44 LEU HA . 44 LEU HA 1 1 499 1 2 1 1 48 TYR QE . 48 TYR QE 1 1 500 1 1 1 1 44 LEU HB2 . 44 LEU HB2 1 1 500 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 501 1 1 1 1 44 LEU HB2 . 44 LEU HB2 1 1 501 1 2 1 1 45 SER H . 45 SER HN 1 1 502 1 1 1 1 44 LEU HB3 . 44 LEU HB3 1 1 502 1 2 1 1 44 LEU MD1 . 44 LEU QD1 1 1 503 1 1 1 1 44 LEU HB3 . 44 LEU HB3 1 1 503 1 2 1 1 44 LEU MD2 . 44 LEU QD2 1 1 504 1 1 1 1 44 LEU HB3 . 44 LEU HB3 1 1 504 1 2 1 1 45 SER H . 45 SER HN 1 1 505 1 1 1 1 44 LEU HB3 . 44 LEU HB3 1 1 505 1 2 1 1 48 TYR HB2 . 48 TYR HB2 1 1 506 1 1 1 1 44 LEU HG . 44 LEU HG 1 1 506 1 2 1 1 45 SER H . 45 SER HN 1 1 507 1 1 1 1 44 LEU MD2 . 44 LEU QD2 1 1 507 1 2 1 1 48 TYR HB2 . 48 TYR HB2 1 1 508 1 1 1 1 44 LEU MD2 . 44 LEU QD2 1 1 508 1 2 1 1 48 TYR QD . 48 TYR QD 1 1 509 1 1 1 1 44 LEU MD2 . 44 LEU QD2 1 1 509 1 2 1 1 48 TYR QE . 48 TYR QE 1 1 510 1 1 1 1 45 SER H . 45 SER HN 1 1 510 1 2 1 1 45 SER HB2 . 45 SER HB2 1 1 511 1 1 1 1 45 SER H . 45 SER HN 1 1 511 1 2 1 1 45 SER HB3 . 45 SER HB3 1 1 512 1 1 1 1 45 SER H . 45 SER HN 1 1 512 1 2 1 1 46 GLN H . 46 GLN HN 1 1 513 1 1 1 1 45 SER HA . 45 SER HA 1 1 513 1 2 1 1 49 GLY H . 49 GLY HN 1 1 514 1 1 1 1 45 SER HA . 45 SER HA 1 1 514 1 2 1 1 50 GLY H . 50 GLY HN 1 1 515 1 1 1 1 45 SER HA . 45 SER HA 1 1 515 1 2 1 1 50 GLY HA3 . 50 GLY HA1 1 1 516 1 1 1 1 45 SER HA . 45 SER HA 1 1 516 1 2 1 1 50 GLY HA2 . 50 GLY HA2 1 1 517 1 1 1 1 45 SER HB2 . 45 SER HB2 1 1 517 1 2 1 1 46 GLN H . 46 GLN HN 1 1 518 1 1 1 1 45 SER HB3 . 45 SER HB3 1 1 518 1 2 1 1 46 GLN H . 46 GLN HN 1 1 519 1 1 1 1 46 GLN H . 46 GLN HN 1 1 519 1 2 1 1 46 GLN HB2 . 46 GLN HB2 1 1 520 1 1 1 1 46 GLN H . 46 GLN HN 1 1 520 1 2 1 1 46 GLN HG2 . 46 GLN HG2 1 1 521 1 1 1 1 46 GLN H . 46 GLN HN 1 1 521 1 2 1 1 46 GLN HG3 . 46 GLN HG3 1 1 522 1 1 1 1 46 GLN H . 46 GLN HN 1 1 522 1 2 1 1 47 CYS H . 47 CYSS HN 1 1 523 1 1 1 1 46 GLN HA . 46 GLN HA 1 1 523 1 2 1 1 46 GLN HG2 . 46 GLN HG2 1 1 524 1 1 1 1 46 GLN HA . 46 GLN HA 1 1 524 1 2 1 1 46 GLN HG3 . 46 GLN HG3 1 1 525 1 1 1 1 46 GLN HB2 . 46 GLN HB2 1 1 525 1 2 1 1 47 CYS H . 47 CYSS HN 1 1 526 1 1 1 1 46 GLN HB3 . 46 GLN HB3 1 1 526 1 2 1 1 46 GLN HG2 . 46 GLN HG2 1 1 527 1 1 1 1 46 GLN HB3 . 46 GLN HB3 1 1 527 1 2 1 1 47 CYS H . 47 CYSS HN 1 1 528 1 1 1 1 46 GLN HB3 . 46 GLN HB3 1 1 528 1 2 1 1 47 CYS HA . 47 CYSS HA 1 1 529 1 1 1 1 47 CYS H . 47 CYSS HN 1 1 529 1 2 1 1 48 TYR H . 48 TYR HN 1 1 530 1 1 1 1 47 CYS H . 47 CYSS HN 1 1 530 1 2 1 1 48 TYR QD . 48 TYR QD 1 1 531 1 1 1 1 47 CYS H . 47 CYSS HN 1 1 531 1 2 1 1 49 GLY H . 49 GLY HN 1 1 532 1 1 1 1 47 CYS QB . 47 CYSS HB2 1 1 532 1 2 1 1 48 TYR H . 48 TYR HN 1 1 533 1 1 1 1 47 CYS QB . 47 CYSS HB2 1 1 533 1 2 1 1 48 TYR QD . 48 TYR QD 1 1 534 1 1 1 1 47 CYS QB . 47 CYSS HB2 1 1 534 1 2 1 1 48 TYR QE . 48 TYR QE 1 1 535 1 1 1 1 48 TYR H . 48 TYR HN 1 1 535 1 2 1 1 48 TYR HB2 . 48 TYR HB2 1 1 536 1 1 1 1 48 TYR H . 48 TYR HN 1 1 536 1 2 1 1 48 TYR QD . 48 TYR QD 1 1 537 1 1 1 1 48 TYR H . 48 TYR HN 1 1 537 1 2 1 1 49 GLY H . 49 GLY HN 1 1 538 1 1 1 1 48 TYR H . 48 TYR HN 1 1 538 1 2 1 1 50 GLY H . 50 GLY HN 1 1 539 1 1 1 1 48 TYR HA . 48 TYR HA 1 1 539 1 2 1 1 48 TYR HB3 . 48 TYR HB3 1 1 540 1 1 1 1 48 TYR HA . 48 TYR HA 1 1 540 1 2 1 1 48 TYR QD . 48 TYR QD 1 1 541 1 1 1 1 48 TYR HA . 48 TYR HA 1 1 541 1 2 1 1 48 TYR QE . 48 TYR QE 1 1 542 1 1 1 1 48 TYR HB2 . 48 TYR HB2 1 1 542 1 2 1 1 49 GLY H . 49 GLY HN 1 1 543 1 1 1 1 48 TYR HB2 . 48 TYR HB2 1 1 543 1 2 1 1 50 GLY H . 50 GLY HN 1 1 544 1 1 1 1 48 TYR HB3 . 48 TYR HB3 1 1 544 1 2 1 1 49 GLY H . 49 GLY HN 1 1 545 1 1 1 1 48 TYR HB3 . 48 TYR HB3 1 1 545 1 2 1 1 50 GLY H . 50 GLY HN 1 1 546 1 1 1 1 49 GLY H . 49 GLY HN 1 1 546 1 2 1 1 49 GLY HA2 . 49 GLY HA1 1 1 547 1 1 1 1 49 GLY H . 49 GLY HN 1 1 547 1 2 1 1 50 GLY H . 50 GLY HN 1 1 548 1 1 1 1 50 GLY HA3 . 50 GLY HA1 1 1 548 1 2 1 1 51 CYS H . 51 CYSS HN 1 1 549 1 1 1 1 51 CYS H . 51 CYSS HN 1 1 549 1 2 1 1 51 CYS HA . 51 CYSS HA 1 1 550 1 1 1 1 51 CYS H . 51 CYSS HN 1 1 550 1 2 1 1 51 CYS HB3 . 51 CYSS HB3 1 1 551 1 1 1 1 51 CYS HA . 51 CYSS HA 1 1 551 1 2 1 1 51 CYS HB2 . 51 CYSS HB2 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 3.37 1 1 2 1 . . . . . . . 2.89 1 1 3 1 . . . . . . . 4.64 1 1 4 1 . . . . . . . 2.92 1 1 5 1 . . . . . . . 3.58 1 1 6 1 . . . . . . . 3.47 1 1 7 1 . . . . . . . 3.53 1 1 8 1 . . . . . . . 2.75 1 1 9 1 . . . . . . . 3.99 1 1 10 1 . . . . . . . 3.49 1 1 11 1 . . . . . . . 4.97 1 1 12 1 . . . . . . . 4.03 1 1 13 1 . . . . . . . 3.35 1 1 14 1 . . . . . . . 3.15 1 1 15 1 . . . . . . . 5.17 1 1 16 1 . . . . . . . 3.77 1 1 17 1 . . . . . . . 4.19 1 1 18 1 . . . . . . . 4.45 1 1 19 1 . . . . . . . 3.06 1 1 20 1 . . . . . . . 4.55 1 1 21 1 . . . . . . . 4.18 1 1 22 1 . . . . . . . 4.63 1 1 23 1 . . . . . . . 3.29 1 1 24 1 . . . . . . . 3.02 1 1 25 1 . . . . . . . 3.18 1 1 26 1 . . . . . . . 4.96 1 1 27 1 . . . . . . . 5.11 1 1 28 1 . . . . . . . 5.29 1 1 29 1 . . . . . . . 3.56 1 1 30 1 . . . . . . . 3.33 1 1 31 1 . . . . . . . 4.1 1 1 32 1 . . . . . . . 3.67 1 1 33 1 . . . . . . . 4.47 1 1 34 1 . . . . . . . 4.06 1 1 35 1 . . . . . . . 3.38 1 1 36 1 . . . . . . . 3.08 1 1 37 1 . . . . . . . 4.16 1 1 38 1 . . . . . . . 3.32 1 1 39 1 . . . . . . . 5.17 1 1 40 1 . . . . . . . 5.5 1 1 41 1 . . . . . . . 3.7 1 1 42 1 . . . . . . . 3.29 1 1 43 1 . . . . . . . 3.96 1 1 44 1 . . . . . . . 4.2 1 1 45 1 . . . . . . . 2.93 1 1 46 1 . . . . . . . 3.05 1 1 47 1 . . . . . . . 3.69 1 1 48 1 . . . . . . . 5.36 1 1 49 1 . . . . . . . 2.97 1 1 50 1 . . . . . . . 5.5 1 1 51 1 . . . . . . . 4.06 1 1 52 1 . . . . . . . 3.06 1 1 53 1 . . . . . . . 3.16 1 1 54 1 . . . . . . . 4.12 1 1 55 1 . . . . . . . 3.41 1 1 56 1 . . . . . . . 3.36 1 1 57 1 . . . . . . . 5.25 1 1 58 1 . . . . . . . 3.62 1 1 59 1 . . . . . . . 4.64 1 1 60 1 . . . . . . . 4.06 1 1 61 1 . . . . . . . 4.99 1 1 62 1 . . . . . . . 3.41 1 1 63 1 . . . . . . . 3.23 1 1 64 1 . . . . . . . 5.0 1 1 65 1 . . . . . . . 4.64 1 1 66 1 . . . . . . . 2.97 1 1 67 1 . . . . . . . 2.92 1 1 68 1 . . . . . . . 5.5 1 1 69 1 . . . . . . . 4.54 1 1 70 1 . . . . . . . 2.95 1 1 71 1 . . . . . . . 4.65 1 1 72 1 . . . . . . . 4.51 1 1 73 1 . . . . . . . 4.51 1 1 74 1 . . . . . . . 3.59 1 1 75 1 . . . . . . . 5.13 1 1 76 1 . . . . . . . 4.45 1 1 77 1 . . . . . . . 5.38 1 1 78 1 . . . . . . . 3.49 1 1 79 1 . . . . . . . 4.39 1 1 80 1 . . . . . . . 3.38 1 1 81 1 . . . . . . . 3.27 1 1 82 1 . . . . . . . 3.33 1 1 83 1 . . . . . . . 4.43 1 1 84 1 . . . . . . . 4.58 1 1 85 1 . . . . . . . 3.92 1 1 86 1 . . . . . . . 4.11 1 1 87 1 . . . . . . . 2.87 1 1 88 1 . . . . . . . 3.55 1 1 89 1 . . . . . . . 3.25 1 1 90 1 . . . . . . . 3.23 1 1 91 1 . . . . . . . 4.0 1 1 92 1 . . . . . . . 5.5 1 1 93 1 . . . . . . . 4.33 1 1 94 1 . . . . . . . 3.31 1 1 95 1 . . . . . . . 3.66 1 1 96 1 . . . . . . . 3.54 1 1 97 1 . . . . . . . 3.99 1 1 98 1 . . . . . . . 4.42 1 1 99 1 . . . . . . . 5.5 1 1 100 1 . . . . . . . 5.0 1 1 101 1 . . . . . . . 4.46 1 1 102 1 . . . . . . . 5.5 1 1 103 1 . . . . . . . 4.53 1 1 104 1 . . . . . . . 4.83 1 1 105 1 . . . . . . . 3.57 1 1 106 1 . . . . . . . 4.68 1 1 107 1 . . . . . . . 4.81 1 1 108 1 . . . . . . . 4.26 1 1 109 1 . . . . . . . 4.48 1 1 110 1 . . . . . . . 4.36 1 1 111 1 . . . . . . . 4.18 1 1 112 1 . . . . . . . 2.96 1 1 113 1 . . . . . . . 3.28 1 1 114 1 . . . . . . . 2.79 1 1 115 1 . . . . . . . 4.39 1 1 116 1 . . . . . . . 3.44 1 1 117 1 . . . . . . . 3.75 1 1 118 1 . . . . . . . 2.87 1 1 119 1 . . . . . . . 3.39 1 1 120 1 . . . . . . . 3.04 1 1 121 1 . . . . . . . 5.4 1 1 122 1 . . . . . . . 2.89 1 1 123 1 . . . . . . . 2.86 1 1 124 1 . . . . . . . 2.87 1 1 125 1 . . . . . . . 3.12 1 1 126 1 . . . . . . . 4.06 1 1 127 1 . . . . . . . 3.21 1 1 128 1 . . . . . . . 3.78 1 1 129 1 . . . . . . . 4.12 1 1 130 1 . . . . . . . 4.27 1 1 131 1 . . . . . . . 4.09 1 1 132 1 . . . . . . . 2.71 1 1 133 1 . . . . . . . 4.25 1 1 134 1 . . . . . . . 3.09 1 1 135 1 . . . . . . . 3.98 1 1 136 1 . . . . . . . 3.33 1 1 137 1 . . . . . . . 4.64 1 1 138 1 . . . . . . . 4.51 1 1 139 1 . . . . . . . 5.37 1 1 140 1 . . . . . . . 3.49 1 1 141 1 . . . . . . . 4.11 1 1 142 1 . . . . . . . 4.52 1 1 143 1 . . . . . . . 3.32 1 1 144 1 . . . . . . . 2.94 1 1 145 1 . . . . . . . 3.8 1 1 146 1 . . . . . . . 3.17 1 1 147 1 . . . . . . . 2.98 1 1 148 1 . . . . . . . 3.06 1 1 149 1 . . . . . . . 4.16 1 1 150 1 . . . . . . . 3.24 1 1 151 1 . . . . . . . 3.47 1 1 152 1 . . . . . . . 4.43 1 1 153 1 . . . . . . . 3.1 1 1 154 1 . . . . . . . 3.95 1 1 155 1 . . . . . . . 3.34 1 1 156 1 . . . . . . . 4.06 1 1 157 1 . . . . . . . 3.06 1 1 158 1 . . . . . . . 3.66 1 1 159 1 . . . . . . . 4.26 1 1 160 1 . . . . . . . 4.16 1 1 161 1 . . . . . . . 5.06 1 1 162 1 . . . . . . . 4.06 1 1 163 1 . . . . . . . 4.59 1 1 164 1 . . . . . . . 4.83 1 1 165 1 . . . . . . . 4.49 1 1 166 1 . . . . . . . 3.68 1 1 167 1 . . . . . . . 4.23 1 1 168 1 . . . . . . . 2.82 1 1 169 1 . . . . . . . 3.17 1 1 170 1 . . . . . . . 3.04 1 1 171 1 . . . . . . . 4.55 1 1 172 1 . . . . . . . 5.5 1 1 173 1 . . . . . . . 3.43 1 1 174 1 . . . . . . . 4.69 1 1 175 1 . . . . . . . 3.35 1 1 176 1 . . . . . . . 5.01 1 1 177 1 . . . . . . . 3.12 1 1 178 1 . . . . . . . 4.78 1 1 179 1 . . . . . . . 3.37 1 1 180 1 . . . . . . . 3.79 1 1 181 1 . . . . . . . 3.99 1 1 182 1 . . . . . . . 3.96 1 1 183 1 . . . . . . . 4.05 1 1 184 1 . . . . . . . 4.26 1 1 185 1 . . . . . . . 2.91 1 1 186 1 . . . . . . . 3.44 1 1 187 1 . . . . . . . 5.28 1 1 188 1 . . . . . . . 4.2 1 1 189 1 . . . . . . . 3.61 1 1 190 1 . . . . . . . 4.28 1 1 191 1 . . . . . . . 3.4 1 1 192 1 . . . . . . . 4.69 1 1 193 1 . . . . . . . 3.83 1 1 194 1 . . . . . . . 4.24 1 1 195 1 . . . . . . . 3.65 1 1 196 1 . . . . . . . 3.24 1 1 197 1 . . . . . . . 3.4 1 1 198 1 . . . . . . . 4.86 1 1 199 1 . . . . . . . 3.9 1 1 200 1 . . . . . . . 4.58 1 1 201 1 . . . . . . . 4.41 1 1 202 1 . . . . . . . 3.23 1 1 203 1 . . . . . . . 4.72 1 1 204 1 . . . . . . . 5.02 1 1 205 1 . . . . . . . 4.42 1 1 206 1 . . . . . . . 3.29 1 1 207 1 . . . . . . . 4.8 1 1 208 1 . . . . . . . 3.82 1 1 209 1 . . . . . . . 5.37 1 1 210 1 . . . . . . . 4.52 1 1 211 1 . . . . . . . 4.64 1 1 212 1 . . . . . . . 4.42 1 1 213 1 . . . . . . . 2.71 1 1 214 1 . . . . . . . 3.58 1 1 215 1 . . . . . . . 3.86 1 1 216 1 . . . . . . . 4.56 1 1 217 1 . . . . . . . 4.56 1 1 218 1 . . . . . . . 4.27 1 1 219 1 . . . . . . . 3.54 1 1 220 1 . . . . . . . 3.2 1 1 221 1 . . . . . . . 5.47 1 1 222 1 . . . . . . . 5.25 1 1 223 1 . . . . . . . 3.26 1 1 224 1 . . . . . . . 3.73 1 1 225 1 . . . . . . . 2.65 1 1 226 1 . . . . . . . 4.01 1 1 227 1 . . . . . . . 3.73 1 1 228 1 . . . . . . . 2.99 1 1 229 1 . . . . . . . 3.36 1 1 230 1 . . . . . . . 3.67 1 1 231 1 . . . . . . . 2.84 1 1 232 1 . . . . . . . 3.09 1 1 233 1 . . . . . . . 4.38 1 1 234 1 . . . . . . . 4.27 1 1 235 1 . . . . . . . 3.86 1 1 236 1 . . . . . . . 3.58 1 1 237 1 . . . . . . . 3.28 1 1 238 1 . . . . . . . 2.75 1 1 239 1 . . . . . . . 3.31 1 1 240 1 . . . . . . . 2.8 1 1 241 1 . . . . . . . 2.99 1 1 242 1 . . . . . . . 3.89 1 1 243 1 . . . . . . . 4.78 1 1 244 1 . . . . . . . 5.07 1 1 245 1 . . . . . . . 2.88 1 1 246 1 . . . . . . . 3.27 1 1 247 1 . . . . . . . 4.91 1 1 248 1 . . . . . . . 2.8 1 1 249 1 . . . . . . . 5.01 1 1 250 1 . . . . . . . 3.04 1 1 251 1 . . . . . . . 3.24 1 1 252 1 . . . . . . . 3.76 1 1 253 1 . . . . . . . 3.9 1 1 254 1 . . . . . . . 4.93 1 1 255 1 . . . . . . . 3.69 1 1 256 1 . . . . . . . 5.1 1 1 257 1 . . . . . . . 3.86 1 1 258 1 . . . . . . . 2.96 1 1 259 1 . . . . . . . 4.24 1 1 260 1 . . . . . . . 4.39 1 1 261 1 . . . . . . . 4.17 1 1 262 1 . . . . . . . 4.39 1 1 263 1 . . . . . . . 4.04 1 1 264 1 . . . . . . . 4.86 1 1 265 1 . . . . . . . 3.9 1 1 266 1 . . . . . . . 2.76 1 1 267 1 . . . . . . . 3.45 1 1 268 1 . . . . . . . 4.36 1 1 269 1 . . . . . . . 5.1 1 1 270 1 . . . . . . . 4.4 1 1 271 1 . . . . . . . 3.97 1 1 272 1 . . . . . . . 3.3 1 1 273 1 . . . . . . . 4.27 1 1 274 1 . . . . . . . 4.23 1 1 275 1 . . . . . . . 4.47 1 1 276 1 . . . . . . . 2.87 1 1 277 1 . . . . . . . 5.24 1 1 278 1 . . . . . . . 3.46 1 1 279 1 . . . . . . . 4.66 1 1 280 1 . . . . . . . 2.73 1 1 281 1 . . . . . . . 4.08 1 1 282 1 . . . . . . . 3.89 1 1 283 1 . . . . . . . 3.66 1 1 284 1 . . . . . . . 4.08 1 1 285 1 . . . . . . . 4.85 1 1 286 1 . . . . . . . 4.75 1 1 287 1 . . . . . . . 2.97 1 1 288 1 . . . . . . . 4.19 1 1 289 1 . . . . . . . 3.06 1 1 290 1 . . . . . . . 4.22 1 1 291 1 . . . . . . . 4.66 1 1 292 1 . . . . . . . 4.04 1 1 293 1 . . . . . . . 4.93 1 1 294 1 . . . . . . . 5.45 1 1 295 1 . . . . . . . 3.73 1 1 296 1 . . . . . . . 5.5 1 1 297 1 . . . . . . . 4.19 1 1 298 1 . . . . . . . 4.25 1 1 299 1 . . . . . . . 3.92 1 1 300 1 . . . . . . . 5.11 1 1 301 1 . . . . . . . 3.24 1 1 302 1 . . . . . . . 3.3 1 1 303 1 . . . . . . . 3.41 1 1 304 1 . . . . . . . 2.88 1 1 305 1 . . . . . . . 3.61 1 1 306 1 . . . . . . . 4.27 1 1 307 1 . . . . . . . 3.02 1 1 308 1 . . . . . . . 4.68 1 1 309 1 . . . . . . . 4.99 1 1 310 1 . . . . . . . 3.18 1 1 311 1 . . . . . . . 5.5 1 1 312 1 . . . . . . . 3.89 1 1 313 1 . . . . . . . 3.9 1 1 314 1 . . . . . . . 5.02 1 1 315 1 . . . . . . . 3.48 1 1 316 1 . . . . . . . 4.42 1 1 317 1 . . . . . . . 2.47 1 1 318 1 . . . . . . . 3.24 1 1 319 1 . . . . . . . 4.12 1 1 320 1 . . . . . . . 3.96 1 1 321 1 . . . . . . . 5.37 1 1 322 1 . . . . . . . 5.26 1 1 323 1 . . . . . . . 4.14 1 1 324 1 . . . . . . . 4.23 1 1 325 1 . . . . . . . 4.95 1 1 326 1 . . . . . . . 4.04 1 1 327 1 . . . . . . . 5.05 1 1 328 1 . . . . . . . 4.64 1 1 329 1 . . . . . . . 4.09 1 1 330 1 . . . . . . . 4.87 1 1 331 1 . . . . . . . 3.62 1 1 332 1 . . . . . . . 3.1 1 1 333 1 . . . . . . . 3.97 1 1 334 1 . . . . . . . 3.45 1 1 335 1 . . . . . . . 4.6 1 1 336 1 . . . . . . . 5.28 1 1 337 1 . . . . . . . 2.77 1 1 338 1 . . . . . . . 3.66 1 1 339 1 . . . . . . . 5.5 1 1 340 1 . . . . . . . 5.18 1 1 341 1 . . . . . . . 2.85 1 1 342 1 . . . . . . . 4.54 1 1 343 1 . . . . . . . 5.25 1 1 344 1 . . . . . . . 3.06 1 1 345 1 . . . . . . . 3.51 1 1 346 1 . . . . . . . 4.46 1 1 347 1 . . . . . . . 4.45 1 1 348 1 . . . . . . . 4.38 1 1 349 1 . . . . . . . 4.76 1 1 350 1 . . . . . . . 5.15 1 1 351 1 . . . . . . . 3.42 1 1 352 1 . . . . . . . 4.94 1 1 353 1 . . . . . . . 5.42 1 1 354 1 . . . . . . . 3.73 1 1 355 1 . . . . . . . 5.48 1 1 356 1 . . . . . . . 4.99 1 1 357 1 . . . . . . . 3.36 1 1 358 1 . . . . . . . 3.39 1 1 359 1 . . . . . . . 4.56 1 1 360 1 . . . . . . . 4.36 1 1 361 1 . . . . . . . 4.31 1 1 362 1 . . . . . . . 4.63 1 1 363 1 . . . . . . . 3.7 1 1 364 1 . . . . . . . 3.2 1 1 365 1 . . . . . . . 3.45 1 1 366 1 . . . . . . . 4.8 1 1 367 1 . . . . . . . 5.25 1 1 368 1 . . . . . . . 4.84 1 1 369 1 . . . . . . . 3.93 1 1 370 1 . . . . . . . 4.92 1 1 371 1 . . . . . . . 5.02 1 1 372 1 . . . . . . . 4.88 1 1 373 1 . . . . . . . 4.21 1 1 374 1 . . . . . . . 4.14 1 1 375 1 . . . . . . . 2.81 1 1 376 1 . . . . . . . 3.67 1 1 377 1 . . . . . . . 4.24 1 1 378 1 . . . . . . . 3.35 1 1 379 1 . . . . . . . 5.14 1 1 380 1 . . . . . . . 3.67 1 1 381 1 . . . . . . . 4.51 1 1 382 1 . . . . . . . 4.54 1 1 383 1 . . . . . . . 4.47 1 1 384 1 . . . . . . . 3.54 1 1 385 1 . . . . . . . 3.94 1 1 386 1 . . . . . . . 3.98 1 1 387 1 . . . . . . . 3.89 1 1 388 1 . . . . . . . 3.29 1 1 389 1 . . . . . . . 2.9 1 1 390 1 . . . . . . . 3.06 1 1 391 1 . . . . . . . 5.2 1 1 392 1 . . . . . . . 3.81 1 1 393 1 . . . . . . . 4.45 1 1 394 1 . . . . . . . 3.28 1 1 395 1 . . . . . . . 3.96 1 1 396 1 . . . . . . . 4.31 1 1 397 1 . . . . . . . 5.5 1 1 398 1 . . . . . . . 4.15 1 1 399 1 . . . . . . . 3.42 1 1 400 1 . . . . . . . 3.48 1 1 401 1 . . . . . . . 3.96 1 1 402 1 . . . . . . . 2.9 1 1 403 1 . . . . . . . 3.39 1 1 404 1 . . . . . . . 5.36 1 1 405 1 . . . . . . . 2.84 1 1 406 1 . . . . . . . 3.46 1 1 407 1 . . . . . . . 4.27 1 1 408 1 . . . . . . . 3.12 1 1 409 1 . . . . . . . 3.2 1 1 410 1 . . . . . . . 5.17 1 1 411 1 . . . . . . . 3.88 1 1 412 1 . . . . . . . 4.44 1 1 413 1 . . . . . . . 5.36 1 1 414 1 . . . . . . . 4.26 1 1 415 1 . . . . . . . 3.68 1 1 416 1 . . . . . . . 3.3 1 1 417 1 . . . . . . . 3.54 1 1 418 1 . . . . . . . 3.01 1 1 419 1 . . . . . . . 2.86 1 1 420 1 . . . . . . . 4.3 1 1 421 1 . . . . . . . 3.85 1 1 422 1 . . . . . . . 2.94 1 1 423 1 . . . . . . . 5.1 1 1 424 1 . . . . . . . 3.02 1 1 425 1 . . . . . . . 3.09 1 1 426 1 . . . . . . . 2.93 1 1 427 1 . . . . . . . 5.5 1 1 428 1 . . . . . . . 4.19 1 1 429 1 . . . . . . . 3.02 1 1 430 1 . . . . . . . 4.01 1 1 431 1 . . . . . . . 2.92 1 1 432 1 . . . . . . . 5.17 1 1 433 1 . . . . . . . 4.7 1 1 434 1 . . . . . . . 4.59 1 1 435 1 . . . . . . . 4.41 1 1 436 1 . . . . . . . 3.44 1 1 437 1 . . . . . . . 4.7 1 1 438 1 . . . . . . . 5.05 1 1 439 1 . . . . . . . 5.02 1 1 440 1 . . . . . . . 3.93 1 1 441 1 . . . . . . . 4.24 1 1 442 1 . . . . . . . 3.77 1 1 443 1 . . . . . . . 4.7 1 1 444 1 . . . . . . . 4.4 1 1 445 1 . . . . . . . 3.34 1 1 446 1 . . . . . . . 3.07 1 1 447 1 . . . . . . . 4.01 1 1 448 1 . . . . . . . 3.39 1 1 449 1 . . . . . . . 3.58 1 1 450 1 . . . . . . . 3.84 1 1 451 1 . . . . . . . 5.11 1 1 452 1 . . . . . . . 3.09 1 1 453 1 . . . . . . . 3.38 1 1 454 1 . . . . . . . 4.72 1 1 455 1 . . . . . . . 3.73 1 1 456 1 . . . . . . . 4.81 1 1 457 1 . . . . . . . 3.09 1 1 458 1 . . . . . . . 4.28 1 1 459 1 . . . . . . . 3.9 1 1 460 1 . . . . . . . 4.33 1 1 461 1 . . . . . . . 5.07 1 1 462 1 . . . . . . . 5.45 1 1 463 1 . . . . . . . 4.36 1 1 464 1 . . . . . . . 4.56 1 1 465 1 . . . . . . . 2.78 1 1 466 1 . . . . . . . 3.97 1 1 467 1 . . . . . . . 3.32 1 1 468 1 . . . . . . . 3.33 1 1 469 1 . . . . . . . 3.22 1 1 470 1 . . . . . . . 4.02 1 1 471 1 . . . . . . . 4.49 1 1 472 1 . . . . . . . 5.21 1 1 473 1 . . . . . . . 4.74 1 1 474 1 . . . . . . . 3.19 1 1 475 1 . . . . . . . 2.92 1 1 476 1 . . . . . . . 3.06 1 1 477 1 . . . . . . . 3.88 1 1 478 1 . . . . . . . 4.2 1 1 479 1 . . . . . . . 4.23 1 1 480 1 . . . . . . . 3.13 1 1 481 1 . . . . . . . 4.34 1 1 482 1 . . . . . . . 4.67 1 1 483 1 . . . . . . . 4.85 1 1 484 1 . . . . . . . 4.21 1 1 485 1 . . . . . . . 2.76 1 1 486 1 . . . . . . . 3.51 1 1 487 1 . . . . . . . 2.71 1 1 488 1 . . . . . . . 4.01 1 1 489 1 . . . . . . . 4.21 1 1 490 1 . . . . . . . 3.22 1 1 491 1 . . . . . . . 2.91 1 1 492 1 . . . . . . . 3.55 1 1 493 1 . . . . . . . 4.37 1 1 494 1 . . . . . . . 2.79 1 1 495 1 . . . . . . . 4.69 1 1 496 1 . . . . . . . 5.5 1 1 497 1 . . . . . . . 4.12 1 1 498 1 . . . . . . . 3.21 1 1 499 1 . . . . . . . 4.75 1 1 500 1 . . . . . . . 2.81 1 1 501 1 . . . . . . . 3.31 1 1 502 1 . . . . . . . 3.31 1 1 503 1 . . . . . . . 3.2 1 1 504 1 . . . . . . . 3.73 1 1 505 1 . . . . . . . 4.02 1 1 506 1 . . . . . . . 4.64 1 1 507 1 . . . . . . . 3.87 1 1 508 1 . . . . . . . 3.66 1 1 509 1 . . . . . . . 4.26 1 1 510 1 . . . . . . . 3.3 1 1 511 1 . . . . . . . 3.28 1 1 512 1 . . . . . . . 3.16 1 1 513 1 . . . . . . . 3.57 1 1 514 1 . . . . . . . 3.04 1 1 515 1 . . . . . . . 3.8 1 1 516 1 . . . . . . . 5.5 1 1 517 1 . . . . . . . 3.67 1 1 518 1 . . . . . . . 3.69 1 1 519 1 . . . . . . . 2.95 1 1 520 1 . . . . . . . 3.75 1 1 521 1 . . . . . . . 4.7 1 1 522 1 . . . . . . . 3.26 1 1 523 1 . . . . . . . 3.85 1 1 524 1 . . . . . . . 3.73 1 1 525 1 . . . . . . . 2.82 1 1 526 1 . . . . . . . 3.02 1 1 527 1 . . . . . . . 3.5 1 1 528 1 . . . . . . . 4.87 1 1 529 1 . . . . . . . 3.04 1 1 530 1 . . . . . . . 4.9 1 1 531 1 . . . . . . . 5.1 1 1 532 1 . . . . . . . 3.87 1 1 533 1 . . . . . . . 3.51 1 1 534 1 . . . . . . . 3.95 1 1 535 1 . . . . . . . 3.22 1 1 536 1 . . . . . . . 3.65 1 1 537 1 . . . . . . . 2.88 1 1 538 1 . . . . . . . 4.66 1 1 539 1 . . . . . . . 3.0 1 1 540 1 . . . . . . . 3.46 1 1 541 1 . . . . . . . 5.04 1 1 542 1 . . . . . . . 4.37 1 1 543 1 . . . . . . . 4.03 1 1 544 1 . . . . . . . 3.79 1 1 545 1 . . . . . . . 5.24 1 1 546 1 . . . . . . . 2.87 1 1 547 1 . . . . . . . 3.29 1 1 548 1 . . . . . . . 3.02 1 1 549 1 . . . . . . . 2.8 1 1 550 1 . . . . . . . 3.9 1 1 551 1 . . . . . . . 2.9 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_6_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "general distance" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 3 CYS CB . 3 CYSS CB 1 2 1 1 2 1 1 24 CYS SG . 24 CYSS SG 1 2 2 1 1 1 1 3 CYS SG . 3 CYSS SG 1 2 2 1 2 1 1 24 CYS CB . 24 CYSS CB 1 2 3 1 1 1 1 3 CYS SG . 3 CYSS SG 1 2 3 1 2 1 1 24 CYS SG . 24 CYSS SG 1 2 4 1 1 1 1 6 CYS CB . 6 CYSS CB 1 2 4 1 2 1 1 16 CYS SG . 16 CYSS SG 1 2 5 1 1 1 1 6 CYS SG . 6 CYSS SG 1 2 5 1 2 1 1 16 CYS CB . 16 CYSS CB 1 2 6 1 1 1 1 6 CYS SG . 6 CYSS SG 1 2 6 1 2 1 1 16 CYS SG . 16 CYSS SG 1 2 7 1 1 1 1 13 CYS CB . 13 CYSS CB 1 2 7 1 2 1 1 47 CYS SG . 47 CYSS SG 1 2 8 1 1 1 1 13 CYS SG . 13 CYSS SG 1 2 8 1 2 1 1 47 CYS CB . 47 CYSS CB 1 2 9 1 1 1 1 13 CYS SG . 13 CYSS SG 1 2 9 1 2 1 1 47 CYS SG . 47 CYSS SG 1 2 10 1 1 1 1 27 CYS CB . 27 CYSS CB 1 2 10 1 2 1 1 40 CYS SG . 40 CYSS SG 1 2 11 1 1 1 1 27 CYS SG . 27 CYSS SG 1 2 11 1 2 1 1 40 CYS CB . 40 CYSS CB 1 2 12 1 1 1 1 27 CYS SG . 27 CYSS SG 1 2 12 1 2 1 1 40 CYS SG . 40 CYSS SG 1 2 13 1 1 1 1 35 CYS CB . 35 CYSS CB 1 2 13 1 2 1 1 51 CYS SG . 51 CYSS SG 1 2 14 1 1 1 1 35 CYS SG . 35 CYSS SG 1 2 14 1 2 1 1 51 CYS CB . 51 CYSS CB 1 2 15 1 1 1 1 35 CYS SG . 35 CYSS SG 1 2 15 1 2 1 1 51 CYS SG . 51 CYSS SG 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . 3.0 3.1 1 2 2 1 . . . . . . 3.0 3.1 1 2 3 1 . . . . . . 2.0 2.1 1 2 4 1 . . . . . . 3.0 3.1 1 2 5 1 . . . . . . 3.0 3.1 1 2 6 1 . . . . . . 2.0 2.1 1 2 7 1 . . . . . . 3.0 3.1 1 2 8 1 . . . . . . 3.0 3.1 1 2 9 1 . . . . . . 2.0 2.1 1 2 10 1 . . . . . . 3.0 3.1 1 2 11 1 . . . . . . 3.0 3.1 1 2 12 1 . . . . . . 2.0 2.1 1 2 13 1 . . . . . . 3.0 3.1 1 2 14 1 . . . . . . 3.0 3.1 1 2 15 1 . . . . . . 2.0 2.1 1 2 stop_ save_ save_DYANA/DIANA_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 PHI 1 1 1 GLY C 1 1 2 GLU N 1 1 2 GLU CA 1 1 2 GLU C -120.0 -20.0 . . . . . . . . . . . . . . . . 1 1 2 PSI 1 1 2 GLU N 1 1 2 GLU CA 1 1 2 GLU C 1 1 3 CYS N -100.0 0.0 . . . . . . . . . . . . . . . . 1 1 3 PHI 1 1 3 CYS C 1 1 4 GLU N 1 1 4 GLU CA 1 1 4 GLU C -120.0 -20.0 . . . . . . . . . . . . . . . . 1 1 4 PSI 1 1 4 GLU N 1 1 4 GLU CA 1 1 4 GLU C 1 1 5 GLN N -100.0 0.0 . . . . . . . . . . . . . . . . 1 1 5 PHI 1 1 4 GLU C 1 1 5 GLN N 1 1 5 GLN CA 1 1 5 GLN C -120.0 80.0 . . . . . . . . . . . . . . . . 1 1 6 PSI 1 1 5 GLN N 1 1 5 GLN CA 1 1 5 GLN C 1 1 6 CYS N -100.0 60.0 . . . . . . . . . . . . . . . . 1 1 7 PHI 1 1 6 CYS C 1 1 7 PHE N 1 1 7 PHE CA 1 1 7 PHE C -120.0 -20.0 . . . . . . . . . . . . . . . . 1 1 8 PSI 1 1 7 PHE N 1 1 7 PHE CA 1 1 7 PHE C 1 1 8 SER N -100.0 0.0 . . . . . . . . . . . . . . . . 1 1 9 PHI 1 1 7 PHE C 1 1 8 SER N 1 1 8 SER CA 1 1 8 SER C -120.0 -20.0 . . . . . . . . . . . . . . . . 1 1 10 PSI 1 1 8 SER N 1 1 8 SER CA 1 1 8 SER C 1 1 9 ASP N -100.0 0.0 . . . . . . . . . . . . . . . . 1 1 11 PHI 1 1 8 SER C 1 1 9 ASP N 1 1 9 ASP CA 1 1 9 ASP C -200.0 -80.0 . . . . . . . . . . . . . . . . 1 1 12 PSI 1 1 9 ASP N 1 1 9 ASP CA 1 1 9 ASP C 1 1 10 GLY N 40.0 220.0 . . . . . . . . . . . . . . . . 1 1 13 PHI 1 1 11 GLY C 1 1 12 ASP N 1 1 12 ASP CA 1 1 12 ASP C -120.0 80.0 . . . . . . . . . . . . . . . . 1 1 14 PSI 1 1 12 ASP N 1 1 12 ASP CA 1 1 12 ASP C 1 1 13 CYS N -100.0 60.0 . . . . . . . . . . . . . . . . 1 1 15 PHI 1 1 13 CYS C 1 1 14 THR N 1 1 14 THR CA 1 1 14 THR C -120.0 -20.0 . . . . . . . . . . . . . . . . 1 1 16 PSI 1 1 14 THR N 1 1 14 THR CA 1 1 14 THR C 1 1 15 THR N -100.0 0.0 . . . . . . . . . . . . . . . . 1 1 17 PHI 1 1 14 THR C 1 1 15 THR N 1 1 15 THR CA 1 1 15 THR C -200.0 -80.0 . . . . . . . . . . . . . . . . 1 1 18 PSI 1 1 15 THR N 1 1 15 THR CA 1 1 15 THR C 1 1 16 CYS N 40.0 220.0 . . . . . . . . . . . . . . . . 1 1 19 PHI 1 1 18 ASN C 1 1 19 ASN N 1 1 19 ASN CA 1 1 19 ASN C -120.0 80.0 . . . . . . . . . . . . . . . . 1 1 20 PSI 1 1 19 ASN N 1 1 19 ASN CA 1 1 19 ASN C 1 1 20 GLY N -100.0 60.0 . . . . . . . . . . . . . . . . 1 1 21 PHI 1 1 24 CYS C 1 1 25 ALA N 1 1 25 ALA CA 1 1 25 ALA C -120.0 -20.0 . . . . . . . . . . . . . . . . 1 1 22 PSI 1 1 25 ALA N 1 1 25 ALA CA 1 1 25 ALA C 1 1 26 ASN N -100.0 0.0 . . . . . . . . . . . . . . . . 1 1 23 PHI 1 1 25 ALA C 1 1 26 ASN N 1 1 26 ASN CA 1 1 26 ASN C -120.0 80.0 . . . . . . . . . . . . . . . . 1 1 24 PSI 1 1 26 ASN N 1 1 26 ASN CA 1 1 26 ASN C 1 1 27 CYS N -100.0 60.0 . . . . . . . . . . . . . . . . 1 1 25 PHI 1 1 28 LEU C 1 1 29 ALA N 1 1 29 ALA CA 1 1 29 ALA C -120.0 -20.0 . . . . . . . . . . . . . . . . 1 1 26 PSI 1 1 29 ALA N 1 1 29 ALA CA 1 1 29 ALA C 1 1 30 GLY N -100.0 0.0 . . . . . . . . . . . . . . . . 1 1 27 PHI 1 1 30 GLY C 1 1 31 TYR N 1 1 31 TYR CA 1 1 31 TYR C -200.0 -80.0 . . . . . . . . . . . . . . . . 1 1 28 PSI 1 1 31 TYR N 1 1 31 TYR CA 1 1 31 TYR C 1 1 32 PRO N 40.0 220.0 . . . . . . . . . . . . . . . . 1 1 29 PHI 1 1 32 PRO C 1 1 33 ALA N 1 1 33 ALA CA 1 1 33 ALA C -120.0 -20.0 . . . . . . . . . . . . . . . . 1 1 30 PSI 1 1 33 ALA N 1 1 33 ALA CA 1 1 33 ALA C 1 1 34 GLY N -100.0 0.0 . . . . . . . . . . . . . . . . 1 1 31 PHI 1 1 35 CYS C 1 1 36 SER N 1 1 36 SER CA 1 1 36 SER C -120.0 -20.0 . . . . . . . . . . . . . . . . 1 1 32 PSI 1 1 36 SER N 1 1 36 SER CA 1 1 36 SER C 1 1 37 ASN N -100.0 0.0 . . . . . . . . . . . . . . . . 1 1 33 PHI 1 1 36 SER C 1 1 37 ASN N 1 1 37 ASN CA 1 1 37 ASN C -200.0 -80.0 . . . . . . . . . . . . . . . . 1 1 34 PSI 1 1 37 ASN N 1 1 37 ASN CA 1 1 37 ASN C 1 1 38 SER N 40.0 220.0 . . . . . . . . . . . . . . . . 1 1 35 PHI 1 1 37 ASN C 1 1 38 SER N 1 1 38 SER CA 1 1 38 SER C -120.0 -20.0 . . . . . . . . . . . . . . . . 1 1 36 PSI 1 1 38 SER N 1 1 38 SER CA 1 1 38 SER C 1 1 39 ASP N -100.0 0.0 . . . . . . . . . . . . . . . . 1 1 37 PHI 1 1 40 CYS C 1 1 41 THR N 1 1 41 THR CA 1 1 41 THR C -120.0 -20.0 . . . . . . . . . . . . . . . . 1 1 38 PSI 1 1 41 THR N 1 1 41 THR CA 1 1 41 THR C 1 1 42 ALA N -100.0 0.0 . . . . . . . . . . . . . . . . 1 1 39 PHI 1 1 41 THR C 1 1 42 ALA N 1 1 42 ALA CA 1 1 42 ALA C -120.0 -20.0 . . . . . . . . . . . . . . . . 1 1 40 PSI 1 1 42 ALA N 1 1 42 ALA CA 1 1 42 ALA C 1 1 43 PHE N -100.0 0.0 . . . . . . . . . . . . . . . . 1 1 41 PHI 1 1 42 ALA C 1 1 43 PHE N 1 1 43 PHE CA 1 1 43 PHE C -120.0 -20.0 . . . . . . . . . . . . . . . . 1 1 42 PSI 1 1 43 PHE N 1 1 43 PHE CA 1 1 43 PHE C 1 1 44 LEU N -100.0 0.0 . . . . . . . . . . . . . . . . 1 1 43 PHI 1 1 43 PHE C 1 1 44 LEU N 1 1 44 LEU CA 1 1 44 LEU C -120.0 -20.0 . . . . . . . . . . . . . . . . 1 1 44 PSI 1 1 44 LEU N 1 1 44 LEU CA 1 1 44 LEU C 1 1 45 SER N -100.0 0.0 . . . . . . . . . . . . . . . . 1 1 45 PHI 1 1 45 SER C 1 1 46 GLN N 1 1 46 GLN CA 1 1 46 GLN C -120.0 -20.0 . . . . . . . . . . . . . . . . 1 1 46 PSI 1 1 46 GLN N 1 1 46 GLN CA 1 1 46 GLN C 1 1 47 CYS N -100.0 0.0 . . . . . . . . . . . . . . . . 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C -7.848 -5.556 -1.194 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C -7.596 -6.582 -2.276 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H -9.545 -6.477 -2.863 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H -8.727 -7.738 -3.514 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H -9.213 -7.794 -1.924 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H -7.159 -6.078 -3.139 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H -6.906 -7.344 -1.920 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N -8.868 -7.202 -2.668 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O -8.699 -4.684 -1.384 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 GLU C C -6.921 -3.360 0.774 1.00 . A A . 2 GLU C 1 1 1 11 1 1 2 GLU CA C -7.425 -4.760 1.079 1.00 . A A . 2 GLU CA 1 1 1 12 1 1 2 GLU CB C -6.827 -5.282 2.390 1.00 . A A . 2 GLU CB 1 1 1 13 1 1 2 GLU CD C -4.776 -6.318 3.526 1.00 . A A . 2 GLU CD 1 1 1 14 1 1 2 GLU CG C -5.327 -5.548 2.321 1.00 . A A . 2 GLU CG 1 1 1 15 1 1 2 GLU H H -6.355 -6.255 -0.021 1.00 . A A . 2 GLU H 1 1 1 16 1 1 2 GLU HA H -8.486 -4.717 1.238 1.00 . A A . 2 GLU HA 1 1 1 17 1 1 2 GLU HB2 H -7.025 -4.551 3.172 1.00 . A A . 2 GLU HB2 1 1 1 18 1 1 2 GLU HB3 H -7.324 -6.220 2.623 1.00 . A A . 2 GLU HB3 1 1 1 19 1 1 2 GLU HG2 H -5.204 -6.143 1.429 1.00 . A A . 2 GLU HG2 1 1 1 20 1 1 2 GLU HG3 H -4.776 -4.613 2.210 1.00 . A A . 2 GLU HG3 1 1 1 21 1 1 2 GLU N N -7.176 -5.658 -0.048 1.00 . A A . 2 GLU N 1 1 1 22 1 1 2 GLU O O -7.546 -2.359 1.143 1.00 . A A . 2 GLU O 1 1 1 23 1 1 2 GLU OE1 O -5.468 -6.401 4.567 1.00 . A A . 2 GLU OE1 1 1 1 24 1 1 2 GLU OE2 O -3.650 -6.863 3.404 1.00 . A A . 2 GLU OE2 1 1 1 25 1 1 3 CYS C C -5.818 -1.451 -1.408 1.00 . A A . 3 CYS C 1 1 1 26 1 1 3 CYS CA C -5.102 -2.075 -0.215 1.00 . A A . 3 CYS CA 1 1 1 27 1 1 3 CYS CB C -3.632 -2.390 -0.479 1.00 . A A . 3 CYS CB 1 1 1 28 1 1 3 CYS H H -5.382 -4.164 -0.277 1.00 . A A . 3 CYS H 1 1 1 29 1 1 3 CYS HA H -5.181 -1.408 0.645 1.00 . A A . 3 CYS HA 1 1 1 30 1 1 3 CYS HB2 H -3.189 -2.758 0.446 1.00 . A A . 3 CYS HB2 1 1 1 31 1 1 3 CYS HB3 H -3.561 -3.177 -1.227 1.00 . A A . 3 CYS HB3 1 1 1 32 1 1 3 CYS N N -5.767 -3.308 0.112 1.00 . A A . 3 CYS N 1 1 1 33 1 1 3 CYS O O -6.074 -0.246 -1.395 1.00 . A A . 3 CYS O 1 1 1 34 1 1 3 CYS SG S -2.659 -0.989 -1.047 1.00 . A A . 3 CYS SG 1 1 1 35 1 1 4 GLU C C -8.410 -1.297 -2.973 1.00 . A A . 4 GLU C 1 1 1 36 1 1 4 GLU CA C -7.082 -1.873 -3.484 1.00 . A A . 4 GLU CA 1 1 1 37 1 1 4 GLU CB C -7.317 -3.047 -4.449 1.00 . A A . 4 GLU CB 1 1 1 38 1 1 4 GLU CD C -6.249 -4.538 -6.249 1.00 . A A . 4 GLU CD 1 1 1 39 1 1 4 GLU CG C -6.077 -3.338 -5.309 1.00 . A A . 4 GLU CG 1 1 1 40 1 1 4 GLU H H -5.884 -3.241 -2.361 1.00 . A A . 4 GLU H 1 1 1 41 1 1 4 GLU HA H -6.577 -1.078 -4.035 1.00 . A A . 4 GLU HA 1 1 1 42 1 1 4 GLU HB2 H -7.596 -3.938 -3.886 1.00 . A A . 4 GLU HB2 1 1 1 43 1 1 4 GLU HB3 H -8.138 -2.786 -5.119 1.00 . A A . 4 GLU HB3 1 1 1 44 1 1 4 GLU HG2 H -5.854 -2.456 -5.908 1.00 . A A . 4 GLU HG2 1 1 1 45 1 1 4 GLU HG3 H -5.222 -3.521 -4.661 1.00 . A A . 4 GLU HG3 1 1 1 46 1 1 4 GLU N N -6.220 -2.276 -2.382 1.00 . A A . 4 GLU N 1 1 1 47 1 1 4 GLU O O -8.825 -0.257 -3.474 1.00 . A A . 4 GLU O 1 1 1 48 1 1 4 GLU OE1 O -7.391 -4.894 -6.628 1.00 . A A . 4 GLU OE1 1 1 1 49 1 1 4 GLU OE2 O -5.228 -5.141 -6.663 1.00 . A A . 4 GLU OE2 1 1 1 50 1 1 5 GLN C C -10.110 0.034 -0.897 1.00 . A A . 5 GLN C 1 1 1 51 1 1 5 GLN CA C -10.318 -1.390 -1.412 1.00 . A A . 5 GLN CA 1 1 1 52 1 1 5 GLN CB C -10.806 -2.315 -0.282 1.00 . A A . 5 GLN CB 1 1 1 53 1 1 5 GLN CD C -13.335 -2.692 -0.193 1.00 . A A . 5 GLN CD 1 1 1 54 1 1 5 GLN CG C -12.144 -1.925 0.378 1.00 . A A . 5 GLN CG 1 1 1 55 1 1 5 GLN H H -8.668 -2.758 -1.594 1.00 . A A . 5 GLN H 1 1 1 56 1 1 5 GLN HA H -11.070 -1.367 -2.204 1.00 . A A . 5 GLN HA 1 1 1 57 1 1 5 GLN HB2 H -10.904 -3.320 -0.676 1.00 . A A . 5 GLN HB2 1 1 1 58 1 1 5 GLN HB3 H -10.045 -2.337 0.498 1.00 . A A . 5 GLN HB3 1 1 1 59 1 1 5 GLN HE21 H -13.669 -1.344 -1.700 1.00 . A A . 5 GLN HE21 1 1 1 60 1 1 5 GLN HE22 H -14.754 -2.692 -1.635 1.00 . A A . 5 GLN HE22 1 1 1 61 1 1 5 GLN HG2 H -12.074 -2.172 1.437 1.00 . A A . 5 GLN HG2 1 1 1 62 1 1 5 GLN HG3 H -12.322 -0.851 0.312 1.00 . A A . 5 GLN HG3 1 1 1 63 1 1 5 GLN N N -9.062 -1.904 -1.973 1.00 . A A . 5 GLN N 1 1 1 64 1 1 5 GLN NE2 N -13.940 -2.222 -1.266 1.00 . A A . 5 GLN NE2 1 1 1 65 1 1 5 GLN O O -10.898 0.927 -1.209 1.00 . A A . 5 GLN O 1 1 1 66 1 1 5 GLN OE1 O -13.713 -3.748 0.316 1.00 . A A . 5 GLN OE1 1 1 1 67 1 1 6 CYS C C -8.449 2.555 -0.661 1.00 . A A . 6 CYS C 1 1 1 68 1 1 6 CYS CA C -8.697 1.525 0.450 1.00 . A A . 6 CYS CA 1 1 1 69 1 1 6 CYS CB C -7.464 1.348 1.337 1.00 . A A . 6 CYS CB 1 1 1 70 1 1 6 CYS H H -8.424 -0.551 0.051 1.00 . A A . 6 CYS H 1 1 1 71 1 1 6 CYS HA H -9.534 1.867 1.058 1.00 . A A . 6 CYS HA 1 1 1 72 1 1 6 CYS HB2 H -7.426 0.330 1.718 1.00 . A A . 6 CYS HB2 1 1 1 73 1 1 6 CYS HB3 H -6.588 1.480 0.714 1.00 . A A . 6 CYS HB3 1 1 1 74 1 1 6 CYS N N -9.044 0.232 -0.119 1.00 . A A . 6 CYS N 1 1 1 75 1 1 6 CYS O O -8.890 3.699 -0.566 1.00 . A A . 6 CYS O 1 1 1 76 1 1 6 CYS SG S -7.364 2.494 2.734 1.00 . A A . 6 CYS SG 1 1 1 77 1 1 7 PHE C C -8.867 3.374 -3.568 1.00 . A A . 7 PHE C 1 1 1 78 1 1 7 PHE CA C -7.550 2.957 -2.915 1.00 . A A . 7 PHE CA 1 1 1 79 1 1 7 PHE CB C -6.639 2.226 -3.914 1.00 . A A . 7 PHE CB 1 1 1 80 1 1 7 PHE CD1 C -4.314 2.986 -3.312 1.00 . A A . 7 PHE CD1 1 1 1 81 1 1 7 PHE CD2 C -5.306 3.787 -5.391 1.00 . A A . 7 PHE CD2 1 1 1 82 1 1 7 PHE CE1 C -3.177 3.773 -3.555 1.00 . A A . 7 PHE CE1 1 1 1 83 1 1 7 PHE CE2 C -4.138 4.516 -5.664 1.00 . A A . 7 PHE CE2 1 1 1 84 1 1 7 PHE CG C -5.384 3.003 -4.226 1.00 . A A . 7 PHE CG 1 1 1 85 1 1 7 PHE CZ C -3.077 4.513 -4.742 1.00 . A A . 7 PHE CZ 1 1 1 86 1 1 7 PHE H H -7.422 1.190 -1.745 1.00 . A A . 7 PHE H 1 1 1 87 1 1 7 PHE HA H -7.048 3.863 -2.575 1.00 . A A . 7 PHE HA 1 1 1 88 1 1 7 PHE HB2 H -6.349 1.253 -3.524 1.00 . A A . 7 PHE HB2 1 1 1 89 1 1 7 PHE HB3 H -7.178 2.043 -4.843 1.00 . A A . 7 PHE HB3 1 1 1 90 1 1 7 PHE HD1 H -4.386 2.417 -2.390 1.00 . A A . 7 PHE HD1 1 1 1 91 1 1 7 PHE HD2 H -6.141 3.839 -6.075 1.00 . A A . 7 PHE HD2 1 1 1 92 1 1 7 PHE HE1 H -2.380 3.828 -2.829 1.00 . A A . 7 PHE HE1 1 1 1 93 1 1 7 PHE HE2 H -4.055 5.113 -6.564 1.00 . A A . 7 PHE HE2 1 1 1 94 1 1 7 PHE HZ H -2.186 5.095 -4.935 1.00 . A A . 7 PHE HZ 1 1 1 95 1 1 7 PHE N N -7.784 2.136 -1.739 1.00 . A A . 7 PHE N 1 1 1 96 1 1 7 PHE O O -9.054 4.558 -3.852 1.00 . A A . 7 PHE O 1 1 1 97 1 1 8 SER C C -11.845 3.722 -3.471 1.00 . A A . 8 SER C 1 1 1 98 1 1 8 SER CA C -11.088 2.739 -4.370 1.00 . A A . 8 SER CA 1 1 1 99 1 1 8 SER CB C -11.863 1.440 -4.639 1.00 . A A . 8 SER CB 1 1 1 100 1 1 8 SER H H -9.586 1.472 -3.545 1.00 . A A . 8 SER H 1 1 1 101 1 1 8 SER HA H -10.928 3.243 -5.326 1.00 . A A . 8 SER HA 1 1 1 102 1 1 8 SER HB2 H -11.866 0.796 -3.751 1.00 . A A . 8 SER HB2 1 1 1 103 1 1 8 SER HB3 H -12.889 1.689 -4.910 1.00 . A A . 8 SER HB3 1 1 1 104 1 1 8 SER HG H -11.911 0.154 -6.132 1.00 . A A . 8 SER HG 1 1 1 105 1 1 8 SER N N -9.784 2.432 -3.800 1.00 . A A . 8 SER N 1 1 1 106 1 1 8 SER O O -12.455 4.659 -3.988 1.00 . A A . 8 SER O 1 1 1 107 1 1 8 SER OG O -11.255 0.761 -5.731 1.00 . A A . 8 SER OG 1 1 1 108 1 1 9 ASP C C -11.451 5.837 -1.025 1.00 . A A . 9 ASP C 1 1 1 109 1 1 9 ASP CA C -12.280 4.544 -1.160 1.00 . A A . 9 ASP CA 1 1 1 110 1 1 9 ASP CB C -12.366 3.805 0.180 1.00 . A A . 9 ASP CB 1 1 1 111 1 1 9 ASP CG C -13.445 4.385 1.089 1.00 . A A . 9 ASP CG 1 1 1 112 1 1 9 ASP H H -11.152 2.848 -1.786 1.00 . A A . 9 ASP H 1 1 1 113 1 1 9 ASP HA H -13.289 4.814 -1.473 1.00 . A A . 9 ASP HA 1 1 1 114 1 1 9 ASP HB2 H -12.622 2.761 -0.011 1.00 . A A . 9 ASP HB2 1 1 1 115 1 1 9 ASP HB3 H -11.397 3.813 0.682 1.00 . A A . 9 ASP HB3 1 1 1 116 1 1 9 ASP N N -11.714 3.615 -2.144 1.00 . A A . 9 ASP N 1 1 1 117 1 1 9 ASP O O -11.339 6.439 0.046 1.00 . A A . 9 ASP O 1 1 1 118 1 1 9 ASP OD1 O -14.636 4.072 0.845 1.00 . A A . 9 ASP OD1 1 1 1 119 1 1 9 ASP OD2 O -13.126 4.980 2.143 1.00 . A A . 9 ASP OD2 1 1 1 120 1 1 10 GLY C C -8.907 7.696 -1.574 1.00 . A A . 10 GLY C 1 1 1 121 1 1 10 GLY CA C -10.242 7.592 -2.302 1.00 . A A . 10 GLY CA 1 1 1 122 1 1 10 GLY H H -10.999 5.731 -2.964 1.00 . A A . 10 GLY H 1 1 1 123 1 1 10 GLY HA2 H -10.901 8.371 -1.928 1.00 . A A . 10 GLY HA2 1 1 1 124 1 1 10 GLY HA3 H -10.073 7.768 -3.363 1.00 . A A . 10 GLY HA3 1 1 1 125 1 1 10 GLY N N -10.919 6.319 -2.147 1.00 . A A . 10 GLY N 1 1 1 126 1 1 10 GLY O O -8.314 8.779 -1.589 1.00 . A A . 10 GLY O 1 1 1 127 1 1 11 GLY C C -5.968 6.742 -0.961 1.00 . A A . 11 GLY C 1 1 1 128 1 1 11 GLY CA C -7.230 6.725 -0.104 1.00 . A A . 11 GLY CA 1 1 1 129 1 1 11 GLY H H -8.919 5.751 -0.937 1.00 . A A . 11 GLY H 1 1 1 130 1 1 11 GLY HA2 H -7.204 5.859 0.553 1.00 . A A . 11 GLY HA2 1 1 1 131 1 1 11 GLY HA3 H -7.292 7.635 0.490 1.00 . A A . 11 GLY HA3 1 1 1 132 1 1 11 GLY N N -8.421 6.636 -0.923 1.00 . A A . 11 GLY N 1 1 1 133 1 1 11 GLY O O -5.907 6.043 -1.979 1.00 . A A . 11 GLY O 1 1 1 134 1 1 12 ASP C C -2.659 6.672 -0.383 1.00 . A A . 12 ASP C 1 1 1 135 1 1 12 ASP CA C -3.633 7.530 -1.192 1.00 . A A . 12 ASP CA 1 1 1 136 1 1 12 ASP CB C -3.079 8.959 -1.285 1.00 . A A . 12 ASP CB 1 1 1 137 1 1 12 ASP CG C -3.554 9.864 -2.412 1.00 . A A . 12 ASP CG 1 1 1 138 1 1 12 ASP H H -5.070 8.030 0.320 1.00 . A A . 12 ASP H 1 1 1 139 1 1 12 ASP HA H -3.696 7.108 -2.194 1.00 . A A . 12 ASP HA 1 1 1 140 1 1 12 ASP HB2 H -3.308 9.435 -0.338 1.00 . A A . 12 ASP HB2 1 1 1 141 1 1 12 ASP HB3 H -1.993 8.912 -1.384 1.00 . A A . 12 ASP HB3 1 1 1 142 1 1 12 ASP N N -4.946 7.492 -0.532 1.00 . A A . 12 ASP N 1 1 1 143 1 1 12 ASP O O -2.631 5.459 -0.561 1.00 . A A . 12 ASP O 1 1 1 144 1 1 12 ASP OD1 O -4.442 10.707 -2.152 1.00 . A A . 12 ASP OD1 1 1 1 145 1 1 12 ASP OD2 O -2.790 10.027 -3.390 1.00 . A A . 12 ASP OD2 1 1 1 146 1 1 13 CYS C C -0.962 6.761 2.707 1.00 . A A . 13 CYS C 1 1 1 147 1 1 13 CYS CA C -0.770 6.638 1.204 1.00 . A A . 13 CYS CA 1 1 1 148 1 1 13 CYS CB C 0.558 7.251 0.728 1.00 . A A . 13 CYS CB 1 1 1 149 1 1 13 CYS H H -1.960 8.280 0.626 1.00 . A A . 13 CYS H 1 1 1 150 1 1 13 CYS HA H -0.760 5.580 0.961 1.00 . A A . 13 CYS HA 1 1 1 151 1 1 13 CYS HB2 H 0.612 8.288 1.061 1.00 . A A . 13 CYS HB2 1 1 1 152 1 1 13 CYS HB3 H 1.371 6.700 1.198 1.00 . A A . 13 CYS HB3 1 1 1 153 1 1 13 CYS N N -1.894 7.272 0.538 1.00 . A A . 13 CYS N 1 1 1 154 1 1 13 CYS O O -1.174 5.752 3.378 1.00 . A A . 13 CYS O 1 1 1 155 1 1 13 CYS SG S 0.824 7.248 -1.066 1.00 . A A . 13 CYS SG 1 1 1 156 1 1 14 THR C C -2.495 7.713 5.092 1.00 . A A . 14 THR C 1 1 1 157 1 1 14 THR CA C -1.127 8.244 4.660 1.00 . A A . 14 THR CA 1 1 1 158 1 1 14 THR CB C -0.996 9.756 4.910 1.00 . A A . 14 THR CB 1 1 1 159 1 1 14 THR CG2 C -1.009 10.116 6.394 1.00 . A A . 14 THR CG2 1 1 1 160 1 1 14 THR H H -0.839 8.797 2.632 1.00 . A A . 14 THR H 1 1 1 161 1 1 14 THR HA H -0.358 7.712 5.224 1.00 . A A . 14 THR HA 1 1 1 162 1 1 14 THR HB H -1.835 10.264 4.432 1.00 . A A . 14 THR HB 1 1 1 163 1 1 14 THR HG1 H 0.794 9.533 4.119 1.00 . A A . 14 THR HG1 1 1 1 164 1 1 14 THR HG21 H -1.939 9.781 6.850 1.00 . A A . 14 THR HG21 1 1 1 165 1 1 14 THR HG22 H -0.185 9.631 6.909 1.00 . A A . 14 THR HG22 1 1 1 166 1 1 14 THR HG23 H -0.934 11.197 6.518 1.00 . A A . 14 THR HG23 1 1 1 167 1 1 14 THR N N -0.933 7.985 3.240 1.00 . A A . 14 THR N 1 1 1 168 1 1 14 THR O O -2.601 6.917 6.025 1.00 . A A . 14 THR O 1 1 1 169 1 1 14 THR OG1 O 0.195 10.268 4.338 1.00 . A A . 14 THR OG1 1 1 1 170 1 1 15 THR C C -5.352 6.396 4.322 1.00 . A A . 15 THR C 1 1 1 171 1 1 15 THR CA C -4.931 7.823 4.711 1.00 . A A . 15 THR CA 1 1 1 172 1 1 15 THR CB C -5.734 8.942 4.013 1.00 . A A . 15 THR CB 1 1 1 173 1 1 15 THR CG2 C -5.700 8.876 2.482 1.00 . A A . 15 THR CG2 1 1 1 174 1 1 15 THR H H -3.386 8.711 3.580 1.00 . A A . 15 THR H 1 1 1 175 1 1 15 THR HA H -5.042 7.923 5.791 1.00 . A A . 15 THR HA 1 1 1 176 1 1 15 THR HB H -5.244 9.878 4.254 1.00 . A A . 15 THR HB 1 1 1 177 1 1 15 THR HG1 H -7.196 8.536 5.264 1.00 . A A . 15 THR HG1 1 1 1 178 1 1 15 THR HG21 H -6.052 7.902 2.158 1.00 . A A . 15 THR HG21 1 1 1 179 1 1 15 THR HG22 H -6.347 9.652 2.068 1.00 . A A . 15 THR HG22 1 1 1 180 1 1 15 THR HG23 H -4.687 9.039 2.114 1.00 . A A . 15 THR HG23 1 1 1 181 1 1 15 THR N N -3.544 8.093 4.361 1.00 . A A . 15 THR N 1 1 1 182 1 1 15 THR O O -6.512 6.160 3.995 1.00 . A A . 15 THR O 1 1 1 183 1 1 15 THR OG1 O -7.080 9.045 4.441 1.00 . A A . 15 THR OG1 1 1 1 184 1 1 16 CYS C C -3.552 3.414 5.262 1.00 . A A . 16 CYS C 1 1 1 185 1 1 16 CYS CA C -4.591 4.007 4.327 1.00 . A A . 16 CYS CA 1 1 1 186 1 1 16 CYS CB C -4.515 3.590 2.852 1.00 . A A . 16 CYS CB 1 1 1 187 1 1 16 CYS H H -3.521 5.744 4.769 1.00 . A A . 16 CYS H 1 1 1 188 1 1 16 CYS HA H -5.557 3.671 4.710 1.00 . A A . 16 CYS HA 1 1 1 189 1 1 16 CYS HB2 H -3.731 4.151 2.346 1.00 . A A . 16 CYS HB2 1 1 1 190 1 1 16 CYS HB3 H -4.292 2.529 2.731 1.00 . A A . 16 CYS HB3 1 1 1 191 1 1 16 CYS N N -4.436 5.444 4.452 1.00 . A A . 16 CYS N 1 1 1 192 1 1 16 CYS O O -3.966 2.704 6.168 1.00 . A A . 16 CYS O 1 1 1 193 1 1 16 CYS SG S -6.104 3.920 2.044 1.00 . A A . 16 CYS SG 1 1 1 194 1 1 17 PHE C C -1.572 3.411 7.544 1.00 . A A . 17 PHE C 1 1 1 195 1 1 17 PHE CA C -1.208 3.310 6.061 1.00 . A A . 17 PHE CA 1 1 1 196 1 1 17 PHE CB C 0.113 4.057 5.812 1.00 . A A . 17 PHE CB 1 1 1 197 1 1 17 PHE CD1 C 1.656 2.169 6.385 1.00 . A A . 17 PHE CD1 1 1 1 198 1 1 17 PHE CD2 C 1.934 4.223 7.622 1.00 . A A . 17 PHE CD2 1 1 1 199 1 1 17 PHE CE1 C 2.718 1.578 7.090 1.00 . A A . 17 PHE CE1 1 1 1 200 1 1 17 PHE CE2 C 2.990 3.633 8.340 1.00 . A A . 17 PHE CE2 1 1 1 201 1 1 17 PHE CG C 1.267 3.490 6.623 1.00 . A A . 17 PHE CG 1 1 1 202 1 1 17 PHE CZ C 3.394 2.319 8.065 1.00 . A A . 17 PHE CZ 1 1 1 203 1 1 17 PHE H H -1.982 4.425 4.430 1.00 . A A . 17 PHE H 1 1 1 204 1 1 17 PHE HA H -1.056 2.256 5.832 1.00 . A A . 17 PHE HA 1 1 1 205 1 1 17 PHE HB2 H 0.370 3.974 4.755 1.00 . A A . 17 PHE HB2 1 1 1 206 1 1 17 PHE HB3 H -0.016 5.115 6.045 1.00 . A A . 17 PHE HB3 1 1 1 207 1 1 17 PHE HD1 H 1.132 1.621 5.624 1.00 . A A . 17 PHE HD1 1 1 1 208 1 1 17 PHE HD2 H 1.648 5.236 7.856 1.00 . A A . 17 PHE HD2 1 1 1 209 1 1 17 PHE HE1 H 3.027 0.562 6.883 1.00 . A A . 17 PHE HE1 1 1 1 210 1 1 17 PHE HE2 H 3.492 4.179 9.127 1.00 . A A . 17 PHE HE2 1 1 1 211 1 1 17 PHE HZ H 4.209 1.869 8.611 1.00 . A A . 17 PHE HZ 1 1 1 212 1 1 17 PHE N N -2.267 3.791 5.168 1.00 . A A . 17 PHE N 1 1 1 213 1 1 17 PHE O O -1.301 2.468 8.294 1.00 . A A . 17 PHE O 1 1 1 214 1 1 18 ASN C C -1.736 4.470 10.399 1.00 . A A . 18 ASN C 1 1 1 215 1 1 18 ASN CA C -2.776 4.697 9.298 1.00 . A A . 18 ASN CA 1 1 1 216 1 1 18 ASN CB C -3.960 3.738 9.443 1.00 . A A . 18 ASN CB 1 1 1 217 1 1 18 ASN CG C -4.994 4.183 10.466 1.00 . A A . 18 ASN CG 1 1 1 218 1 1 18 ASN H H -2.310 5.287 7.299 1.00 . A A . 18 ASN H 1 1 1 219 1 1 18 ASN HA H -3.127 5.724 9.390 1.00 . A A . 18 ASN HA 1 1 1 220 1 1 18 ASN HB2 H -4.475 3.648 8.490 1.00 . A A . 18 ASN HB2 1 1 1 221 1 1 18 ASN HB3 H -3.534 2.768 9.706 1.00 . A A . 18 ASN HB3 1 1 1 222 1 1 18 ASN HD21 H -3.931 3.452 12.009 1.00 . A A . 18 ASN HD21 1 1 1 223 1 1 18 ASN HD22 H -5.499 4.181 12.406 1.00 . A A . 18 ASN HD22 1 1 1 224 1 1 18 ASN N N -2.199 4.524 7.959 1.00 . A A . 18 ASN N 1 1 1 225 1 1 18 ASN ND2 N -4.806 3.882 11.736 1.00 . A A . 18 ASN ND2 1 1 1 226 1 1 18 ASN O O -2.028 3.952 11.479 1.00 . A A . 18 ASN O 1 1 1 227 1 1 18 ASN OD1 O -5.992 4.805 10.122 1.00 . A A . 18 ASN OD1 1 1 1 228 1 1 19 ASN C C 0.793 2.996 11.267 1.00 . A A . 19 ASN C 1 1 1 229 1 1 19 ASN CA C 0.686 4.474 10.879 1.00 . A A . 19 ASN CA 1 1 1 230 1 1 19 ASN CB C 1.016 5.447 12.014 1.00 . A A . 19 ASN CB 1 1 1 231 1 1 19 ASN CG C 2.471 5.295 12.455 1.00 . A A . 19 ASN CG 1 1 1 232 1 1 19 ASN H H -0.347 5.314 9.231 1.00 . A A . 19 ASN H 1 1 1 233 1 1 19 ASN HA H 1.459 4.613 10.146 1.00 . A A . 19 ASN HA 1 1 1 234 1 1 19 ASN HB2 H 0.846 6.461 11.659 1.00 . A A . 19 ASN HB2 1 1 1 235 1 1 19 ASN HB3 H 0.370 5.244 12.865 1.00 . A A . 19 ASN HB3 1 1 1 236 1 1 19 ASN HD21 H 2.181 6.356 14.182 1.00 . A A . 19 ASN HD21 1 1 1 237 1 1 19 ASN HD22 H 3.811 5.815 13.827 1.00 . A A . 19 ASN HD22 1 1 1 238 1 1 19 ASN N N -0.493 4.840 10.117 1.00 . A A . 19 ASN N 1 1 1 239 1 1 19 ASN ND2 N 2.820 5.778 13.635 1.00 . A A . 19 ASN ND2 1 1 1 240 1 1 19 ASN O O 0.766 2.637 12.447 1.00 . A A . 19 ASN O 1 1 1 241 1 1 19 ASN OD1 O 3.302 4.736 11.753 1.00 . A A . 19 ASN OD1 1 1 1 242 1 1 20 GLY C C 0.407 -0.283 10.739 1.00 . A A . 20 GLY C 1 1 1 243 1 1 20 GLY CA C 1.427 0.792 10.375 1.00 . A A . 20 GLY CA 1 1 1 244 1 1 20 GLY H H 0.788 2.497 9.312 1.00 . A A . 20 GLY H 1 1 1 245 1 1 20 GLY HA2 H 2.239 0.810 11.101 1.00 . A A . 20 GLY HA2 1 1 1 246 1 1 20 GLY HA3 H 1.869 0.516 9.421 1.00 . A A . 20 GLY HA3 1 1 1 247 1 1 20 GLY N N 0.871 2.134 10.252 1.00 . A A . 20 GLY N 1 1 1 248 1 1 20 GLY O O 0.775 -1.453 10.861 1.00 . A A . 20 GLY O 1 1 1 249 1 1 21 THR C C -2.965 -0.948 9.926 1.00 . A A . 21 THR C 1 1 1 250 1 1 21 THR CA C -1.983 -0.829 11.109 1.00 . A A . 21 THR CA 1 1 1 251 1 1 21 THR CB C -2.583 -0.424 12.462 1.00 . A A . 21 THR CB 1 1 1 252 1 1 21 THR CG2 C -3.546 0.728 12.286 1.00 . A A . 21 THR CG2 1 1 1 253 1 1 21 THR H H -1.092 1.051 10.659 1.00 . A A . 21 THR H 1 1 1 254 1 1 21 THR HA H -1.607 -1.816 11.279 1.00 . A A . 21 THR HA 1 1 1 255 1 1 21 THR HB H -1.775 -0.102 13.119 1.00 . A A . 21 THR HB 1 1 1 256 1 1 21 THR HG1 H -2.533 -2.050 13.489 1.00 . A A . 21 THR HG1 1 1 1 257 1 1 21 THR HG21 H -3.029 1.511 11.743 1.00 . A A . 21 THR HG21 1 1 1 258 1 1 21 THR HG22 H -4.399 0.375 11.710 1.00 . A A . 21 THR HG22 1 1 1 259 1 1 21 THR HG23 H -3.869 1.081 13.262 1.00 . A A . 21 THR HG23 1 1 1 260 1 1 21 THR N N -0.874 0.077 10.812 1.00 . A A . 21 THR N 1 1 1 261 1 1 21 THR O O -3.904 -1.737 9.973 1.00 . A A . 21 THR O 1 1 1 262 1 1 21 THR OG1 O -3.239 -1.490 13.106 1.00 . A A . 21 THR OG1 1 1 1 263 1 1 22 GLY C C -3.582 -1.316 6.779 1.00 . A A . 22 GLY C 1 1 1 264 1 1 22 GLY CA C -3.618 -0.093 7.697 1.00 . A A . 22 GLY CA 1 1 1 265 1 1 22 GLY H H -1.956 0.451 8.851 1.00 . A A . 22 GLY H 1 1 1 266 1 1 22 GLY HA2 H -3.280 0.755 7.120 1.00 . A A . 22 GLY HA2 1 1 1 267 1 1 22 GLY HA3 H -4.640 0.072 8.030 1.00 . A A . 22 GLY HA3 1 1 1 268 1 1 22 GLY N N -2.749 -0.174 8.859 1.00 . A A . 22 GLY N 1 1 1 269 1 1 22 GLY O O -2.914 -2.304 7.094 1.00 . A A . 22 GLY O 1 1 1 270 1 1 23 PRO C C -2.974 -2.469 3.945 1.00 . A A . 23 PRO C 1 1 1 271 1 1 23 PRO CA C -4.319 -2.349 4.670 1.00 . A A . 23 PRO CA 1 1 1 272 1 1 23 PRO CB C -5.496 -2.025 3.747 1.00 . A A . 23 PRO CB 1 1 1 273 1 1 23 PRO CD C -5.051 -0.113 5.149 1.00 . A A . 23 PRO CD 1 1 1 274 1 1 23 PRO CG C -5.644 -0.508 3.805 1.00 . A A . 23 PRO CG 1 1 1 275 1 1 23 PRO HA H -4.520 -3.289 5.188 1.00 . A A . 23 PRO HA 1 1 1 276 1 1 23 PRO HB2 H -5.320 -2.354 2.728 1.00 . A A . 23 PRO HB2 1 1 1 277 1 1 23 PRO HB3 H -6.398 -2.490 4.145 1.00 . A A . 23 PRO HB3 1 1 1 278 1 1 23 PRO HD2 H -4.422 0.761 4.991 1.00 . A A . 23 PRO HD2 1 1 1 279 1 1 23 PRO HD3 H -5.848 0.130 5.848 1.00 . A A . 23 PRO HD3 1 1 1 280 1 1 23 PRO HG2 H -5.077 -0.038 3.000 1.00 . A A . 23 PRO HG2 1 1 1 281 1 1 23 PRO HG3 H -6.688 -0.216 3.752 1.00 . A A . 23 PRO HG3 1 1 1 282 1 1 23 PRO N N -4.275 -1.254 5.626 1.00 . A A . 23 PRO N 1 1 1 283 1 1 23 PRO O O -2.241 -3.437 4.146 1.00 . A A . 23 PRO O 1 1 1 284 1 1 24 CYS C C -0.411 -0.789 3.891 1.00 . A A . 24 CYS C 1 1 1 285 1 1 24 CYS CA C -1.221 -1.298 2.702 1.00 . A A . 24 CYS CA 1 1 1 286 1 1 24 CYS CB C -1.111 -0.359 1.486 1.00 . A A . 24 CYS CB 1 1 1 287 1 1 24 CYS H H -3.202 -0.658 3.075 1.00 . A A . 24 CYS H 1 1 1 288 1 1 24 CYS HA H -0.821 -2.270 2.414 1.00 . A A . 24 CYS HA 1 1 1 289 1 1 24 CYS HB2 H -1.972 0.309 1.432 1.00 . A A . 24 CYS HB2 1 1 1 290 1 1 24 CYS HB3 H -0.229 0.271 1.606 1.00 . A A . 24 CYS HB3 1 1 1 291 1 1 24 CYS N N -2.596 -1.460 3.150 1.00 . A A . 24 CYS N 1 1 1 292 1 1 24 CYS O O -0.132 0.403 3.992 1.00 . A A . 24 CYS O 1 1 1 293 1 1 24 CYS SG S -0.884 -1.206 -0.094 1.00 . A A . 24 CYS SG 1 1 1 294 1 1 25 ALA C C 2.045 -2.343 5.878 1.00 . A A . 25 ALA C 1 1 1 295 1 1 25 ALA CA C 0.854 -1.402 5.910 1.00 . A A . 25 ALA CA 1 1 1 296 1 1 25 ALA CB C 0.124 -1.406 7.247 1.00 . A A . 25 ALA CB 1 1 1 297 1 1 25 ALA H H -0.473 -2.611 4.730 1.00 . A A . 25 ALA H 1 1 1 298 1 1 25 ALA HA H 1.263 -0.408 5.769 1.00 . A A . 25 ALA HA 1 1 1 299 1 1 25 ALA HB1 H 0.831 -1.197 8.047 1.00 . A A . 25 ALA HB1 1 1 1 300 1 1 25 ALA HB2 H -0.335 -2.379 7.414 1.00 . A A . 25 ALA HB2 1 1 1 301 1 1 25 ALA HB3 H -0.641 -0.633 7.237 1.00 . A A . 25 ALA HB3 1 1 1 302 1 1 25 ALA N N -0.063 -1.684 4.816 1.00 . A A . 25 ALA N 1 1 1 303 1 1 25 ALA O O 3.182 -1.875 5.834 1.00 . A A . 25 ALA O 1 1 1 304 1 1 26 ASN C C 3.601 -4.366 4.278 1.00 . A A . 26 ASN C 1 1 1 305 1 1 26 ASN CA C 2.939 -4.580 5.643 1.00 . A A . 26 ASN CA 1 1 1 306 1 1 26 ASN CB C 2.517 -6.043 5.796 1.00 . A A . 26 ASN CB 1 1 1 307 1 1 26 ASN CG C 1.765 -6.533 4.569 1.00 . A A . 26 ASN CG 1 1 1 308 1 1 26 ASN H H 0.876 -4.022 5.871 1.00 . A A . 26 ASN H 1 1 1 309 1 1 26 ASN HA H 3.675 -4.346 6.416 1.00 . A A . 26 ASN HA 1 1 1 310 1 1 26 ASN HB2 H 3.413 -6.647 5.945 1.00 . A A . 26 ASN HB2 1 1 1 311 1 1 26 ASN HB3 H 1.889 -6.151 6.679 1.00 . A A . 26 ASN HB3 1 1 1 312 1 1 26 ASN HD21 H 3.337 -7.639 3.865 1.00 . A A . 26 ASN HD21 1 1 1 313 1 1 26 ASN HD22 H 1.875 -7.647 2.901 1.00 . A A . 26 ASN HD22 1 1 1 314 1 1 26 ASN N N 1.821 -3.659 5.833 1.00 . A A . 26 ASN N 1 1 1 315 1 1 26 ASN ND2 N 2.382 -7.338 3.721 1.00 . A A . 26 ASN ND2 1 1 1 316 1 1 26 ASN O O 4.805 -4.575 4.166 1.00 . A A . 26 ASN O 1 1 1 317 1 1 26 ASN OD1 O 0.625 -6.139 4.358 1.00 . A A . 26 ASN OD1 1 1 1 318 1 1 27 CYS C C 4.418 -2.328 2.071 1.00 . A A . 27 CYS C 1 1 1 319 1 1 27 CYS CA C 3.404 -3.480 1.980 1.00 . A A . 27 CYS CA 1 1 1 320 1 1 27 CYS CB C 2.300 -3.061 0.981 1.00 . A A . 27 CYS CB 1 1 1 321 1 1 27 CYS H H 1.862 -3.781 3.416 1.00 . A A . 27 CYS H 1 1 1 322 1 1 27 CYS HA H 3.921 -4.348 1.567 1.00 . A A . 27 CYS HA 1 1 1 323 1 1 27 CYS HB2 H 1.959 -2.044 1.183 1.00 . A A . 27 CYS HB2 1 1 1 324 1 1 27 CYS HB3 H 2.775 -2.987 0.003 1.00 . A A . 27 CYS HB3 1 1 1 325 1 1 27 CYS N N 2.858 -3.865 3.278 1.00 . A A . 27 CYS N 1 1 1 326 1 1 27 CYS O O 4.787 -1.821 1.023 1.00 . A A . 27 CYS O 1 1 1 327 1 1 27 CYS SG S 0.840 -4.120 0.793 1.00 . A A . 27 CYS SG 1 1 1 328 1 1 28 LEU C C 6.968 -0.919 3.961 1.00 . A A . 28 LEU C 1 1 1 329 1 1 28 LEU CA C 5.600 -0.605 3.384 1.00 . A A . 28 LEU CA 1 1 1 330 1 1 28 LEU CB C 4.895 0.421 4.284 1.00 . A A . 28 LEU CB 1 1 1 331 1 1 28 LEU CD1 C 3.866 2.554 3.488 1.00 . A A . 28 LEU CD1 1 1 1 332 1 1 28 LEU CD2 C 2.969 0.469 2.485 1.00 . A A . 28 LEU CD2 1 1 1 333 1 1 28 LEU CG C 3.612 1.072 3.730 1.00 . A A . 28 LEU CG 1 1 1 334 1 1 28 LEU H H 4.424 -2.221 4.097 1.00 . A A . 28 LEU H 1 1 1 335 1 1 28 LEU HA H 5.754 -0.153 2.404 1.00 . A A . 28 LEU HA 1 1 1 336 1 1 28 LEU HB2 H 4.669 -0.026 5.251 1.00 . A A . 28 LEU HB2 1 1 1 337 1 1 28 LEU HB3 H 5.620 1.204 4.514 1.00 . A A . 28 LEU HB3 1 1 1 338 1 1 28 LEU HD11 H 4.177 3.004 4.432 1.00 . A A . 28 LEU HD11 1 1 1 339 1 1 28 LEU HD12 H 4.659 2.659 2.746 1.00 . A A . 28 LEU HD12 1 1 1 340 1 1 28 LEU HD13 H 2.956 3.039 3.147 1.00 . A A . 28 LEU HD13 1 1 1 341 1 1 28 LEU HD21 H 3.662 0.480 1.639 1.00 . A A . 28 LEU HD21 1 1 1 342 1 1 28 LEU HD22 H 2.637 -0.539 2.703 1.00 . A A . 28 LEU HD22 1 1 1 343 1 1 28 LEU HD23 H 2.069 1.025 2.248 1.00 . A A . 28 LEU HD23 1 1 1 344 1 1 28 LEU HG H 2.861 0.982 4.499 1.00 . A A . 28 LEU HG 1 1 1 345 1 1 28 LEU N N 4.803 -1.822 3.251 1.00 . A A . 28 LEU N 1 1 1 346 1 1 28 LEU O O 7.990 -0.574 3.364 1.00 . A A . 28 LEU O 1 1 1 347 1 1 29 ALA C C 8.834 -3.056 5.103 1.00 . A A . 29 ALA C 1 1 1 348 1 1 29 ALA CA C 8.213 -1.871 5.836 1.00 . A A . 29 ALA CA 1 1 1 349 1 1 29 ALA CB C 7.905 -2.167 7.305 1.00 . A A . 29 ALA CB 1 1 1 350 1 1 29 ALA H H 6.107 -1.768 5.576 1.00 . A A . 29 ALA H 1 1 1 351 1 1 29 ALA HA H 8.912 -1.037 5.793 1.00 . A A . 29 ALA HA 1 1 1 352 1 1 29 ALA HB1 H 8.811 -2.517 7.794 1.00 . A A . 29 ALA HB1 1 1 1 353 1 1 29 ALA HB2 H 7.132 -2.929 7.393 1.00 . A A . 29 ALA HB2 1 1 1 354 1 1 29 ALA HB3 H 7.574 -1.257 7.806 1.00 . A A . 29 ALA HB3 1 1 1 355 1 1 29 ALA N N 6.986 -1.516 5.152 1.00 . A A . 29 ALA N 1 1 1 356 1 1 29 ALA O O 9.785 -2.908 4.334 1.00 . A A . 29 ALA O 1 1 1 357 1 1 30 GLY C C 8.126 -5.551 3.254 1.00 . A A . 30 GLY C 1 1 1 358 1 1 30 GLY CA C 8.705 -5.450 4.648 1.00 . A A . 30 GLY CA 1 1 1 359 1 1 30 GLY H H 7.434 -4.309 5.873 1.00 . A A . 30 GLY H 1 1 1 360 1 1 30 GLY HA2 H 8.334 -6.292 5.226 1.00 . A A . 30 GLY HA2 1 1 1 361 1 1 30 GLY HA3 H 9.795 -5.484 4.605 1.00 . A A . 30 GLY HA3 1 1 1 362 1 1 30 GLY N N 8.252 -4.238 5.286 1.00 . A A . 30 GLY N 1 1 1 363 1 1 30 GLY O O 7.291 -6.427 3.030 1.00 . A A . 30 GLY O 1 1 1 364 1 1 31 TYR C C 8.921 -5.031 -0.164 1.00 . A A . 31 TYR C 1 1 1 365 1 1 31 TYR CA C 7.961 -4.682 0.988 1.00 . A A . 31 TYR CA 1 1 1 366 1 1 31 TYR CB C 7.406 -3.248 0.897 1.00 . A A . 31 TYR CB 1 1 1 367 1 1 31 TYR CD1 C 9.696 -2.189 0.409 1.00 . A A . 31 TYR CD1 1 1 1 368 1 1 31 TYR CD2 C 7.654 -1.147 -0.392 1.00 . A A . 31 TYR CD2 1 1 1 369 1 1 31 TYR CE1 C 10.444 -1.201 -0.264 1.00 . A A . 31 TYR CE1 1 1 1 370 1 1 31 TYR CE2 C 8.381 -0.204 -1.117 1.00 . A A . 31 TYR CE2 1 1 1 371 1 1 31 TYR CG C 8.291 -2.146 0.351 1.00 . A A . 31 TYR CG 1 1 1 372 1 1 31 TYR CZ C 9.792 -0.198 -1.023 1.00 . A A . 31 TYR CZ 1 1 1 373 1 1 31 TYR H H 9.266 -4.028 2.546 1.00 . A A . 31 TYR H 1 1 1 374 1 1 31 TYR HA H 7.127 -5.357 0.922 1.00 . A A . 31 TYR HA 1 1 1 375 1 1 31 TYR HB2 H 6.543 -3.282 0.243 1.00 . A A . 31 TYR HB2 1 1 1 376 1 1 31 TYR HB3 H 7.038 -2.928 1.872 1.00 . A A . 31 TYR HB3 1 1 1 377 1 1 31 TYR HD1 H 10.181 -3.039 0.877 1.00 . A A . 31 TYR HD1 1 1 1 378 1 1 31 TYR HD2 H 6.584 -1.153 -0.430 1.00 . A A . 31 TYR HD2 1 1 1 379 1 1 31 TYR HE1 H 11.518 -1.259 -0.260 1.00 . A A . 31 TYR HE1 1 1 1 380 1 1 31 TYR HE2 H 7.830 0.477 -1.767 1.00 . A A . 31 TYR HE2 1 1 1 381 1 1 31 TYR HH H 11.426 0.833 -1.472 1.00 . A A . 31 TYR HH 1 1 1 382 1 1 31 TYR N N 8.567 -4.714 2.312 1.00 . A A . 31 TYR N 1 1 1 383 1 1 31 TYR O O 8.820 -4.449 -1.249 1.00 . A A . 31 TYR O 1 1 1 384 1 1 31 TYR OH O 10.499 0.718 -1.748 1.00 . A A . 31 TYR OH 1 1 1 385 1 1 32 PRO C C 9.873 -7.040 -2.340 1.00 . A A . 32 PRO C 1 1 1 386 1 1 32 PRO CA C 10.629 -6.452 -1.144 1.00 . A A . 32 PRO CA 1 1 1 387 1 1 32 PRO CB C 11.610 -7.449 -0.524 1.00 . A A . 32 PRO CB 1 1 1 388 1 1 32 PRO CD C 9.790 -7.080 1.002 1.00 . A A . 32 PRO CD 1 1 1 389 1 1 32 PRO CG C 10.789 -8.145 0.564 1.00 . A A . 32 PRO CG 1 1 1 390 1 1 32 PRO HA H 11.159 -5.536 -1.416 1.00 . A A . 32 PRO HA 1 1 1 391 1 1 32 PRO HB2 H 11.996 -8.156 -1.259 1.00 . A A . 32 PRO HB2 1 1 1 392 1 1 32 PRO HB3 H 12.432 -6.904 -0.060 1.00 . A A . 32 PRO HB3 1 1 1 393 1 1 32 PRO HD2 H 8.815 -7.510 1.215 1.00 . A A . 32 PRO HD2 1 1 1 394 1 1 32 PRO HD3 H 10.179 -6.575 1.881 1.00 . A A . 32 PRO HD3 1 1 1 395 1 1 32 PRO HG2 H 10.265 -9.008 0.152 1.00 . A A . 32 PRO HG2 1 1 1 396 1 1 32 PRO HG3 H 11.422 -8.427 1.403 1.00 . A A . 32 PRO HG3 1 1 1 397 1 1 32 PRO N N 9.678 -6.137 -0.092 1.00 . A A . 32 PRO N 1 1 1 398 1 1 32 PRO O O 10.220 -6.783 -3.490 1.00 . A A . 32 PRO O 1 1 1 399 1 1 33 ALA C C 6.696 -7.570 -3.323 1.00 . A A . 33 ALA C 1 1 1 400 1 1 33 ALA CA C 7.915 -8.438 -2.991 1.00 . A A . 33 ALA CA 1 1 1 401 1 1 33 ALA CB C 7.465 -9.763 -2.375 1.00 . A A . 33 ALA CB 1 1 1 402 1 1 33 ALA H H 8.582 -7.879 -1.065 1.00 . A A . 33 ALA H 1 1 1 403 1 1 33 ALA HA H 8.460 -8.646 -3.913 1.00 . A A . 33 ALA HA 1 1 1 404 1 1 33 ALA HB1 H 6.882 -10.327 -3.103 1.00 . A A . 33 ALA HB1 1 1 1 405 1 1 33 ALA HB2 H 8.331 -10.356 -2.084 1.00 . A A . 33 ALA HB2 1 1 1 406 1 1 33 ALA HB3 H 6.853 -9.561 -1.496 1.00 . A A . 33 ALA HB3 1 1 1 407 1 1 33 ALA N N 8.805 -7.785 -2.047 1.00 . A A . 33 ALA N 1 1 1 408 1 1 33 ALA O O 5.776 -8.040 -3.994 1.00 . A A . 33 ALA O 1 1 1 409 1 1 34 GLY C C 5.052 -5.073 -4.251 1.00 . A A . 34 GLY C 1 1 1 410 1 1 34 GLY CA C 5.351 -5.591 -2.848 1.00 . A A . 34 GLY CA 1 1 1 411 1 1 34 GLY H H 7.362 -5.982 -2.240 1.00 . A A . 34 GLY H 1 1 1 412 1 1 34 GLY HA2 H 5.392 -4.755 -2.160 1.00 . A A . 34 GLY HA2 1 1 1 413 1 1 34 GLY HA3 H 4.524 -6.225 -2.535 1.00 . A A . 34 GLY HA3 1 1 1 414 1 1 34 GLY N N 6.591 -6.355 -2.774 1.00 . A A . 34 GLY N 1 1 1 415 1 1 34 GLY O O 3.890 -4.851 -4.563 1.00 . A A . 34 GLY O 1 1 1 416 1 1 35 CYS C C 5.572 -5.577 -7.401 1.00 . A A . 35 CYS C 1 1 1 417 1 1 35 CYS CA C 5.959 -4.423 -6.465 1.00 . A A . 35 CYS CA 1 1 1 418 1 1 35 CYS CB C 7.309 -3.813 -6.861 1.00 . A A . 35 CYS CB 1 1 1 419 1 1 35 CYS H H 7.007 -4.988 -4.717 1.00 . A A . 35 CYS H 1 1 1 420 1 1 35 CYS HA H 5.192 -3.648 -6.521 1.00 . A A . 35 CYS HA 1 1 1 421 1 1 35 CYS HB2 H 8.040 -4.615 -6.965 1.00 . A A . 35 CYS HB2 1 1 1 422 1 1 35 CYS HB3 H 7.220 -3.322 -7.832 1.00 . A A . 35 CYS HB3 1 1 1 423 1 1 35 CYS N N 6.076 -4.884 -5.084 1.00 . A A . 35 CYS N 1 1 1 424 1 1 35 CYS O O 4.729 -5.413 -8.283 1.00 . A A . 35 CYS O 1 1 1 425 1 1 35 CYS SG S 7.928 -2.623 -5.638 1.00 . A A . 35 CYS SG 1 1 1 426 1 1 36 SER C C 4.487 -8.602 -7.486 1.00 . A A . 36 SER C 1 1 1 427 1 1 36 SER CA C 5.834 -7.997 -7.899 1.00 . A A . 36 SER CA 1 1 1 428 1 1 36 SER CB C 6.984 -8.954 -7.622 1.00 . A A . 36 SER CB 1 1 1 429 1 1 36 SER H H 6.814 -6.878 -6.431 1.00 . A A . 36 SER H 1 1 1 430 1 1 36 SER HA H 5.810 -7.780 -8.970 1.00 . A A . 36 SER HA 1 1 1 431 1 1 36 SER HB2 H 6.895 -9.842 -8.246 1.00 . A A . 36 SER HB2 1 1 1 432 1 1 36 SER HB3 H 7.882 -8.409 -7.871 1.00 . A A . 36 SER HB3 1 1 1 433 1 1 36 SER HG H 7.902 -9.809 -6.118 1.00 . A A . 36 SER HG 1 1 1 434 1 1 36 SER N N 6.143 -6.765 -7.176 1.00 . A A . 36 SER N 1 1 1 435 1 1 36 SER O O 4.032 -9.604 -8.041 1.00 . A A . 36 SER O 1 1 1 436 1 1 36 SER OG O 7.062 -9.314 -6.255 1.00 . A A . 36 SER OG 1 1 1 437 1 1 37 ASN C C 1.479 -7.729 -6.976 1.00 . A A . 37 ASN C 1 1 1 438 1 1 37 ASN CA C 2.523 -8.275 -5.995 1.00 . A A . 37 ASN CA 1 1 1 439 1 1 37 ASN CB C 2.328 -7.612 -4.606 1.00 . A A . 37 ASN CB 1 1 1 440 1 1 37 ASN CG C 1.345 -8.382 -3.745 1.00 . A A . 37 ASN CG 1 1 1 441 1 1 37 ASN H H 4.423 -7.223 -6.126 1.00 . A A . 37 ASN H 1 1 1 442 1 1 37 ASN HA H 2.428 -9.355 -5.941 1.00 . A A . 37 ASN HA 1 1 1 443 1 1 37 ASN HB2 H 3.268 -7.510 -4.064 1.00 . A A . 37 ASN HB2 1 1 1 444 1 1 37 ASN HB3 H 1.957 -6.599 -4.751 1.00 . A A . 37 ASN HB3 1 1 1 445 1 1 37 ASN HD21 H 0.957 -6.808 -2.516 1.00 . A A . 37 ASN HD21 1 1 1 446 1 1 37 ASN HD22 H 0.055 -8.262 -2.206 1.00 . A A . 37 ASN HD22 1 1 1 447 1 1 37 ASN N N 3.854 -7.966 -6.503 1.00 . A A . 37 ASN N 1 1 1 448 1 1 37 ASN ND2 N 0.685 -7.739 -2.798 1.00 . A A . 37 ASN ND2 1 1 1 449 1 1 37 ASN O O 1.848 -7.242 -8.049 1.00 . A A . 37 ASN O 1 1 1 450 1 1 37 ASN OD1 O 1.174 -9.583 -3.917 1.00 . A A . 37 ASN OD1 1 1 1 451 1 1 38 SER C C -1.439 -5.897 -6.199 1.00 . A A . 38 SER C 1 1 1 452 1 1 38 SER CA C -0.756 -6.789 -7.236 1.00 . A A . 38 SER CA 1 1 1 453 1 1 38 SER CB C -1.759 -7.519 -8.116 1.00 . A A . 38 SER CB 1 1 1 454 1 1 38 SER H H -0.120 -8.212 -5.794 1.00 . A A . 38 SER H 1 1 1 455 1 1 38 SER HA H -0.203 -6.120 -7.902 1.00 . A A . 38 SER HA 1 1 1 456 1 1 38 SER HB2 H -1.930 -8.502 -7.705 1.00 . A A . 38 SER HB2 1 1 1 457 1 1 38 SER HB3 H -2.691 -6.956 -8.142 1.00 . A A . 38 SER HB3 1 1 1 458 1 1 38 SER HG H -1.399 -8.524 -9.779 1.00 . A A . 38 SER HG 1 1 1 459 1 1 38 SER N N 0.190 -7.722 -6.626 1.00 . A A . 38 SER N 1 1 1 460 1 1 38 SER O O -1.454 -4.692 -6.415 1.00 . A A . 38 SER O 1 1 1 461 1 1 38 SER OG O -1.254 -7.619 -9.430 1.00 . A A . 38 SER OG 1 1 1 462 1 1 39 ASP C C -2.063 -4.474 -3.557 1.00 . A A . 39 ASP C 1 1 1 463 1 1 39 ASP CA C -2.818 -5.665 -4.156 1.00 . A A . 39 ASP CA 1 1 1 464 1 1 39 ASP CB C -3.344 -6.600 -3.051 1.00 . A A . 39 ASP CB 1 1 1 465 1 1 39 ASP CG C -4.375 -5.991 -2.083 1.00 . A A . 39 ASP CG 1 1 1 466 1 1 39 ASP H H -1.926 -7.436 -4.954 1.00 . A A . 39 ASP H 1 1 1 467 1 1 39 ASP HA H -3.677 -5.278 -4.704 1.00 . A A . 39 ASP HA 1 1 1 468 1 1 39 ASP HB2 H -3.814 -7.463 -3.526 1.00 . A A . 39 ASP HB2 1 1 1 469 1 1 39 ASP HB3 H -2.494 -6.965 -2.469 1.00 . A A . 39 ASP HB3 1 1 1 470 1 1 39 ASP N N -1.966 -6.430 -5.089 1.00 . A A . 39 ASP N 1 1 1 471 1 1 39 ASP O O -2.599 -3.376 -3.452 1.00 . A A . 39 ASP O 1 1 1 472 1 1 39 ASP OD1 O -5.056 -4.989 -2.386 1.00 . A A . 39 ASP OD1 1 1 1 473 1 1 39 ASP OD2 O -4.609 -6.618 -1.021 1.00 . A A . 39 ASP OD2 1 1 1 474 1 1 40 CYS C C 0.527 -2.673 -3.883 1.00 . A A . 40 CYS C 1 1 1 475 1 1 40 CYS CA C 0.113 -3.620 -2.761 1.00 . A A . 40 CYS CA 1 1 1 476 1 1 40 CYS CB C 1.409 -4.256 -2.224 1.00 . A A . 40 CYS CB 1 1 1 477 1 1 40 CYS H H -0.375 -5.498 -3.652 1.00 . A A . 40 CYS H 1 1 1 478 1 1 40 CYS HA H -0.392 -3.033 -1.991 1.00 . A A . 40 CYS HA 1 1 1 479 1 1 40 CYS HB2 H 1.874 -4.830 -3.031 1.00 . A A . 40 CYS HB2 1 1 1 480 1 1 40 CYS HB3 H 2.096 -3.442 -2.002 1.00 . A A . 40 CYS HB3 1 1 1 481 1 1 40 CYS N N -0.775 -4.664 -3.263 1.00 . A A . 40 CYS N 1 1 1 482 1 1 40 CYS O O 0.828 -1.512 -3.652 1.00 . A A . 40 CYS O 1 1 1 483 1 1 40 CYS SG S 1.336 -5.334 -0.762 1.00 . A A . 40 CYS SG 1 1 1 484 1 1 41 THR C C 1.131 -1.304 -6.581 1.00 . A A . 41 THR C 1 1 1 485 1 1 41 THR CA C 1.523 -2.684 -6.108 1.00 . A A . 41 THR CA 1 1 1 486 1 1 41 THR CB C 1.456 -3.695 -7.233 1.00 . A A . 41 THR CB 1 1 1 487 1 1 41 THR CG2 C 2.234 -3.386 -8.488 1.00 . A A . 41 THR CG2 1 1 1 488 1 1 41 THR H H 0.306 -4.128 -5.270 1.00 . A A . 41 THR H 1 1 1 489 1 1 41 THR HA H 2.539 -2.647 -5.716 1.00 . A A . 41 THR HA 1 1 1 490 1 1 41 THR HB H 0.424 -3.784 -7.536 1.00 . A A . 41 THR HB 1 1 1 491 1 1 41 THR HG1 H 2.107 -5.514 -7.439 1.00 . A A . 41 THR HG1 1 1 1 492 1 1 41 THR HG21 H 3.293 -3.274 -8.266 1.00 . A A . 41 THR HG21 1 1 1 493 1 1 41 THR HG22 H 2.044 -4.230 -9.145 1.00 . A A . 41 THR HG22 1 1 1 494 1 1 41 THR HG23 H 1.859 -2.471 -8.950 1.00 . A A . 41 THR HG23 1 1 1 495 1 1 41 THR N N 0.638 -3.194 -5.090 1.00 . A A . 41 THR N 1 1 1 496 1 1 41 THR O O 2.026 -0.479 -6.730 1.00 . A A . 41 THR O 1 1 1 497 1 1 41 THR OG1 O 1.870 -4.925 -6.705 1.00 . A A . 41 THR OG1 1 1 1 498 1 1 42 ALA C C -0.261 1.343 -6.409 1.00 . A A . 42 ALA C 1 1 1 499 1 1 42 ALA CA C -0.535 0.234 -7.420 1.00 . A A . 42 ALA CA 1 1 1 500 1 1 42 ALA CB C -1.991 0.237 -7.883 1.00 . A A . 42 ALA CB 1 1 1 501 1 1 42 ALA H H -0.853 -1.746 -6.579 1.00 . A A . 42 ALA H 1 1 1 502 1 1 42 ALA HA H 0.096 0.412 -8.291 1.00 . A A . 42 ALA HA 1 1 1 503 1 1 42 ALA HB1 H -2.177 -0.613 -8.539 1.00 . A A . 42 ALA HB1 1 1 1 504 1 1 42 ALA HB2 H -2.667 0.209 -7.031 1.00 . A A . 42 ALA HB2 1 1 1 505 1 1 42 ALA HB3 H -2.174 1.158 -8.440 1.00 . A A . 42 ALA HB3 1 1 1 506 1 1 42 ALA N N -0.156 -1.053 -6.839 1.00 . A A . 42 ALA N 1 1 1 507 1 1 42 ALA O O 0.373 2.340 -6.741 1.00 . A A . 42 ALA O 1 1 1 508 1 1 43 PHE C C 1.208 2.201 -4.047 1.00 . A A . 43 PHE C 1 1 1 509 1 1 43 PHE CA C -0.294 1.933 -4.020 1.00 . A A . 43 PHE CA 1 1 1 510 1 1 43 PHE CB C -0.772 1.263 -2.720 1.00 . A A . 43 PHE CB 1 1 1 511 1 1 43 PHE CD1 C 0.971 1.806 -1.004 1.00 . A A . 43 PHE CD1 1 1 1 512 1 1 43 PHE CD2 C -1.286 2.540 -0.558 1.00 . A A . 43 PHE CD2 1 1 1 513 1 1 43 PHE CE1 C 1.420 2.381 0.186 1.00 . A A . 43 PHE CE1 1 1 1 514 1 1 43 PHE CE2 C -0.862 3.043 0.687 1.00 . A A . 43 PHE CE2 1 1 1 515 1 1 43 PHE CG C -0.361 1.921 -1.416 1.00 . A A . 43 PHE CG 1 1 1 516 1 1 43 PHE CZ C 0.497 2.982 1.048 1.00 . A A . 43 PHE CZ 1 1 1 517 1 1 43 PHE H H -1.092 0.211 -4.970 1.00 . A A . 43 PHE H 1 1 1 518 1 1 43 PHE HA H -0.793 2.894 -4.138 1.00 . A A . 43 PHE HA 1 1 1 519 1 1 43 PHE HB2 H -1.853 1.138 -2.753 1.00 . A A . 43 PHE HB2 1 1 1 520 1 1 43 PHE HB3 H -0.344 0.270 -2.685 1.00 . A A . 43 PHE HB3 1 1 1 521 1 1 43 PHE HD1 H 1.643 1.251 -1.618 1.00 . A A . 43 PHE HD1 1 1 1 522 1 1 43 PHE HD2 H -2.326 2.603 -0.836 1.00 . A A . 43 PHE HD2 1 1 1 523 1 1 43 PHE HE1 H 2.465 2.332 0.453 1.00 . A A . 43 PHE HE1 1 1 1 524 1 1 43 PHE HE2 H -1.587 3.493 1.348 1.00 . A A . 43 PHE HE2 1 1 1 525 1 1 43 PHE HZ H 0.863 3.367 1.982 1.00 . A A . 43 PHE HZ 1 1 1 526 1 1 43 PHE N N -0.643 1.094 -5.152 1.00 . A A . 43 PHE N 1 1 1 527 1 1 43 PHE O O 1.603 3.359 -4.057 1.00 . A A . 43 PHE O 1 1 1 528 1 1 44 LEU C C 4.027 2.164 -5.215 1.00 . A A . 44 LEU C 1 1 1 529 1 1 44 LEU CA C 3.501 1.416 -3.988 1.00 . A A . 44 LEU CA 1 1 1 530 1 1 44 LEU CB C 4.282 0.115 -3.765 1.00 . A A . 44 LEU CB 1 1 1 531 1 1 44 LEU CD1 C 4.689 -1.978 -2.472 1.00 . A A . 44 LEU CD1 1 1 1 532 1 1 44 LEU CD2 C 3.982 0.078 -1.195 1.00 . A A . 44 LEU CD2 1 1 1 533 1 1 44 LEU CG C 3.872 -0.686 -2.515 1.00 . A A . 44 LEU CG 1 1 1 534 1 1 44 LEU H H 1.743 0.219 -3.917 1.00 . A A . 44 LEU H 1 1 1 535 1 1 44 LEU HA H 3.659 2.068 -3.134 1.00 . A A . 44 LEU HA 1 1 1 536 1 1 44 LEU HB2 H 4.200 -0.529 -4.640 1.00 . A A . 44 LEU HB2 1 1 1 537 1 1 44 LEU HB3 H 5.322 0.391 -3.692 1.00 . A A . 44 LEU HB3 1 1 1 538 1 1 44 LEU HD11 H 5.756 -1.756 -2.498 1.00 . A A . 44 LEU HD11 1 1 1 539 1 1 44 LEU HD12 H 4.451 -2.541 -1.572 1.00 . A A . 44 LEU HD12 1 1 1 540 1 1 44 LEU HD13 H 4.430 -2.577 -3.342 1.00 . A A . 44 LEU HD13 1 1 1 541 1 1 44 LEU HD21 H 3.649 1.106 -1.263 1.00 . A A . 44 LEU HD21 1 1 1 542 1 1 44 LEU HD22 H 3.351 -0.404 -0.450 1.00 . A A . 44 LEU HD22 1 1 1 543 1 1 44 LEU HD23 H 5.007 0.084 -0.861 1.00 . A A . 44 LEU HD23 1 1 1 544 1 1 44 LEU HG H 2.837 -0.971 -2.602 1.00 . A A . 44 LEU HG 1 1 1 545 1 1 44 LEU N N 2.069 1.173 -4.056 1.00 . A A . 44 LEU N 1 1 1 546 1 1 44 LEU O O 4.924 2.994 -5.069 1.00 . A A . 44 LEU O 1 1 1 547 1 1 45 SER C C 3.602 4.106 -7.458 1.00 . A A . 45 SER C 1 1 1 548 1 1 45 SER CA C 3.755 2.593 -7.653 1.00 . A A . 45 SER CA 1 1 1 549 1 1 45 SER CB C 2.868 2.009 -8.765 1.00 . A A . 45 SER CB 1 1 1 550 1 1 45 SER H H 2.774 1.167 -6.408 1.00 . A A . 45 SER H 1 1 1 551 1 1 45 SER HA H 4.783 2.404 -7.931 1.00 . A A . 45 SER HA 1 1 1 552 1 1 45 SER HB2 H 2.715 0.948 -8.586 1.00 . A A . 45 SER HB2 1 1 1 553 1 1 45 SER HB3 H 1.898 2.495 -8.755 1.00 . A A . 45 SER HB3 1 1 1 554 1 1 45 SER HG H 3.974 1.312 -10.212 1.00 . A A . 45 SER HG 1 1 1 555 1 1 45 SER N N 3.479 1.895 -6.399 1.00 . A A . 45 SER N 1 1 1 556 1 1 45 SER O O 4.488 4.874 -7.847 1.00 . A A . 45 SER O 1 1 1 557 1 1 45 SER OG O 3.456 2.123 -10.046 1.00 . A A . 45 SER OG 1 1 1 558 1 1 46 GLN C C 3.490 6.080 -5.128 1.00 . A A . 46 GLN C 1 1 1 559 1 1 46 GLN CA C 2.455 5.905 -6.260 1.00 . A A . 46 GLN CA 1 1 1 560 1 1 46 GLN CB C 1.003 6.248 -5.860 1.00 . A A . 46 GLN CB 1 1 1 561 1 1 46 GLN CD C -0.468 5.261 -7.761 1.00 . A A . 46 GLN CD 1 1 1 562 1 1 46 GLN CG C 0.070 6.515 -7.063 1.00 . A A . 46 GLN CG 1 1 1 563 1 1 46 GLN H H 1.841 3.872 -6.476 1.00 . A A . 46 GLN H 1 1 1 564 1 1 46 GLN HA H 2.740 6.596 -7.052 1.00 . A A . 46 GLN HA 1 1 1 565 1 1 46 GLN HB2 H 0.576 5.465 -5.234 1.00 . A A . 46 GLN HB2 1 1 1 566 1 1 46 GLN HB3 H 1.033 7.166 -5.272 1.00 . A A . 46 GLN HB3 1 1 1 567 1 1 46 GLN HE21 H 1.131 5.075 -9.050 1.00 . A A . 46 GLN HE21 1 1 1 568 1 1 46 GLN HE22 H -0.099 3.822 -9.079 1.00 . A A . 46 GLN HE22 1 1 1 569 1 1 46 GLN HG2 H -0.791 7.080 -6.700 1.00 . A A . 46 GLN HG2 1 1 1 570 1 1 46 GLN HG3 H 0.581 7.147 -7.788 1.00 . A A . 46 GLN HG3 1 1 1 571 1 1 46 GLN N N 2.546 4.546 -6.769 1.00 . A A . 46 GLN N 1 1 1 572 1 1 46 GLN NE2 N 0.234 4.724 -8.745 1.00 . A A . 46 GLN NE2 1 1 1 573 1 1 46 GLN O O 4.584 6.596 -5.376 1.00 . A A . 46 GLN O 1 1 1 574 1 1 46 GLN OE1 O -1.553 4.785 -7.456 1.00 . A A . 46 GLN OE1 1 1 1 575 1 1 47 CYS C C 5.285 5.781 -2.490 1.00 . A A . 47 CYS C 1 1 1 576 1 1 47 CYS CA C 3.770 5.982 -2.633 1.00 . A A . 47 CYS CA 1 1 1 577 1 1 47 CYS CB C 3.056 5.222 -1.499 1.00 . A A . 47 CYS CB 1 1 1 578 1 1 47 CYS H H 2.321 5.065 -3.865 1.00 . A A . 47 CYS H 1 1 1 579 1 1 47 CYS HA H 3.568 7.045 -2.500 1.00 . A A . 47 CYS HA 1 1 1 580 1 1 47 CYS HB2 H 3.362 4.170 -1.514 1.00 . A A . 47 CYS HB2 1 1 1 581 1 1 47 CYS HB3 H 3.392 5.634 -0.549 1.00 . A A . 47 CYS HB3 1 1 1 582 1 1 47 CYS N N 3.186 5.595 -3.918 1.00 . A A . 47 CYS N 1 1 1 583 1 1 47 CYS O O 5.872 6.371 -1.578 1.00 . A A . 47 CYS O 1 1 1 584 1 1 47 CYS SG S 1.241 5.314 -1.529 1.00 . A A . 47 CYS SG 1 1 1 585 1 1 48 TYR C C 7.987 4.801 -4.718 1.00 . A A . 48 TYR C 1 1 1 586 1 1 48 TYR CA C 7.347 4.667 -3.339 1.00 . A A . 48 TYR CA 1 1 1 587 1 1 48 TYR CB C 7.582 3.231 -2.884 1.00 . A A . 48 TYR CB 1 1 1 588 1 1 48 TYR CD1 C 8.597 3.159 -0.587 1.00 . A A . 48 TYR CD1 1 1 1 589 1 1 48 TYR CD2 C 6.278 2.495 -0.869 1.00 . A A . 48 TYR CD2 1 1 1 590 1 1 48 TYR CE1 C 8.547 2.830 0.774 1.00 . A A . 48 TYR CE1 1 1 1 591 1 1 48 TYR CE2 C 6.242 2.070 0.469 1.00 . A A . 48 TYR CE2 1 1 1 592 1 1 48 TYR CG C 7.466 3.007 -1.401 1.00 . A A . 48 TYR CG 1 1 1 593 1 1 48 TYR CZ C 7.365 2.278 1.303 1.00 . A A . 48 TYR CZ 1 1 1 594 1 1 48 TYR H H 5.342 4.504 -4.037 1.00 . A A . 48 TYR H 1 1 1 595 1 1 48 TYR HA H 7.874 5.324 -2.648 1.00 . A A . 48 TYR HA 1 1 1 596 1 1 48 TYR HB2 H 6.909 2.557 -3.415 1.00 . A A . 48 TYR HB2 1 1 1 597 1 1 48 TYR HB3 H 8.591 2.940 -3.173 1.00 . A A . 48 TYR HB3 1 1 1 598 1 1 48 TYR HD1 H 9.520 3.498 -1.027 1.00 . A A . 48 TYR HD1 1 1 1 599 1 1 48 TYR HD2 H 5.436 2.348 -1.523 1.00 . A A . 48 TYR HD2 1 1 1 600 1 1 48 TYR HE1 H 9.421 2.951 1.397 1.00 . A A . 48 TYR HE1 1 1 1 601 1 1 48 TYR HE2 H 5.385 1.519 0.821 1.00 . A A . 48 TYR HE2 1 1 1 602 1 1 48 TYR HH H 7.738 1.065 2.754 1.00 . A A . 48 TYR HH 1 1 1 603 1 1 48 TYR N N 5.913 4.963 -3.336 1.00 . A A . 48 TYR N 1 1 1 604 1 1 48 TYR O O 9.215 4.880 -4.796 1.00 . A A . 48 TYR O 1 1 1 605 1 1 48 TYR OH O 7.324 1.931 2.611 1.00 . A A . 48 TYR OH 1 1 1 606 1 1 49 GLY C C 7.372 3.227 -7.723 1.00 . A A . 49 GLY C 1 1 1 607 1 1 49 GLY CA C 7.657 4.614 -7.157 1.00 . A A . 49 GLY CA 1 1 1 608 1 1 49 GLY H H 6.191 4.651 -5.649 1.00 . A A . 49 GLY H 1 1 1 609 1 1 49 GLY HA2 H 8.735 4.754 -7.185 1.00 . A A . 49 GLY HA2 1 1 1 610 1 1 49 GLY HA3 H 7.183 5.365 -7.788 1.00 . A A . 49 GLY HA3 1 1 1 611 1 1 49 GLY N N 7.186 4.766 -5.788 1.00 . A A . 49 GLY N 1 1 1 612 1 1 49 GLY O O 7.357 3.058 -8.941 1.00 . A A . 49 GLY O 1 1 1 613 1 1 50 GLY C C 8.175 0.241 -7.642 1.00 . A A . 50 GLY C 1 1 1 614 1 1 50 GLY CA C 6.853 0.869 -7.256 1.00 . A A . 50 GLY CA 1 1 1 615 1 1 50 GLY H H 7.076 2.471 -5.879 1.00 . A A . 50 GLY H 1 1 1 616 1 1 50 GLY HA2 H 6.181 0.830 -8.114 1.00 . A A . 50 GLY HA2 1 1 1 617 1 1 50 GLY HA3 H 6.412 0.317 -6.429 1.00 . A A . 50 GLY HA3 1 1 1 618 1 1 50 GLY N N 7.085 2.248 -6.861 1.00 . A A . 50 GLY N 1 1 1 619 1 1 50 GLY O O 8.333 -0.187 -8.787 1.00 . A A . 50 GLY O 1 1 1 620 1 1 51 CYS C C 11.099 0.559 -7.973 1.00 . A A . 51 CYS C 1 1 1 621 1 1 51 CYS CA C 10.462 -0.254 -6.843 1.00 . A A . 51 CYS CA 1 1 1 622 1 1 51 CYS CB C 10.532 -1.780 -7.049 1.00 . A A . 51 CYS CB 1 1 1 623 1 1 51 CYS H H 8.832 0.501 -5.731 1.00 . A A . 51 CYS H 1 1 1 624 1 1 51 CYS HA H 11.007 -0.009 -5.932 1.00 . A A . 51 CYS HA 1 1 1 625 1 1 51 CYS HB2 H 9.990 -2.039 -7.958 1.00 . A A . 51 CYS HB2 1 1 1 626 1 1 51 CYS HB3 H 11.572 -2.038 -7.226 1.00 . A A . 51 CYS HB3 1 1 1 627 1 1 51 CYS N N 9.080 0.158 -6.664 1.00 . A A . 51 CYS N 1 1 1 628 1 1 51 CYS O O 11.799 -0.045 -8.817 1.00 . A A . 51 CYS O 1 1 1 629 1 1 51 CYS OXT O 10.919 1.793 -8.000 1.00 . A A . 51 CYS OXT 1 1 1 630 1 1 51 CYS SG S 9.954 -2.829 -5.690 1.00 . A A . 51 CYS SG 1 1 2 631 1 1 1 GLY C C -7.998 -5.599 -0.761 1.00 . A A . 1 GLY C 1 1 2 632 1 1 1 GLY CA C -7.445 -6.655 -1.678 1.00 . A A . 1 GLY CA 1 1 2 633 1 1 1 GLY H1 H -9.242 -7.206 -2.458 1.00 . A A . 1 GLY H1 1 1 2 634 1 1 1 GLY H2 H -8.046 -8.315 -2.666 1.00 . A A . 1 GLY H2 1 1 2 635 1 1 1 GLY H3 H -8.751 -8.146 -1.186 1.00 . A A . 1 GLY H3 1 1 2 636 1 1 1 GLY HA2 H -7.107 -6.175 -2.597 1.00 . A A . 1 GLY HA2 1 1 2 637 1 1 1 GLY HA3 H -6.594 -7.148 -1.216 1.00 . A A . 1 GLY HA3 1 1 2 638 1 1 1 GLY N N -8.452 -7.655 -2.015 1.00 . A A . 1 GLY N 1 1 2 639 1 1 1 GLY O O -8.737 -4.734 -1.220 1.00 . A A . 1 GLY O 1 1 2 640 1 1 2 GLU C C -7.220 -3.250 0.941 1.00 . A A . 2 GLU C 1 1 2 641 1 1 2 GLU CA C -7.900 -4.525 1.440 1.00 . A A . 2 GLU CA 1 1 2 642 1 1 2 GLU CB C -7.508 -4.850 2.890 1.00 . A A . 2 GLU CB 1 1 2 643 1 1 2 GLU CD C -5.803 -5.968 4.408 1.00 . A A . 2 GLU CD 1 1 2 644 1 1 2 GLU CG C -6.060 -5.298 3.055 1.00 . A A . 2 GLU CG 1 1 2 645 1 1 2 GLU H H -6.974 -6.341 0.825 1.00 . A A . 2 GLU H 1 1 2 646 1 1 2 GLU HA H -8.964 -4.368 1.456 1.00 . A A . 2 GLU HA 1 1 2 647 1 1 2 GLU HB2 H -7.658 -3.953 3.488 1.00 . A A . 2 GLU HB2 1 1 2 648 1 1 2 GLU HB3 H -8.166 -5.639 3.253 1.00 . A A . 2 GLU HB3 1 1 2 649 1 1 2 GLU HG2 H -5.884 -6.009 2.260 1.00 . A A . 2 GLU HG2 1 1 2 650 1 1 2 GLU HG3 H -5.389 -4.453 2.918 1.00 . A A . 2 GLU HG3 1 1 2 651 1 1 2 GLU N N -7.625 -5.626 0.518 1.00 . A A . 2 GLU N 1 1 2 652 1 1 2 GLU O O -7.783 -2.161 1.006 1.00 . A A . 2 GLU O 1 1 2 653 1 1 2 GLU OE1 O -5.583 -5.260 5.422 1.00 . A A . 2 GLU OE1 1 1 2 654 1 1 2 GLU OE2 O -5.842 -7.215 4.467 1.00 . A A . 2 GLU OE2 1 1 2 655 1 1 3 CYS C C -5.913 -1.630 -1.316 1.00 . A A . 3 CYS C 1 1 2 656 1 1 3 CYS CA C -5.242 -2.266 -0.091 1.00 . A A . 3 CYS CA 1 1 2 657 1 1 3 CYS CB C -3.829 -2.754 -0.407 1.00 . A A . 3 CYS CB 1 1 2 658 1 1 3 CYS H H -5.599 -4.312 0.369 1.00 . A A . 3 CYS H 1 1 2 659 1 1 3 CYS HA H -5.200 -1.530 0.714 1.00 . A A . 3 CYS HA 1 1 2 660 1 1 3 CYS HB2 H -3.386 -3.170 0.498 1.00 . A A . 3 CYS HB2 1 1 2 661 1 1 3 CYS HB3 H -3.879 -3.539 -1.163 1.00 . A A . 3 CYS HB3 1 1 2 662 1 1 3 CYS N N -6.009 -3.390 0.400 1.00 . A A . 3 CYS N 1 1 2 663 1 1 3 CYS O O -5.922 -0.405 -1.459 1.00 . A A . 3 CYS O 1 1 2 664 1 1 3 CYS SG S -2.747 -1.457 -1.030 1.00 . A A . 3 CYS SG 1 1 2 665 1 1 4 GLU C C -8.555 -1.378 -3.015 1.00 . A A . 4 GLU C 1 1 2 666 1 1 4 GLU CA C -7.187 -1.965 -3.389 1.00 . A A . 4 GLU CA 1 1 2 667 1 1 4 GLU CB C -7.341 -3.100 -4.418 1.00 . A A . 4 GLU CB 1 1 2 668 1 1 4 GLU CD C -6.113 -4.309 -6.304 1.00 . A A . 4 GLU CD 1 1 2 669 1 1 4 GLU CG C -5.982 -3.592 -4.954 1.00 . A A . 4 GLU CG 1 1 2 670 1 1 4 GLU H H -6.424 -3.440 -2.058 1.00 . A A . 4 GLU H 1 1 2 671 1 1 4 GLU HA H -6.599 -1.159 -3.841 1.00 . A A . 4 GLU HA 1 1 2 672 1 1 4 GLU HB2 H -7.882 -3.941 -3.977 1.00 . A A . 4 GLU HB2 1 1 2 673 1 1 4 GLU HB3 H -7.927 -2.710 -5.248 1.00 . A A . 4 GLU HB3 1 1 2 674 1 1 4 GLU HG2 H -5.315 -2.735 -5.087 1.00 . A A . 4 GLU HG2 1 1 2 675 1 1 4 GLU HG3 H -5.533 -4.265 -4.222 1.00 . A A . 4 GLU HG3 1 1 2 676 1 1 4 GLU N N -6.487 -2.445 -2.204 1.00 . A A . 4 GLU N 1 1 2 677 1 1 4 GLU O O -8.967 -0.384 -3.620 1.00 . A A . 4 GLU O 1 1 2 678 1 1 4 GLU OE1 O -6.501 -3.638 -7.287 1.00 . A A . 4 GLU OE1 1 1 2 679 1 1 4 GLU OE2 O -5.771 -5.512 -6.412 1.00 . A A . 4 GLU OE2 1 1 2 680 1 1 5 GLN C C -10.233 -0.018 -0.881 1.00 . A A . 5 GLN C 1 1 2 681 1 1 5 GLN CA C -10.479 -1.413 -1.454 1.00 . A A . 5 GLN CA 1 1 2 682 1 1 5 GLN CB C -11.026 -2.369 -0.376 1.00 . A A . 5 GLN CB 1 1 2 683 1 1 5 GLN CD C -13.512 -2.491 -0.918 1.00 . A A . 5 GLN CD 1 1 2 684 1 1 5 GLN CG C -12.455 -2.030 0.084 1.00 . A A . 5 GLN CG 1 1 2 685 1 1 5 GLN H H -8.863 -2.786 -1.584 1.00 . A A . 5 GLN H 1 1 2 686 1 1 5 GLN HA H -11.207 -1.322 -2.262 1.00 . A A . 5 GLN HA 1 1 2 687 1 1 5 GLN HB2 H -11.016 -3.391 -0.757 1.00 . A A . 5 GLN HB2 1 1 2 688 1 1 5 GLN HB3 H -10.371 -2.330 0.495 1.00 . A A . 5 GLN HB3 1 1 2 689 1 1 5 GLN HE21 H -14.223 -0.591 -1.266 1.00 . A A . 5 GLN HE21 1 1 2 690 1 1 5 GLN HE22 H -15.026 -1.893 -2.099 1.00 . A A . 5 GLN HE22 1 1 2 691 1 1 5 GLN HG2 H -12.639 -2.544 1.028 1.00 . A A . 5 GLN HG2 1 1 2 692 1 1 5 GLN HG3 H -12.549 -0.960 0.273 1.00 . A A . 5 GLN HG3 1 1 2 693 1 1 5 GLN N N -9.235 -1.944 -2.009 1.00 . A A . 5 GLN N 1 1 2 694 1 1 5 GLN NE2 N -14.274 -1.582 -1.503 1.00 . A A . 5 GLN NE2 1 1 2 695 1 1 5 GLN O O -10.990 0.900 -1.182 1.00 . A A . 5 GLN O 1 1 2 696 1 1 5 GLN OE1 O -13.656 -3.686 -1.185 1.00 . A A . 5 GLN OE1 1 1 2 697 1 1 6 CYS C C -8.535 2.467 -0.630 1.00 . A A . 6 CYS C 1 1 2 698 1 1 6 CYS CA C -8.796 1.440 0.468 1.00 . A A . 6 CYS CA 1 1 2 699 1 1 6 CYS CB C -7.572 1.271 1.365 1.00 . A A . 6 CYS CB 1 1 2 700 1 1 6 CYS H H -8.626 -0.669 0.162 1.00 . A A . 6 CYS H 1 1 2 701 1 1 6 CYS HA H -9.630 1.793 1.073 1.00 . A A . 6 CYS HA 1 1 2 702 1 1 6 CYS HB2 H -7.766 0.440 2.033 1.00 . A A . 6 CYS HB2 1 1 2 703 1 1 6 CYS HB3 H -6.703 1.020 0.759 1.00 . A A . 6 CYS HB3 1 1 2 704 1 1 6 CYS N N -9.161 0.152 -0.104 1.00 . A A . 6 CYS N 1 1 2 705 1 1 6 CYS O O -8.996 3.602 -0.544 1.00 . A A . 6 CYS O 1 1 2 706 1 1 6 CYS SG S -7.211 2.740 2.361 1.00 . A A . 6 CYS SG 1 1 2 707 1 1 7 PHE C C -8.998 3.325 -3.447 1.00 . A A . 7 PHE C 1 1 2 708 1 1 7 PHE CA C -7.652 2.900 -2.870 1.00 . A A . 7 PHE CA 1 1 2 709 1 1 7 PHE CB C -6.787 2.183 -3.911 1.00 . A A . 7 PHE CB 1 1 2 710 1 1 7 PHE CD1 C -4.591 3.080 -3.024 1.00 . A A . 7 PHE CD1 1 1 2 711 1 1 7 PHE CD2 C -5.083 3.304 -5.397 1.00 . A A . 7 PHE CD2 1 1 2 712 1 1 7 PHE CE1 C -3.394 3.777 -3.218 1.00 . A A . 7 PHE CE1 1 1 2 713 1 1 7 PHE CE2 C -3.883 4.008 -5.586 1.00 . A A . 7 PHE CE2 1 1 2 714 1 1 7 PHE CG C -5.449 2.854 -4.117 1.00 . A A . 7 PHE CG 1 1 2 715 1 1 7 PHE CZ C -3.044 4.257 -4.491 1.00 . A A . 7 PHE CZ 1 1 2 716 1 1 7 PHE H H -7.465 1.119 -1.697 1.00 . A A . 7 PHE H 1 1 2 717 1 1 7 PHE HA H -7.140 3.811 -2.571 1.00 . A A . 7 PHE HA 1 1 2 718 1 1 7 PHE HB2 H -6.628 1.148 -3.620 1.00 . A A . 7 PHE HB2 1 1 2 719 1 1 7 PHE HB3 H -7.315 2.160 -4.863 1.00 . A A . 7 PHE HB3 1 1 2 720 1 1 7 PHE HD1 H -4.846 2.760 -2.024 1.00 . A A . 7 PHE HD1 1 1 2 721 1 1 7 PHE HD2 H -5.751 3.163 -6.233 1.00 . A A . 7 PHE HD2 1 1 2 722 1 1 7 PHE HE1 H -2.747 3.957 -2.375 1.00 . A A . 7 PHE HE1 1 1 2 723 1 1 7 PHE HE2 H -3.628 4.386 -6.566 1.00 . A A . 7 PHE HE2 1 1 2 724 1 1 7 PHE HZ H -2.131 4.821 -4.616 1.00 . A A . 7 PHE HZ 1 1 2 725 1 1 7 PHE N N -7.827 2.064 -1.689 1.00 . A A . 7 PHE N 1 1 2 726 1 1 7 PHE O O -9.198 4.508 -3.709 1.00 . A A . 7 PHE O 1 1 2 727 1 1 8 SER C C -12.095 3.519 -3.184 1.00 . A A . 8 SER C 1 1 2 728 1 1 8 SER CA C -11.260 2.613 -4.102 1.00 . A A . 8 SER CA 1 1 2 729 1 1 8 SER CB C -11.972 1.273 -4.327 1.00 . A A . 8 SER CB 1 1 2 730 1 1 8 SER H H -9.689 1.435 -3.298 1.00 . A A . 8 SER H 1 1 2 731 1 1 8 SER HA H -11.166 3.116 -5.065 1.00 . A A . 8 SER HA 1 1 2 732 1 1 8 SER HB2 H -12.203 0.803 -3.371 1.00 . A A . 8 SER HB2 1 1 2 733 1 1 8 SER HB3 H -12.904 1.475 -4.846 1.00 . A A . 8 SER HB3 1 1 2 734 1 1 8 SER HG H -10.436 0.092 -4.612 1.00 . A A . 8 SER HG 1 1 2 735 1 1 8 SER N N -9.922 2.374 -3.588 1.00 . A A . 8 SER N 1 1 2 736 1 1 8 SER O O -13.141 4.009 -3.617 1.00 . A A . 8 SER O 1 1 2 737 1 1 8 SER OG O -11.212 0.381 -5.121 1.00 . A A . 8 SER OG 1 1 2 738 1 1 9 ASP C C -11.384 5.990 -0.908 1.00 . A A . 9 ASP C 1 1 2 739 1 1 9 ASP CA C -12.267 4.740 -1.023 1.00 . A A . 9 ASP CA 1 1 2 740 1 1 9 ASP CB C -12.587 4.066 0.321 1.00 . A A . 9 ASP CB 1 1 2 741 1 1 9 ASP CG C -13.589 4.861 1.170 1.00 . A A . 9 ASP CG 1 1 2 742 1 1 9 ASP H H -10.821 3.317 -1.621 1.00 . A A . 9 ASP H 1 1 2 743 1 1 9 ASP HA H -13.209 5.071 -1.445 1.00 . A A . 9 ASP HA 1 1 2 744 1 1 9 ASP HB2 H -13.032 3.090 0.123 1.00 . A A . 9 ASP HB2 1 1 2 745 1 1 9 ASP HB3 H -11.666 3.900 0.875 1.00 . A A . 9 ASP HB3 1 1 2 746 1 1 9 ASP N N -11.666 3.773 -1.945 1.00 . A A . 9 ASP N 1 1 2 747 1 1 9 ASP O O -11.237 6.594 0.158 1.00 . A A . 9 ASP O 1 1 2 748 1 1 9 ASP OD1 O -14.373 5.657 0.606 1.00 . A A . 9 ASP OD1 1 1 2 749 1 1 9 ASP OD2 O -13.735 4.553 2.376 1.00 . A A . 9 ASP OD2 1 1 2 750 1 1 10 GLY C C -8.686 7.439 -1.426 1.00 . A A . 10 GLY C 1 1 2 751 1 1 10 GLY CA C -9.971 7.553 -2.236 1.00 . A A . 10 GLY CA 1 1 2 752 1 1 10 GLY H H -10.888 5.759 -2.845 1.00 . A A . 10 GLY H 1 1 2 753 1 1 10 GLY HA2 H -10.518 8.445 -1.948 1.00 . A A . 10 GLY HA2 1 1 2 754 1 1 10 GLY HA3 H -9.711 7.636 -3.291 1.00 . A A . 10 GLY HA3 1 1 2 755 1 1 10 GLY N N -10.812 6.384 -2.052 1.00 . A A . 10 GLY N 1 1 2 756 1 1 10 GLY O O -8.380 8.320 -0.615 1.00 . A A . 10 GLY O 1 1 2 757 1 1 11 GLY C C -5.529 6.527 -1.952 1.00 . A A . 11 GLY C 1 1 2 758 1 1 11 GLY CA C -6.659 6.094 -1.025 1.00 . A A . 11 GLY CA 1 1 2 759 1 1 11 GLY H H -8.298 5.685 -2.321 1.00 . A A . 11 GLY H 1 1 2 760 1 1 11 GLY HA2 H -6.572 5.028 -0.825 1.00 . A A . 11 GLY HA2 1 1 2 761 1 1 11 GLY HA3 H -6.592 6.620 -0.080 1.00 . A A . 11 GLY HA3 1 1 2 762 1 1 11 GLY N N -7.945 6.355 -1.647 1.00 . A A . 11 GLY N 1 1 2 763 1 1 11 GLY O O -5.618 6.337 -3.167 1.00 . A A . 11 GLY O 1 1 2 764 1 1 12 ASP C C -2.025 6.646 -1.487 1.00 . A A . 12 ASP C 1 1 2 765 1 1 12 ASP CA C -3.205 7.438 -2.056 1.00 . A A . 12 ASP CA 1 1 2 766 1 1 12 ASP CB C -2.876 8.956 -1.915 1.00 . A A . 12 ASP CB 1 1 2 767 1 1 12 ASP CG C -3.222 9.671 -0.588 1.00 . A A . 12 ASP CG 1 1 2 768 1 1 12 ASP H H -4.447 7.200 -0.375 1.00 . A A . 12 ASP H 1 1 2 769 1 1 12 ASP HA H -3.293 7.138 -3.107 1.00 . A A . 12 ASP HA 1 1 2 770 1 1 12 ASP HB2 H -1.807 9.087 -2.065 1.00 . A A . 12 ASP HB2 1 1 2 771 1 1 12 ASP HB3 H -3.378 9.489 -2.717 1.00 . A A . 12 ASP HB3 1 1 2 772 1 1 12 ASP N N -4.450 7.071 -1.386 1.00 . A A . 12 ASP N 1 1 2 773 1 1 12 ASP O O -1.368 5.883 -2.189 1.00 . A A . 12 ASP O 1 1 2 774 1 1 12 ASP OD1 O -2.771 9.253 0.503 1.00 . A A . 12 ASP OD1 1 1 2 775 1 1 12 ASP OD2 O -3.928 10.704 -0.617 1.00 . A A . 12 ASP OD2 1 1 2 776 1 1 13 CYS C C -0.919 6.567 2.019 1.00 . A A . 13 CYS C 1 1 2 777 1 1 13 CYS CA C -0.631 6.298 0.548 1.00 . A A . 13 CYS CA 1 1 2 778 1 1 13 CYS CB C 0.679 6.928 0.068 1.00 . A A . 13 CYS CB 1 1 2 779 1 1 13 CYS H H -2.267 7.589 0.239 1.00 . A A . 13 CYS H 1 1 2 780 1 1 13 CYS HA H -0.619 5.225 0.405 1.00 . A A . 13 CYS HA 1 1 2 781 1 1 13 CYS HB2 H 0.880 6.547 -0.931 1.00 . A A . 13 CYS HB2 1 1 2 782 1 1 13 CYS HB3 H 0.511 7.997 -0.045 1.00 . A A . 13 CYS HB3 1 1 2 783 1 1 13 CYS N N -1.705 6.879 -0.223 1.00 . A A . 13 CYS N 1 1 2 784 1 1 13 CYS O O -1.239 5.638 2.767 1.00 . A A . 13 CYS O 1 1 2 785 1 1 13 CYS SG S 2.169 6.727 1.080 1.00 . A A . 13 CYS SG 1 1 2 786 1 1 14 THR C C -2.430 7.933 4.277 1.00 . A A . 14 THR C 1 1 2 787 1 1 14 THR CA C -0.998 8.191 3.831 1.00 . A A . 14 THR CA 1 1 2 788 1 1 14 THR CB C -0.533 9.635 4.064 1.00 . A A . 14 THR CB 1 1 2 789 1 1 14 THR CG2 C -0.615 10.065 5.529 1.00 . A A . 14 THR CG2 1 1 2 790 1 1 14 THR H H -0.668 8.563 1.754 1.00 . A A . 14 THR H 1 1 2 791 1 1 14 THR HA H -0.365 7.528 4.422 1.00 . A A . 14 THR HA 1 1 2 792 1 1 14 THR HB H -1.124 10.320 3.458 1.00 . A A . 14 THR HB 1 1 2 793 1 1 14 THR HG1 H 0.869 9.605 2.714 1.00 . A A . 14 THR HG1 1 1 2 794 1 1 14 THR HG21 H -0.104 9.348 6.165 1.00 . A A . 14 THR HG21 1 1 2 795 1 1 14 THR HG22 H -0.150 11.046 5.655 1.00 . A A . 14 THR HG22 1 1 2 796 1 1 14 THR HG23 H -1.659 10.111 5.840 1.00 . A A . 14 THR HG23 1 1 2 797 1 1 14 THR N N -0.829 7.830 2.435 1.00 . A A . 14 THR N 1 1 2 798 1 1 14 THR O O -2.607 7.354 5.349 1.00 . A A . 14 THR O 1 1 2 799 1 1 14 THR OG1 O 0.826 9.736 3.682 1.00 . A A . 14 THR OG1 1 1 2 800 1 1 15 THR C C -5.215 6.543 3.668 1.00 . A A . 15 THR C 1 1 2 801 1 1 15 THR CA C -4.837 8.038 3.837 1.00 . A A . 15 THR CA 1 1 2 802 1 1 15 THR CB C -5.671 9.064 3.022 1.00 . A A . 15 THR CB 1 1 2 803 1 1 15 THR CG2 C -6.020 8.715 1.580 1.00 . A A . 15 THR CG2 1 1 2 804 1 1 15 THR H H -3.257 8.639 2.543 1.00 . A A . 15 THR H 1 1 2 805 1 1 15 THR HA H -4.935 8.295 4.890 1.00 . A A . 15 THR HA 1 1 2 806 1 1 15 THR HB H -5.049 9.952 2.930 1.00 . A A . 15 THR HB 1 1 2 807 1 1 15 THR HG1 H -7.050 8.892 4.415 1.00 . A A . 15 THR HG1 1 1 2 808 1 1 15 THR HG21 H -5.126 8.431 1.038 1.00 . A A . 15 THR HG21 1 1 2 809 1 1 15 THR HG22 H -6.756 7.917 1.551 1.00 . A A . 15 THR HG22 1 1 2 810 1 1 15 THR HG23 H -6.437 9.589 1.086 1.00 . A A . 15 THR HG23 1 1 2 811 1 1 15 THR N N -3.442 8.242 3.458 1.00 . A A . 15 THR N 1 1 2 812 1 1 15 THR O O -6.335 6.204 3.301 1.00 . A A . 15 THR O 1 1 2 813 1 1 15 THR OG1 O -6.854 9.487 3.671 1.00 . A A . 15 THR OG1 1 1 2 814 1 1 16 CYS C C -3.474 3.709 5.145 1.00 . A A . 16 CYS C 1 1 2 815 1 1 16 CYS CA C -4.481 4.173 4.100 1.00 . A A . 16 CYS CA 1 1 2 816 1 1 16 CYS CB C -4.257 3.410 2.781 1.00 . A A . 16 CYS CB 1 1 2 817 1 1 16 CYS H H -3.370 5.963 4.171 1.00 . A A . 16 CYS H 1 1 2 818 1 1 16 CYS HA H -5.483 3.945 4.474 1.00 . A A . 16 CYS HA 1 1 2 819 1 1 16 CYS HB2 H -3.331 3.771 2.351 1.00 . A A . 16 CYS HB2 1 1 2 820 1 1 16 CYS HB3 H -4.127 2.354 3.008 1.00 . A A . 16 CYS HB3 1 1 2 821 1 1 16 CYS N N -4.297 5.612 3.959 1.00 . A A . 16 CYS N 1 1 2 822 1 1 16 CYS O O -3.906 3.092 6.109 1.00 . A A . 16 CYS O 1 1 2 823 1 1 16 CYS SG S -5.549 3.522 1.513 1.00 . A A . 16 CYS SG 1 1 2 824 1 1 17 PHE C C -1.362 3.443 7.287 1.00 . A A . 17 PHE C 1 1 2 825 1 1 17 PHE CA C -1.089 3.404 5.788 1.00 . A A . 17 PHE CA 1 1 2 826 1 1 17 PHE CB C 0.266 4.090 5.514 1.00 . A A . 17 PHE CB 1 1 2 827 1 1 17 PHE CD1 C 1.648 2.110 6.269 1.00 . A A . 17 PHE CD1 1 1 2 828 1 1 17 PHE CD2 C 2.262 4.292 7.132 1.00 . A A . 17 PHE CD2 1 1 2 829 1 1 17 PHE CE1 C 2.675 1.503 7.015 1.00 . A A . 17 PHE CE1 1 1 2 830 1 1 17 PHE CE2 C 3.333 3.693 7.830 1.00 . A A . 17 PHE CE2 1 1 2 831 1 1 17 PHE CG C 1.421 3.497 6.321 1.00 . A A . 17 PHE CG 1 1 2 832 1 1 17 PHE CZ C 3.531 2.301 7.784 1.00 . A A . 17 PHE CZ 1 1 2 833 1 1 17 PHE H H -1.882 4.568 4.205 1.00 . A A . 17 PHE H 1 1 2 834 1 1 17 PHE HA H -1.016 2.356 5.499 1.00 . A A . 17 PHE HA 1 1 2 835 1 1 17 PHE HB2 H 0.501 4.003 4.451 1.00 . A A . 17 PHE HB2 1 1 2 836 1 1 17 PHE HB3 H 0.182 5.153 5.746 1.00 . A A . 17 PHE HB3 1 1 2 837 1 1 17 PHE HD1 H 1.003 1.504 5.660 1.00 . A A . 17 PHE HD1 1 1 2 838 1 1 17 PHE HD2 H 2.098 5.358 7.243 1.00 . A A . 17 PHE HD2 1 1 2 839 1 1 17 PHE HE1 H 2.824 0.424 7.003 1.00 . A A . 17 PHE HE1 1 1 2 840 1 1 17 PHE HE2 H 3.975 4.305 8.452 1.00 . A A . 17 PHE HE2 1 1 2 841 1 1 17 PHE HZ H 4.321 1.824 8.347 1.00 . A A . 17 PHE HZ 1 1 2 842 1 1 17 PHE N N -2.170 3.998 4.992 1.00 . A A . 17 PHE N 1 1 2 843 1 1 17 PHE O O -1.031 2.483 7.989 1.00 . A A . 17 PHE O 1 1 2 844 1 1 18 ASN C C -1.235 4.824 10.161 1.00 . A A . 18 ASN C 1 1 2 845 1 1 18 ASN CA C -2.378 4.750 9.144 1.00 . A A . 18 ASN CA 1 1 2 846 1 1 18 ASN CB C -3.455 3.716 9.511 1.00 . A A . 18 ASN CB 1 1 2 847 1 1 18 ASN CG C -4.322 4.164 10.668 1.00 . A A . 18 ASN CG 1 1 2 848 1 1 18 ASN H H -2.140 5.303 7.116 1.00 . A A . 18 ASN H 1 1 2 849 1 1 18 ASN HA H -2.866 5.716 9.162 1.00 . A A . 18 ASN HA 1 1 2 850 1 1 18 ASN HB2 H -4.082 3.509 8.643 1.00 . A A . 18 ASN HB2 1 1 2 851 1 1 18 ASN HB3 H -3.002 2.780 9.780 1.00 . A A . 18 ASN HB3 1 1 2 852 1 1 18 ASN HD21 H -5.626 4.709 9.305 1.00 . A A . 18 ASN HD21 1 1 2 853 1 1 18 ASN HD22 H -6.159 5.041 10.964 1.00 . A A . 18 ASN HD22 1 1 2 854 1 1 18 ASN N N -1.938 4.549 7.763 1.00 . A A . 18 ASN N 1 1 2 855 1 1 18 ASN ND2 N -5.479 4.665 10.309 1.00 . A A . 18 ASN ND2 1 1 2 856 1 1 18 ASN O O -1.489 5.214 11.300 1.00 . A A . 18 ASN O 1 1 2 857 1 1 18 ASN OD1 O -4.012 4.001 11.844 1.00 . A A . 18 ASN OD1 1 1 2 858 1 1 19 ASN C C 1.224 2.825 11.020 1.00 . A A . 19 ASN C 1 1 2 859 1 1 19 ASN CA C 1.209 4.279 10.540 1.00 . A A . 19 ASN CA 1 1 2 860 1 1 19 ASN CB C 1.426 5.337 11.634 1.00 . A A . 19 ASN CB 1 1 2 861 1 1 19 ASN CG C 2.808 5.353 12.276 1.00 . A A . 19 ASN CG 1 1 2 862 1 1 19 ASN H H 0.072 4.229 8.778 1.00 . A A . 19 ASN H 1 1 2 863 1 1 19 ASN HA H 2.059 4.396 9.880 1.00 . A A . 19 ASN HA 1 1 2 864 1 1 19 ASN HB2 H 1.263 6.293 11.146 1.00 . A A . 19 ASN HB2 1 1 2 865 1 1 19 ASN HB3 H 0.702 5.201 12.436 1.00 . A A . 19 ASN HB3 1 1 2 866 1 1 19 ASN HD21 H 2.827 7.384 12.305 1.00 . A A . 19 ASN HD21 1 1 2 867 1 1 19 ASN HD22 H 4.103 6.583 13.208 1.00 . A A . 19 ASN HD22 1 1 2 868 1 1 19 ASN N N 0.007 4.546 9.738 1.00 . A A . 19 ASN N 1 1 2 869 1 1 19 ASN ND2 N 3.315 6.538 12.571 1.00 . A A . 19 ASN ND2 1 1 2 870 1 1 19 ASN O O 1.299 2.513 12.206 1.00 . A A . 19 ASN O 1 1 2 871 1 1 19 ASN OD1 O 3.422 4.329 12.553 1.00 . A A . 19 ASN OD1 1 1 2 872 1 1 20 GLY C C 0.592 -0.411 10.762 1.00 . A A . 20 GLY C 1 1 2 873 1 1 20 GLY CA C 1.665 0.539 10.232 1.00 . A A . 20 GLY CA 1 1 2 874 1 1 20 GLY H H 1.084 2.210 9.092 1.00 . A A . 20 GLY H 1 1 2 875 1 1 20 GLY HA2 H 2.540 0.526 10.876 1.00 . A A . 20 GLY HA2 1 1 2 876 1 1 20 GLY HA3 H 2.003 0.153 9.275 1.00 . A A . 20 GLY HA3 1 1 2 877 1 1 20 GLY N N 1.222 1.911 10.045 1.00 . A A . 20 GLY N 1 1 2 878 1 1 20 GLY O O 0.924 -1.544 11.105 1.00 . A A . 20 GLY O 1 1 2 879 1 1 21 THR C C -2.871 -0.844 9.933 1.00 . A A . 21 THR C 1 1 2 880 1 1 21 THR CA C -1.821 -0.863 11.071 1.00 . A A . 21 THR CA 1 1 2 881 1 1 21 THR CB C -2.321 -0.507 12.492 1.00 . A A . 21 THR CB 1 1 2 882 1 1 21 THR CG2 C -3.716 0.103 12.533 1.00 . A A . 21 THR CG2 1 1 2 883 1 1 21 THR H H -0.868 0.990 10.691 1.00 . A A . 21 THR H 1 1 2 884 1 1 21 THR HA H -1.472 -1.886 11.130 1.00 . A A . 21 THR HA 1 1 2 885 1 1 21 THR HB H -1.633 0.205 12.941 1.00 . A A . 21 THR HB 1 1 2 886 1 1 21 THR HG1 H -2.297 -1.256 14.270 1.00 . A A . 21 THR HG1 1 1 2 887 1 1 21 THR HG21 H -3.816 0.893 11.795 1.00 . A A . 21 THR HG21 1 1 2 888 1 1 21 THR HG22 H -4.472 -0.654 12.353 1.00 . A A . 21 THR HG22 1 1 2 889 1 1 21 THR HG23 H -3.889 0.541 13.506 1.00 . A A . 21 THR HG23 1 1 2 890 1 1 21 THR N N -0.679 -0.002 10.771 1.00 . A A . 21 THR N 1 1 2 891 1 1 21 THR O O -3.838 -1.606 9.985 1.00 . A A . 21 THR O 1 1 2 892 1 1 21 THR OG1 O -2.312 -1.623 13.362 1.00 . A A . 21 THR OG1 1 1 2 893 1 1 22 GLY C C -3.746 -1.033 6.859 1.00 . A A . 22 GLY C 1 1 2 894 1 1 22 GLY CA C -3.615 0.180 7.798 1.00 . A A . 22 GLY CA 1 1 2 895 1 1 22 GLY H H -1.855 0.575 8.900 1.00 . A A . 22 GLY H 1 1 2 896 1 1 22 GLY HA2 H -3.260 1.030 7.220 1.00 . A A . 22 GLY HA2 1 1 2 897 1 1 22 GLY HA3 H -4.599 0.419 8.209 1.00 . A A . 22 GLY HA3 1 1 2 898 1 1 22 GLY N N -2.685 -0.002 8.908 1.00 . A A . 22 GLY N 1 1 2 899 1 1 22 GLY O O -3.114 -2.077 7.055 1.00 . A A . 22 GLY O 1 1 2 900 1 1 23 PRO C C -3.652 -2.334 4.025 1.00 . A A . 23 PRO C 1 1 2 901 1 1 23 PRO CA C -4.873 -2.008 4.895 1.00 . A A . 23 PRO CA 1 1 2 902 1 1 23 PRO CB C -6.100 -1.567 4.096 1.00 . A A . 23 PRO CB 1 1 2 903 1 1 23 PRO CD C -5.262 0.307 5.384 1.00 . A A . 23 PRO CD 1 1 2 904 1 1 23 PRO CG C -6.014 -0.041 4.099 1.00 . A A . 23 PRO CG 1 1 2 905 1 1 23 PRO HA H -5.132 -2.891 5.476 1.00 . A A . 23 PRO HA 1 1 2 906 1 1 23 PRO HB2 H -6.083 -1.967 3.081 1.00 . A A . 23 PRO HB2 1 1 2 907 1 1 23 PRO HB3 H -7.000 -1.881 4.632 1.00 . A A . 23 PRO HB3 1 1 2 908 1 1 23 PRO HD2 H -4.527 1.073 5.148 1.00 . A A . 23 PRO HD2 1 1 2 909 1 1 23 PRO HD3 H -5.961 0.655 6.153 1.00 . A A . 23 PRO HD3 1 1 2 910 1 1 23 PRO HG2 H -5.435 0.294 3.234 1.00 . A A . 23 PRO HG2 1 1 2 911 1 1 23 PRO HG3 H -7.010 0.403 4.105 1.00 . A A . 23 PRO HG3 1 1 2 912 1 1 23 PRO N N -4.574 -0.908 5.802 1.00 . A A . 23 PRO N 1 1 2 913 1 1 23 PRO O O -3.179 -3.471 4.011 1.00 . A A . 23 PRO O 1 1 2 914 1 1 24 CYS C C -0.834 -0.901 4.004 1.00 . A A . 24 CYS C 1 1 2 915 1 1 24 CYS CA C -1.709 -1.405 2.862 1.00 . A A . 24 CYS CA 1 1 2 916 1 1 24 CYS CB C -1.491 -0.593 1.576 1.00 . A A . 24 CYS CB 1 1 2 917 1 1 24 CYS H H -3.482 -0.422 3.432 1.00 . A A . 24 CYS H 1 1 2 918 1 1 24 CYS HA H -1.439 -2.439 2.649 1.00 . A A . 24 CYS HA 1 1 2 919 1 1 24 CYS HB2 H -2.359 0.028 1.359 1.00 . A A . 24 CYS HB2 1 1 2 920 1 1 24 CYS HB3 H -0.648 0.082 1.720 1.00 . A A . 24 CYS HB3 1 1 2 921 1 1 24 CYS N N -3.084 -1.341 3.334 1.00 . A A . 24 CYS N 1 1 2 922 1 1 24 CYS O O -0.595 0.300 4.115 1.00 . A A . 24 CYS O 1 1 2 923 1 1 24 CYS SG S -1.093 -1.597 0.127 1.00 . A A . 24 CYS SG 1 1 2 924 1 1 25 ALA C C 1.784 -2.518 5.681 1.00 . A A . 25 ALA C 1 1 2 925 1 1 25 ALA CA C 0.630 -1.548 5.866 1.00 . A A . 25 ALA CA 1 1 2 926 1 1 25 ALA CB C 0.043 -1.574 7.272 1.00 . A A . 25 ALA CB 1 1 2 927 1 1 25 ALA H H -0.726 -2.762 4.797 1.00 . A A . 25 ALA H 1 1 2 928 1 1 25 ALA HA H 1.037 -0.557 5.706 1.00 . A A . 25 ALA HA 1 1 2 929 1 1 25 ALA HB1 H -0.447 -2.526 7.463 1.00 . A A . 25 ALA HB1 1 1 2 930 1 1 25 ALA HB2 H -0.677 -0.765 7.365 1.00 . A A . 25 ALA HB2 1 1 2 931 1 1 25 ALA HB3 H 0.832 -1.423 8.002 1.00 . A A . 25 ALA HB3 1 1 2 932 1 1 25 ALA N N -0.401 -1.807 4.876 1.00 . A A . 25 ALA N 1 1 2 933 1 1 25 ALA O O 2.917 -2.092 5.485 1.00 . A A . 25 ALA O 1 1 2 934 1 1 26 ASN C C 3.315 -4.766 4.247 1.00 . A A . 26 ASN C 1 1 2 935 1 1 26 ASN CA C 2.612 -4.797 5.606 1.00 . A A . 26 ASN CA 1 1 2 936 1 1 26 ASN CB C 2.145 -6.235 5.912 1.00 . A A . 26 ASN CB 1 1 2 937 1 1 26 ASN CG C 1.230 -6.369 7.127 1.00 . A A . 26 ASN CG 1 1 2 938 1 1 26 ASN H H 0.571 -4.137 5.836 1.00 . A A . 26 ASN H 1 1 2 939 1 1 26 ASN HA H 3.350 -4.476 6.352 1.00 . A A . 26 ASN HA 1 1 2 940 1 1 26 ASN HB2 H 1.631 -6.629 5.035 1.00 . A A . 26 ASN HB2 1 1 2 941 1 1 26 ASN HB3 H 3.038 -6.840 6.083 1.00 . A A . 26 ASN HB3 1 1 2 942 1 1 26 ASN HD21 H 0.243 -8.036 6.417 1.00 . A A . 26 ASN HD21 1 1 2 943 1 1 26 ASN HD22 H -0.274 -7.436 7.946 1.00 . A A . 26 ASN HD22 1 1 2 944 1 1 26 ASN N N 1.521 -3.824 5.666 1.00 . A A . 26 ASN N 1 1 2 945 1 1 26 ASN ND2 N 0.314 -7.320 7.134 1.00 . A A . 26 ASN ND2 1 1 2 946 1 1 26 ASN O O 4.472 -5.180 4.162 1.00 . A A . 26 ASN O 1 1 2 947 1 1 26 ASN OD1 O 1.272 -5.564 8.056 1.00 . A A . 26 ASN OD1 1 1 2 948 1 1 27 CYS C C 4.403 -2.850 2.015 1.00 . A A . 27 CYS C 1 1 2 949 1 1 27 CYS CA C 3.298 -3.921 1.919 1.00 . A A . 27 CYS CA 1 1 2 950 1 1 27 CYS CB C 2.264 -3.461 0.865 1.00 . A A . 27 CYS CB 1 1 2 951 1 1 27 CYS H H 1.734 -3.868 3.370 1.00 . A A . 27 CYS H 1 1 2 952 1 1 27 CYS HA H 3.751 -4.835 1.540 1.00 . A A . 27 CYS HA 1 1 2 953 1 1 27 CYS HB2 H 1.950 -2.435 1.060 1.00 . A A . 27 CYS HB2 1 1 2 954 1 1 27 CYS HB3 H 2.785 -3.406 -0.087 1.00 . A A . 27 CYS HB3 1 1 2 955 1 1 27 CYS N N 2.670 -4.209 3.210 1.00 . A A . 27 CYS N 1 1 2 956 1 1 27 CYS O O 4.860 -2.425 0.965 1.00 . A A . 27 CYS O 1 1 2 957 1 1 27 CYS SG S 0.772 -4.453 0.589 1.00 . A A . 27 CYS SG 1 1 2 958 1 1 28 LEU C C 6.943 -1.437 3.886 1.00 . A A . 28 LEU C 1 1 2 959 1 1 28 LEU CA C 5.566 -1.098 3.322 1.00 . A A . 28 LEU CA 1 1 2 960 1 1 28 LEU CB C 4.859 -0.050 4.225 1.00 . A A . 28 LEU CB 1 1 2 961 1 1 28 LEU CD1 C 3.691 2.044 3.400 1.00 . A A . 28 LEU CD1 1 1 2 962 1 1 28 LEU CD2 C 2.780 -0.135 2.618 1.00 . A A . 28 LEU CD2 1 1 2 963 1 1 28 LEU CG C 3.523 0.566 3.752 1.00 . A A . 28 LEU CG 1 1 2 964 1 1 28 LEU H H 4.313 -2.655 4.033 1.00 . A A . 28 LEU H 1 1 2 965 1 1 28 LEU HA H 5.722 -0.652 2.341 1.00 . A A . 28 LEU HA 1 1 2 966 1 1 28 LEU HB2 H 4.702 -0.458 5.224 1.00 . A A . 28 LEU HB2 1 1 2 967 1 1 28 LEU HB3 H 5.562 0.763 4.396 1.00 . A A . 28 LEU HB3 1 1 2 968 1 1 28 LEU HD11 H 4.097 2.575 4.254 1.00 . A A . 28 LEU HD11 1 1 2 969 1 1 28 LEU HD12 H 4.366 2.162 2.556 1.00 . A A . 28 LEU HD12 1 1 2 970 1 1 28 LEU HD13 H 2.729 2.489 3.163 1.00 . A A . 28 LEU HD13 1 1 2 971 1 1 28 LEU HD21 H 2.520 -1.144 2.920 1.00 . A A . 28 LEU HD21 1 1 2 972 1 1 28 LEU HD22 H 1.836 0.371 2.444 1.00 . A A . 28 LEU HD22 1 1 2 973 1 1 28 LEU HD23 H 3.393 -0.130 1.712 1.00 . A A . 28 LEU HD23 1 1 2 974 1 1 28 LEU HG H 2.846 0.521 4.595 1.00 . A A . 28 LEU HG 1 1 2 975 1 1 28 LEU N N 4.769 -2.324 3.194 1.00 . A A . 28 LEU N 1 1 2 976 1 1 28 LEU O O 7.963 -1.323 3.206 1.00 . A A . 28 LEU O 1 1 2 977 1 1 29 ALA C C 9.204 -2.858 5.293 1.00 . A A . 29 ALA C 1 1 2 978 1 1 29 ALA CA C 8.153 -1.986 5.978 1.00 . A A . 29 ALA CA 1 1 2 979 1 1 29 ALA CB C 7.720 -2.561 7.325 1.00 . A A . 29 ALA CB 1 1 2 980 1 1 29 ALA H H 6.072 -1.917 5.619 1.00 . A A . 29 ALA H 1 1 2 981 1 1 29 ALA HA H 8.592 -1.000 6.138 1.00 . A A . 29 ALA HA 1 1 2 982 1 1 29 ALA HB1 H 8.597 -2.774 7.935 1.00 . A A . 29 ALA HB1 1 1 2 983 1 1 29 ALA HB2 H 7.148 -3.476 7.166 1.00 . A A . 29 ALA HB2 1 1 2 984 1 1 29 ALA HB3 H 7.081 -1.844 7.836 1.00 . A A . 29 ALA HB3 1 1 2 985 1 1 29 ALA N N 6.962 -1.841 5.156 1.00 . A A . 29 ALA N 1 1 2 986 1 1 29 ALA O O 10.293 -2.383 4.983 1.00 . A A . 29 ALA O 1 1 2 987 1 1 30 GLY C C 8.924 -5.346 3.000 1.00 . A A . 30 GLY C 1 1 2 988 1 1 30 GLY CA C 9.680 -5.030 4.265 1.00 . A A . 30 GLY CA 1 1 2 989 1 1 30 GLY H H 7.943 -4.442 5.311 1.00 . A A . 30 GLY H 1 1 2 990 1 1 30 GLY HA2 H 9.854 -5.943 4.833 1.00 . A A . 30 GLY HA2 1 1 2 991 1 1 30 GLY HA3 H 10.639 -4.579 4.007 1.00 . A A . 30 GLY HA3 1 1 2 992 1 1 30 GLY N N 8.864 -4.122 5.043 1.00 . A A . 30 GLY N 1 1 2 993 1 1 30 GLY O O 8.123 -6.285 3.006 1.00 . A A . 30 GLY O 1 1 2 994 1 1 31 TYR C C 9.231 -4.996 -0.573 1.00 . A A . 31 TYR C 1 1 2 995 1 1 31 TYR CA C 8.398 -4.755 0.698 1.00 . A A . 31 TYR CA 1 1 2 996 1 1 31 TYR CB C 7.626 -3.435 0.612 1.00 . A A . 31 TYR CB 1 1 2 997 1 1 31 TYR CD1 C 9.688 -2.082 -0.096 1.00 . A A . 31 TYR CD1 1 1 2 998 1 1 31 TYR CD2 C 7.464 -1.349 -0.734 1.00 . A A . 31 TYR CD2 1 1 2 999 1 1 31 TYR CE1 C 10.246 -1.002 -0.801 1.00 . A A . 31 TYR CE1 1 1 2 1000 1 1 31 TYR CE2 C 8.001 -0.248 -1.409 1.00 . A A . 31 TYR CE2 1 1 2 1001 1 1 31 TYR CG C 8.295 -2.279 -0.106 1.00 . A A . 31 TYR CG 1 1 2 1002 1 1 31 TYR CZ C 9.400 -0.078 -1.457 1.00 . A A . 31 TYR CZ 1 1 2 1003 1 1 31 TYR H H 9.750 -3.763 2.031 1.00 . A A . 31 TYR H 1 1 2 1004 1 1 31 TYR HA H 7.680 -5.550 0.775 1.00 . A A . 31 TYR HA 1 1 2 1005 1 1 31 TYR HB2 H 6.730 -3.651 0.044 1.00 . A A . 31 TYR HB2 1 1 2 1006 1 1 31 TYR HB3 H 7.284 -3.114 1.593 1.00 . A A . 31 TYR HB3 1 1 2 1007 1 1 31 TYR HD1 H 10.331 -2.836 0.333 1.00 . A A . 31 TYR HD1 1 1 2 1008 1 1 31 TYR HD2 H 6.405 -1.505 -0.663 1.00 . A A . 31 TYR HD2 1 1 2 1009 1 1 31 TYR HE1 H 11.319 -0.907 -0.869 1.00 . A A . 31 TYR HE1 1 1 2 1010 1 1 31 TYR HE2 H 7.335 0.474 -1.864 1.00 . A A . 31 TYR HE2 1 1 2 1011 1 1 31 TYR HH H 10.755 1.243 -1.791 1.00 . A A . 31 TYR HH 1 1 2 1012 1 1 31 TYR N N 9.151 -4.571 1.936 1.00 . A A . 31 TYR N 1 1 2 1013 1 1 31 TYR O O 8.806 -4.603 -1.662 1.00 . A A . 31 TYR O 1 1 2 1014 1 1 31 TYR OH O 9.918 0.955 -2.171 1.00 . A A . 31 TYR OH 1 1 2 1015 1 1 32 PRO C C 10.333 -7.012 -2.766 1.00 . A A . 32 PRO C 1 1 2 1016 1 1 32 PRO CA C 11.045 -6.128 -1.734 1.00 . A A . 32 PRO CA 1 1 2 1017 1 1 32 PRO CB C 12.312 -6.803 -1.201 1.00 . A A . 32 PRO CB 1 1 2 1018 1 1 32 PRO CD C 10.724 -6.653 0.575 1.00 . A A . 32 PRO CD 1 1 2 1019 1 1 32 PRO CG C 11.810 -7.566 0.022 1.00 . A A . 32 PRO CG 1 1 2 1020 1 1 32 PRO HA H 11.293 -5.147 -2.158 1.00 . A A . 32 PRO HA 1 1 2 1021 1 1 32 PRO HB2 H 12.778 -7.466 -1.931 1.00 . A A . 32 PRO HB2 1 1 2 1022 1 1 32 PRO HB3 H 13.020 -6.037 -0.886 1.00 . A A . 32 PRO HB3 1 1 2 1023 1 1 32 PRO HD2 H 9.929 -7.222 1.056 1.00 . A A . 32 PRO HD2 1 1 2 1024 1 1 32 PRO HD3 H 11.174 -5.956 1.280 1.00 . A A . 32 PRO HD3 1 1 2 1025 1 1 32 PRO HG2 H 11.368 -8.516 -0.284 1.00 . A A . 32 PRO HG2 1 1 2 1026 1 1 32 PRO HG3 H 12.603 -7.713 0.754 1.00 . A A . 32 PRO HG3 1 1 2 1027 1 1 32 PRO N N 10.203 -5.920 -0.562 1.00 . A A . 32 PRO N 1 1 2 1028 1 1 32 PRO O O 10.838 -7.250 -3.860 1.00 . A A . 32 PRO O 1 1 2 1029 1 1 33 ALA C C 6.883 -7.756 -3.220 1.00 . A A . 33 ALA C 1 1 2 1030 1 1 33 ALA CA C 8.287 -8.375 -3.201 1.00 . A A . 33 ALA CA 1 1 2 1031 1 1 33 ALA CB C 8.278 -9.795 -2.643 1.00 . A A . 33 ALA CB 1 1 2 1032 1 1 33 ALA H H 8.882 -7.383 -1.449 1.00 . A A . 33 ALA H 1 1 2 1033 1 1 33 ALA HA H 8.650 -8.406 -4.232 1.00 . A A . 33 ALA HA 1 1 2 1034 1 1 33 ALA HB1 H 9.281 -10.218 -2.690 1.00 . A A . 33 ALA HB1 1 1 2 1035 1 1 33 ALA HB2 H 7.605 -10.415 -3.235 1.00 . A A . 33 ALA HB2 1 1 2 1036 1 1 33 ALA HB3 H 7.941 -9.759 -1.606 1.00 . A A . 33 ALA HB3 1 1 2 1037 1 1 33 ALA N N 9.191 -7.584 -2.389 1.00 . A A . 33 ALA N 1 1 2 1038 1 1 33 ALA O O 5.953 -8.361 -3.755 1.00 . A A . 33 ALA O 1 1 2 1039 1 1 34 GLY C C 5.067 -5.359 -3.928 1.00 . A A . 34 GLY C 1 1 2 1040 1 1 34 GLY CA C 5.342 -5.992 -2.570 1.00 . A A . 34 GLY CA 1 1 2 1041 1 1 34 GLY H H 7.437 -6.102 -2.164 1.00 . A A . 34 GLY H 1 1 2 1042 1 1 34 GLY HA2 H 5.246 -5.245 -1.792 1.00 . A A . 34 GLY HA2 1 1 2 1043 1 1 34 GLY HA3 H 4.584 -6.751 -2.380 1.00 . A A . 34 GLY HA3 1 1 2 1044 1 1 34 GLY N N 6.660 -6.615 -2.561 1.00 . A A . 34 GLY N 1 1 2 1045 1 1 34 GLY O O 3.956 -5.471 -4.421 1.00 . A A . 34 GLY O 1 1 2 1046 1 1 35 CYS C C 5.575 -5.152 -6.996 1.00 . A A . 35 CYS C 1 1 2 1047 1 1 35 CYS CA C 5.971 -4.163 -5.896 1.00 . A A . 35 CYS CA 1 1 2 1048 1 1 35 CYS CB C 7.322 -3.558 -6.276 1.00 . A A . 35 CYS CB 1 1 2 1049 1 1 35 CYS H H 6.964 -4.663 -4.092 1.00 . A A . 35 CYS H 1 1 2 1050 1 1 35 CYS HA H 5.222 -3.370 -5.862 1.00 . A A . 35 CYS HA 1 1 2 1051 1 1 35 CYS HB2 H 7.990 -4.396 -6.497 1.00 . A A . 35 CYS HB2 1 1 2 1052 1 1 35 CYS HB3 H 7.203 -2.986 -7.199 1.00 . A A . 35 CYS HB3 1 1 2 1053 1 1 35 CYS N N 6.081 -4.770 -4.570 1.00 . A A . 35 CYS N 1 1 2 1054 1 1 35 CYS O O 5.262 -4.719 -8.102 1.00 . A A . 35 CYS O 1 1 2 1055 1 1 35 CYS SG S 8.011 -2.462 -4.998 1.00 . A A . 35 CYS SG 1 1 2 1056 1 1 36 SER C C 3.868 -8.058 -7.352 1.00 . A A . 36 SER C 1 1 2 1057 1 1 36 SER CA C 5.236 -7.466 -7.705 1.00 . A A . 36 SER CA 1 1 2 1058 1 1 36 SER CB C 6.341 -8.510 -7.719 1.00 . A A . 36 SER CB 1 1 2 1059 1 1 36 SER H H 6.007 -6.876 -5.907 1.00 . A A . 36 SER H 1 1 2 1060 1 1 36 SER HA H 5.203 -6.999 -8.686 1.00 . A A . 36 SER HA 1 1 2 1061 1 1 36 SER HB2 H 6.175 -9.185 -8.542 1.00 . A A . 36 SER HB2 1 1 2 1062 1 1 36 SER HB3 H 7.263 -7.964 -7.862 1.00 . A A . 36 SER HB3 1 1 2 1063 1 1 36 SER HG H 5.859 -10.001 -6.556 1.00 . A A . 36 SER HG 1 1 2 1064 1 1 36 SER N N 5.648 -6.467 -6.753 1.00 . A A . 36 SER N 1 1 2 1065 1 1 36 SER O O 3.241 -8.737 -8.169 1.00 . A A . 36 SER O 1 1 2 1066 1 1 36 SER OG O 6.463 -9.242 -6.517 1.00 . A A . 36 SER OG 1 1 2 1067 1 1 37 ASN C C 1.174 -7.035 -6.095 1.00 . A A . 37 ASN C 1 1 2 1068 1 1 37 ASN CA C 2.084 -8.170 -5.648 1.00 . A A . 37 ASN CA 1 1 2 1069 1 1 37 ASN CB C 2.038 -8.336 -4.110 1.00 . A A . 37 ASN CB 1 1 2 1070 1 1 37 ASN CG C 1.864 -9.800 -3.742 1.00 . A A . 37 ASN CG 1 1 2 1071 1 1 37 ASN H H 4.009 -7.236 -5.566 1.00 . A A . 37 ASN H 1 1 2 1072 1 1 37 ASN HA H 1.741 -9.095 -6.115 1.00 . A A . 37 ASN HA 1 1 2 1073 1 1 37 ASN HB2 H 2.901 -7.878 -3.620 1.00 . A A . 37 ASN HB2 1 1 2 1074 1 1 37 ASN HB3 H 1.171 -7.811 -3.708 1.00 . A A . 37 ASN HB3 1 1 2 1075 1 1 37 ASN HD21 H -0.052 -9.701 -4.300 1.00 . A A . 37 ASN HD21 1 1 2 1076 1 1 37 ASN HD22 H 0.447 -11.284 -3.733 1.00 . A A . 37 ASN HD22 1 1 2 1077 1 1 37 ASN N N 3.426 -7.857 -6.114 1.00 . A A . 37 ASN N 1 1 2 1078 1 1 37 ASN ND2 N 0.655 -10.304 -3.887 1.00 . A A . 37 ASN ND2 1 1 2 1079 1 1 37 ASN O O 1.065 -6.046 -5.381 1.00 . A A . 37 ASN O 1 1 2 1080 1 1 37 ASN OD1 O 2.794 -10.502 -3.355 1.00 . A A . 37 ASN OD1 1 1 2 1081 1 1 38 SER C C -1.419 -5.613 -6.761 1.00 . A A . 38 SER C 1 1 2 1082 1 1 38 SER CA C -0.399 -6.143 -7.778 1.00 . A A . 38 SER CA 1 1 2 1083 1 1 38 SER CB C -1.088 -6.679 -9.014 1.00 . A A . 38 SER CB 1 1 2 1084 1 1 38 SER H H 0.614 -7.985 -7.805 1.00 . A A . 38 SER H 1 1 2 1085 1 1 38 SER HA H 0.199 -5.322 -8.136 1.00 . A A . 38 SER HA 1 1 2 1086 1 1 38 SER HB2 H -1.566 -7.602 -8.738 1.00 . A A . 38 SER HB2 1 1 2 1087 1 1 38 SER HB3 H -1.832 -5.967 -9.371 1.00 . A A . 38 SER HB3 1 1 2 1088 1 1 38 SER HG H -0.286 -6.233 -10.724 1.00 . A A . 38 SER HG 1 1 2 1089 1 1 38 SER N N 0.499 -7.162 -7.240 1.00 . A A . 38 SER N 1 1 2 1090 1 1 38 SER O O -1.812 -4.455 -6.868 1.00 . A A . 38 SER O 1 1 2 1091 1 1 38 SER OG O -0.128 -6.914 -10.029 1.00 . A A . 38 SER OG 1 1 2 1092 1 1 39 ASP C C -2.048 -4.855 -3.842 1.00 . A A . 39 ASP C 1 1 2 1093 1 1 39 ASP CA C -2.628 -6.042 -4.626 1.00 . A A . 39 ASP CA 1 1 2 1094 1 1 39 ASP CB C -2.759 -7.275 -3.722 1.00 . A A . 39 ASP CB 1 1 2 1095 1 1 39 ASP CG C -3.705 -7.026 -2.550 1.00 . A A . 39 ASP CG 1 1 2 1096 1 1 39 ASP H H -1.438 -7.364 -5.780 1.00 . A A . 39 ASP H 1 1 2 1097 1 1 39 ASP HA H -3.620 -5.770 -4.986 1.00 . A A . 39 ASP HA 1 1 2 1098 1 1 39 ASP HB2 H -3.167 -8.100 -4.310 1.00 . A A . 39 ASP HB2 1 1 2 1099 1 1 39 ASP HB3 H -1.774 -7.586 -3.358 1.00 . A A . 39 ASP HB3 1 1 2 1100 1 1 39 ASP N N -1.797 -6.418 -5.767 1.00 . A A . 39 ASP N 1 1 2 1101 1 1 39 ASP O O -2.790 -3.987 -3.384 1.00 . A A . 39 ASP O 1 1 2 1102 1 1 39 ASP OD1 O -4.923 -6.913 -2.801 1.00 . A A . 39 ASP OD1 1 1 2 1103 1 1 39 ASP OD2 O -3.267 -7.096 -1.378 1.00 . A A . 39 ASP OD2 1 1 2 1104 1 1 40 CYS C C 0.523 -2.712 -4.148 1.00 . A A . 40 CYS C 1 1 2 1105 1 1 40 CYS CA C 0.062 -3.738 -3.098 1.00 . A A . 40 CYS CA 1 1 2 1106 1 1 40 CYS CB C 1.322 -4.361 -2.460 1.00 . A A . 40 CYS CB 1 1 2 1107 1 1 40 CYS H H -0.183 -5.444 -4.293 1.00 . A A . 40 CYS H 1 1 2 1108 1 1 40 CYS HA H -0.538 -3.218 -2.348 1.00 . A A . 40 CYS HA 1 1 2 1109 1 1 40 CYS HB2 H 1.864 -4.880 -3.255 1.00 . A A . 40 CYS HB2 1 1 2 1110 1 1 40 CYS HB3 H 1.955 -3.544 -2.117 1.00 . A A . 40 CYS HB3 1 1 2 1111 1 1 40 CYS N N -0.718 -4.796 -3.726 1.00 . A A . 40 CYS N 1 1 2 1112 1 1 40 CYS O O 0.680 -1.539 -3.829 1.00 . A A . 40 CYS O 1 1 2 1113 1 1 40 CYS SG S 1.163 -5.554 -1.090 1.00 . A A . 40 CYS SG 1 1 2 1114 1 1 41 THR C C 0.976 -0.986 -6.701 1.00 . A A . 41 THR C 1 1 2 1115 1 1 41 THR CA C 1.556 -2.363 -6.367 1.00 . A A . 41 THR CA 1 1 2 1116 1 1 41 THR CB C 1.656 -3.233 -7.619 1.00 . A A . 41 THR CB 1 1 2 1117 1 1 41 THR CG2 C 2.382 -2.647 -8.807 1.00 . A A . 41 THR CG2 1 1 2 1118 1 1 41 THR H H 0.773 -4.122 -5.580 1.00 . A A . 41 THR H 1 1 2 1119 1 1 41 THR HA H 2.566 -2.216 -5.987 1.00 . A A . 41 THR HA 1 1 2 1120 1 1 41 THR HB H 0.641 -3.442 -7.944 1.00 . A A . 41 THR HB 1 1 2 1121 1 1 41 THR HG1 H 2.526 -4.920 -8.105 1.00 . A A . 41 THR HG1 1 1 2 1122 1 1 41 THR HG21 H 1.984 -1.660 -9.032 1.00 . A A . 41 THR HG21 1 1 2 1123 1 1 41 THR HG22 H 3.445 -2.586 -8.592 1.00 . A A . 41 THR HG22 1 1 2 1124 1 1 41 THR HG23 H 2.207 -3.309 -9.655 1.00 . A A . 41 THR HG23 1 1 2 1125 1 1 41 THR N N 0.804 -3.128 -5.380 1.00 . A A . 41 THR N 1 1 2 1126 1 1 41 THR O O 1.767 -0.055 -6.854 1.00 . A A . 41 THR O 1 1 2 1127 1 1 41 THR OG1 O 2.343 -4.418 -7.286 1.00 . A A . 41 THR OG1 1 1 2 1128 1 1 42 ALA C C -0.740 1.509 -6.171 1.00 . A A . 42 ALA C 1 1 2 1129 1 1 42 ALA CA C -0.892 0.474 -7.282 1.00 . A A . 42 ALA CA 1 1 2 1130 1 1 42 ALA CB C -2.367 0.352 -7.655 1.00 . A A . 42 ALA CB 1 1 2 1131 1 1 42 ALA H H -0.983 -1.552 -6.573 1.00 . A A . 42 ALA H 1 1 2 1132 1 1 42 ALA HA H -0.342 0.819 -8.161 1.00 . A A . 42 ALA HA 1 1 2 1133 1 1 42 ALA HB1 H -2.491 -0.418 -8.407 1.00 . A A . 42 ALA HB1 1 1 2 1134 1 1 42 ALA HB2 H -2.960 0.099 -6.779 1.00 . A A . 42 ALA HB2 1 1 2 1135 1 1 42 ALA HB3 H -2.705 1.307 -8.059 1.00 . A A . 42 ALA HB3 1 1 2 1136 1 1 42 ALA N N -0.343 -0.818 -6.861 1.00 . A A . 42 ALA N 1 1 2 1137 1 1 42 ALA O O -0.417 2.670 -6.436 1.00 . A A . 42 ALA O 1 1 2 1138 1 1 43 PHE C C 0.887 2.119 -3.772 1.00 . A A . 43 PHE C 1 1 2 1139 1 1 43 PHE CA C -0.608 1.818 -3.746 1.00 . A A . 43 PHE CA 1 1 2 1140 1 1 43 PHE CB C -1.063 1.030 -2.513 1.00 . A A . 43 PHE CB 1 1 2 1141 1 1 43 PHE CD1 C 0.725 1.276 -0.790 1.00 . A A . 43 PHE CD1 1 1 2 1142 1 1 43 PHE CD2 C -1.424 2.321 -0.345 1.00 . A A . 43 PHE CD2 1 1 2 1143 1 1 43 PHE CE1 C 1.244 1.809 0.391 1.00 . A A . 43 PHE CE1 1 1 2 1144 1 1 43 PHE CE2 C -0.921 2.789 0.880 1.00 . A A . 43 PHE CE2 1 1 2 1145 1 1 43 PHE CG C -0.585 1.568 -1.189 1.00 . A A . 43 PHE CG 1 1 2 1146 1 1 43 PHE CZ C 0.414 2.550 1.237 1.00 . A A . 43 PHE CZ 1 1 2 1147 1 1 43 PHE H H -1.213 0.092 -4.822 1.00 . A A . 43 PHE H 1 1 2 1148 1 1 43 PHE HA H -1.122 2.771 -3.768 1.00 . A A . 43 PHE HA 1 1 2 1149 1 1 43 PHE HB2 H -2.148 0.963 -2.511 1.00 . A A . 43 PHE HB2 1 1 2 1150 1 1 43 PHE HB3 H -0.676 0.022 -2.593 1.00 . A A . 43 PHE HB3 1 1 2 1151 1 1 43 PHE HD1 H 1.333 0.638 -1.406 1.00 . A A . 43 PHE HD1 1 1 2 1152 1 1 43 PHE HD2 H -2.446 2.524 -0.625 1.00 . A A . 43 PHE HD2 1 1 2 1153 1 1 43 PHE HE1 H 2.277 1.650 0.655 1.00 . A A . 43 PHE HE1 1 1 2 1154 1 1 43 PHE HE2 H -1.530 3.374 1.542 1.00 . A A . 43 PHE HE2 1 1 2 1155 1 1 43 PHE HZ H 0.825 2.938 2.152 1.00 . A A . 43 PHE HZ 1 1 2 1156 1 1 43 PHE N N -0.950 1.067 -4.933 1.00 . A A . 43 PHE N 1 1 2 1157 1 1 43 PHE O O 1.265 3.284 -3.712 1.00 . A A . 43 PHE O 1 1 2 1158 1 1 44 LEU C C 3.766 2.213 -4.864 1.00 . A A . 44 LEU C 1 1 2 1159 1 1 44 LEU CA C 3.190 1.312 -3.772 1.00 . A A . 44 LEU CA 1 1 2 1160 1 1 44 LEU CB C 3.929 -0.030 -3.750 1.00 . A A . 44 LEU CB 1 1 2 1161 1 1 44 LEU CD1 C 4.432 -2.209 -2.639 1.00 . A A . 44 LEU CD1 1 1 2 1162 1 1 44 LEU CD2 C 3.969 -0.200 -1.191 1.00 . A A . 44 LEU CD2 1 1 2 1163 1 1 44 LEU CG C 3.647 -0.899 -2.512 1.00 . A A . 44 LEU CG 1 1 2 1164 1 1 44 LEU H H 1.409 0.150 -3.856 1.00 . A A . 44 LEU H 1 1 2 1165 1 1 44 LEU HA H 3.350 1.828 -2.831 1.00 . A A . 44 LEU HA 1 1 2 1166 1 1 44 LEU HB2 H 3.686 -0.593 -4.651 1.00 . A A . 44 LEU HB2 1 1 2 1167 1 1 44 LEU HB3 H 4.990 0.187 -3.791 1.00 . A A . 44 LEU HB3 1 1 2 1168 1 1 44 LEU HD11 H 5.492 -2.004 -2.790 1.00 . A A . 44 LEU HD11 1 1 2 1169 1 1 44 LEU HD12 H 4.312 -2.811 -1.738 1.00 . A A . 44 LEU HD12 1 1 2 1170 1 1 44 LEU HD13 H 4.053 -2.769 -3.494 1.00 . A A . 44 LEU HD13 1 1 2 1171 1 1 44 LEU HD21 H 3.451 0.748 -1.080 1.00 . A A . 44 LEU HD21 1 1 2 1172 1 1 44 LEU HD22 H 3.636 -0.831 -0.374 1.00 . A A . 44 LEU HD22 1 1 2 1173 1 1 44 LEU HD23 H 5.031 -0.017 -1.124 1.00 . A A . 44 LEU HD23 1 1 2 1174 1 1 44 LEU HG H 2.597 -1.151 -2.471 1.00 . A A . 44 LEU HG 1 1 2 1175 1 1 44 LEU N N 1.754 1.107 -3.885 1.00 . A A . 44 LEU N 1 1 2 1176 1 1 44 LEU O O 4.752 2.899 -4.613 1.00 . A A . 44 LEU O 1 1 2 1177 1 1 45 SER C C 3.418 4.611 -6.597 1.00 . A A . 45 SER C 1 1 2 1178 1 1 45 SER CA C 3.475 3.170 -7.123 1.00 . A A . 45 SER CA 1 1 2 1179 1 1 45 SER CB C 2.495 2.921 -8.285 1.00 . A A . 45 SER CB 1 1 2 1180 1 1 45 SER H H 2.386 1.596 -6.175 1.00 . A A . 45 SER H 1 1 2 1181 1 1 45 SER HA H 4.491 2.952 -7.460 1.00 . A A . 45 SER HA 1 1 2 1182 1 1 45 SER HB2 H 2.474 1.867 -8.540 1.00 . A A . 45 SER HB2 1 1 2 1183 1 1 45 SER HB3 H 1.485 3.152 -7.970 1.00 . A A . 45 SER HB3 1 1 2 1184 1 1 45 SER HG H 3.699 3.406 -9.765 1.00 . A A . 45 SER HG 1 1 2 1185 1 1 45 SER N N 3.146 2.252 -6.041 1.00 . A A . 45 SER N 1 1 2 1186 1 1 45 SER O O 4.371 5.376 -6.779 1.00 . A A . 45 SER O 1 1 2 1187 1 1 45 SER OG O 2.812 3.678 -9.439 1.00 . A A . 45 SER OG 1 1 2 1188 1 1 46 GLN C C 2.855 6.485 -4.028 1.00 . A A . 46 GLN C 1 1 2 1189 1 1 46 GLN CA C 2.087 6.286 -5.337 1.00 . A A . 46 GLN CA 1 1 2 1190 1 1 46 GLN CB C 0.577 6.442 -5.080 1.00 . A A . 46 GLN CB 1 1 2 1191 1 1 46 GLN CD C 0.194 6.399 -7.636 1.00 . A A . 46 GLN CD 1 1 2 1192 1 1 46 GLN CG C -0.207 6.981 -6.283 1.00 . A A . 46 GLN CG 1 1 2 1193 1 1 46 GLN H H 1.592 4.278 -5.820 1.00 . A A . 46 GLN H 1 1 2 1194 1 1 46 GLN HA H 2.421 7.055 -6.031 1.00 . A A . 46 GLN HA 1 1 2 1195 1 1 46 GLN HB2 H 0.158 5.480 -4.782 1.00 . A A . 46 GLN HB2 1 1 2 1196 1 1 46 GLN HB3 H 0.421 7.137 -4.252 1.00 . A A . 46 GLN HB3 1 1 2 1197 1 1 46 GLN HE21 H -0.616 4.531 -7.277 1.00 . A A . 46 GLN HE21 1 1 2 1198 1 1 46 GLN HE22 H 0.025 4.848 -8.887 1.00 . A A . 46 GLN HE22 1 1 2 1199 1 1 46 GLN HG2 H -1.266 6.792 -6.112 1.00 . A A . 46 GLN HG2 1 1 2 1200 1 1 46 GLN HG3 H -0.064 8.062 -6.323 1.00 . A A . 46 GLN HG3 1 1 2 1201 1 1 46 GLN N N 2.323 4.971 -5.924 1.00 . A A . 46 GLN N 1 1 2 1202 1 1 46 GLN NE2 N -0.219 5.180 -7.955 1.00 . A A . 46 GLN NE2 1 1 2 1203 1 1 46 GLN O O 3.360 7.574 -3.770 1.00 . A A . 46 GLN O 1 1 2 1204 1 1 46 GLN OE1 O 0.887 7.045 -8.415 1.00 . A A . 46 GLN OE1 1 1 2 1205 1 1 47 CYS C C 4.905 5.586 -1.717 1.00 . A A . 47 CYS C 1 1 2 1206 1 1 47 CYS CA C 3.382 5.618 -1.798 1.00 . A A . 47 CYS CA 1 1 2 1207 1 1 47 CYS CB C 2.759 4.513 -0.936 1.00 . A A . 47 CYS CB 1 1 2 1208 1 1 47 CYS H H 2.410 4.623 -3.417 1.00 . A A . 47 CYS H 1 1 2 1209 1 1 47 CYS HA H 3.058 6.592 -1.434 1.00 . A A . 47 CYS HA 1 1 2 1210 1 1 47 CYS HB2 H 1.717 4.389 -1.239 1.00 . A A . 47 CYS HB2 1 1 2 1211 1 1 47 CYS HB3 H 3.274 3.574 -1.136 1.00 . A A . 47 CYS HB3 1 1 2 1212 1 1 47 CYS N N 2.896 5.475 -3.164 1.00 . A A . 47 CYS N 1 1 2 1213 1 1 47 CYS O O 5.479 6.154 -0.790 1.00 . A A . 47 CYS O 1 1 2 1214 1 1 47 CYS SG S 2.744 4.791 0.856 1.00 . A A . 47 CYS SG 1 1 2 1215 1 1 48 TYR C C 7.335 5.259 -4.223 1.00 . A A . 48 TYR C 1 1 2 1216 1 1 48 TYR CA C 6.984 4.813 -2.808 1.00 . A A . 48 TYR CA 1 1 2 1217 1 1 48 TYR CB C 7.415 3.385 -2.500 1.00 . A A . 48 TYR CB 1 1 2 1218 1 1 48 TYR CD1 C 8.509 3.182 -0.230 1.00 . A A . 48 TYR CD1 1 1 2 1219 1 1 48 TYR CD2 C 6.251 2.323 -0.550 1.00 . A A . 48 TYR CD2 1 1 2 1220 1 1 48 TYR CE1 C 8.518 2.685 1.084 1.00 . A A . 48 TYR CE1 1 1 2 1221 1 1 48 TYR CE2 C 6.297 1.726 0.717 1.00 . A A . 48 TYR CE2 1 1 2 1222 1 1 48 TYR CG C 7.374 3.006 -1.041 1.00 . A A . 48 TYR CG 1 1 2 1223 1 1 48 TYR CZ C 7.403 1.962 1.562 1.00 . A A . 48 TYR CZ 1 1 2 1224 1 1 48 TYR H H 5.005 4.519 -3.432 1.00 . A A . 48 TYR H 1 1 2 1225 1 1 48 TYR HA H 7.496 5.433 -2.082 1.00 . A A . 48 TYR HA 1 1 2 1226 1 1 48 TYR HB2 H 6.768 2.706 -3.046 1.00 . A A . 48 TYR HB2 1 1 2 1227 1 1 48 TYR HB3 H 8.434 3.234 -2.855 1.00 . A A . 48 TYR HB3 1 1 2 1228 1 1 48 TYR HD1 H 9.385 3.679 -0.627 1.00 . A A . 48 TYR HD1 1 1 2 1229 1 1 48 TYR HD2 H 5.403 2.173 -1.197 1.00 . A A . 48 TYR HD2 1 1 2 1230 1 1 48 TYR HE1 H 9.388 2.835 1.710 1.00 . A A . 48 TYR HE1 1 1 2 1231 1 1 48 TYR HE2 H 5.519 1.041 1.025 1.00 . A A . 48 TYR HE2 1 1 2 1232 1 1 48 TYR HH H 8.161 1.644 3.366 1.00 . A A . 48 TYR HH 1 1 2 1233 1 1 48 TYR N N 5.547 4.939 -2.686 1.00 . A A . 48 TYR N 1 1 2 1234 1 1 48 TYR O O 7.575 6.446 -4.449 1.00 . A A . 48 TYR O 1 1 2 1235 1 1 48 TYR OH O 7.357 1.512 2.838 1.00 . A A . 48 TYR OH 1 1 2 1236 1 1 49 GLY C C 7.643 3.163 -7.334 1.00 . A A . 49 GLY C 1 1 2 1237 1 1 49 GLY CA C 7.729 4.477 -6.550 1.00 . A A . 49 GLY CA 1 1 2 1238 1 1 49 GLY H H 6.963 3.418 -4.878 1.00 . A A . 49 GLY H 1 1 2 1239 1 1 49 GLY HA2 H 8.768 4.808 -6.540 1.00 . A A . 49 GLY HA2 1 1 2 1240 1 1 49 GLY HA3 H 7.138 5.236 -7.059 1.00 . A A . 49 GLY HA3 1 1 2 1241 1 1 49 GLY N N 7.268 4.331 -5.177 1.00 . A A . 49 GLY N 1 1 2 1242 1 1 49 GLY O O 7.979 3.139 -8.515 1.00 . A A . 49 GLY O 1 1 2 1243 1 1 50 GLY C C 8.443 0.043 -7.445 1.00 . A A . 50 GLY C 1 1 2 1244 1 1 50 GLY CA C 7.088 0.752 -7.361 1.00 . A A . 50 GLY CA 1 1 2 1245 1 1 50 GLY H H 6.922 2.089 -5.752 1.00 . A A . 50 GLY H 1 1 2 1246 1 1 50 GLY HA2 H 6.665 0.851 -8.360 1.00 . A A . 50 GLY HA2 1 1 2 1247 1 1 50 GLY HA3 H 6.427 0.137 -6.749 1.00 . A A . 50 GLY HA3 1 1 2 1248 1 1 50 GLY N N 7.176 2.063 -6.728 1.00 . A A . 50 GLY N 1 1 2 1249 1 1 50 GLY O O 8.704 -0.670 -8.416 1.00 . A A . 50 GLY O 1 1 2 1250 1 1 51 CYS C C 11.575 0.450 -7.153 1.00 . A A . 51 CYS C 1 1 2 1251 1 1 51 CYS CA C 10.628 -0.261 -6.200 1.00 . A A . 51 CYS CA 1 1 2 1252 1 1 51 CYS CB C 10.768 -1.790 -6.278 1.00 . A A . 51 CYS CB 1 1 2 1253 1 1 51 CYS H H 8.901 0.789 -5.658 1.00 . A A . 51 CYS H 1 1 2 1254 1 1 51 CYS HA H 10.913 0.034 -5.191 1.00 . A A . 51 CYS HA 1 1 2 1255 1 1 51 CYS HB2 H 10.381 -2.118 -7.234 1.00 . A A . 51 CYS HB2 1 1 2 1256 1 1 51 CYS HB3 H 11.836 -2.015 -6.294 1.00 . A A . 51 CYS HB3 1 1 2 1257 1 1 51 CYS N N 9.266 0.208 -6.405 1.00 . A A . 51 CYS N 1 1 2 1258 1 1 51 CYS O O 11.598 0.130 -8.356 1.00 . A A . 51 CYS O 1 1 2 1259 1 1 51 CYS OXT O 12.388 1.254 -6.650 1.00 . A A . 51 CYS OXT 1 1 2 1260 1 1 51 CYS SG S 10.022 -2.798 -4.961 1.00 . A A . 51 CYS SG 1 1 3 1261 1 1 1 GLY C C -7.678 -5.827 -0.970 1.00 . A A . 1 GLY C 1 1 3 1262 1 1 1 GLY CA C -7.353 -7.043 -1.792 1.00 . A A . 1 GLY CA 1 1 3 1263 1 1 1 GLY H1 H -9.218 -7.036 -2.589 1.00 . A A . 1 GLY H1 1 1 3 1264 1 1 1 GLY H2 H -8.366 -8.419 -2.883 1.00 . A A . 1 GLY H2 1 1 3 1265 1 1 1 GLY H3 H -9.018 -8.146 -1.384 1.00 . A A . 1 GLY H3 1 1 3 1266 1 1 1 GLY HA2 H -6.811 -6.716 -2.677 1.00 . A A . 1 GLY HA2 1 1 3 1267 1 1 1 GLY HA3 H -6.725 -7.729 -1.224 1.00 . A A . 1 GLY HA3 1 1 3 1268 1 1 1 GLY N N -8.589 -7.717 -2.191 1.00 . A A . 1 GLY N 1 1 3 1269 1 1 1 GLY O O -8.453 -4.976 -1.412 1.00 . A A . 1 GLY O 1 1 3 1270 1 1 2 GLU C C -6.826 -3.360 0.675 1.00 . A A . 2 GLU C 1 1 3 1271 1 1 2 GLU CA C -7.326 -4.704 1.197 1.00 . A A . 2 GLU CA 1 1 3 1272 1 1 2 GLU CB C -6.660 -5.081 2.532 1.00 . A A . 2 GLU CB 1 1 3 1273 1 1 2 GLU CD C -4.450 -6.031 3.472 1.00 . A A . 2 GLU CD 1 1 3 1274 1 1 2 GLU CG C -5.138 -5.200 2.392 1.00 . A A . 2 GLU CG 1 1 3 1275 1 1 2 GLU H H -6.400 -6.447 0.464 1.00 . A A . 2 GLU H 1 1 3 1276 1 1 2 GLU HA H -8.385 -4.625 1.371 1.00 . A A . 2 GLU HA 1 1 3 1277 1 1 2 GLU HB2 H -6.899 -4.325 3.276 1.00 . A A . 2 GLU HB2 1 1 3 1278 1 1 2 GLU HB3 H -7.067 -6.038 2.862 1.00 . A A . 2 GLU HB3 1 1 3 1279 1 1 2 GLU HG2 H -4.959 -5.669 1.432 1.00 . A A . 2 GLU HG2 1 1 3 1280 1 1 2 GLU HG3 H -4.678 -4.214 2.365 1.00 . A A . 2 GLU HG3 1 1 3 1281 1 1 2 GLU N N -7.108 -5.766 0.227 1.00 . A A . 2 GLU N 1 1 3 1282 1 1 2 GLU O O -7.428 -2.319 0.940 1.00 . A A . 2 GLU O 1 1 3 1283 1 1 2 GLU OE1 O -4.902 -6.036 4.637 1.00 . A A . 2 GLU OE1 1 1 3 1284 1 1 2 GLU OE2 O -3.456 -6.701 3.111 1.00 . A A . 2 GLU OE2 1 1 3 1285 1 1 3 CYS C C -5.795 -1.516 -1.613 1.00 . A A . 3 CYS C 1 1 3 1286 1 1 3 CYS CA C -5.041 -2.159 -0.448 1.00 . A A . 3 CYS CA 1 1 3 1287 1 1 3 CYS CB C -3.592 -2.492 -0.784 1.00 . A A . 3 CYS CB 1 1 3 1288 1 1 3 CYS H H -5.331 -4.262 -0.369 1.00 . A A . 3 CYS H 1 1 3 1289 1 1 3 CYS HA H -5.054 -1.481 0.406 1.00 . A A . 3 CYS HA 1 1 3 1290 1 1 3 CYS HB2 H -3.129 -2.951 0.090 1.00 . A A . 3 CYS HB2 1 1 3 1291 1 1 3 CYS HB3 H -3.567 -3.212 -1.599 1.00 . A A . 3 CYS HB3 1 1 3 1292 1 1 3 CYS N N -5.714 -3.375 -0.057 1.00 . A A . 3 CYS N 1 1 3 1293 1 1 3 CYS O O -6.007 -0.299 -1.614 1.00 . A A . 3 CYS O 1 1 3 1294 1 1 3 CYS SG S -2.623 -1.052 -1.256 1.00 . A A . 3 CYS SG 1 1 3 1295 1 1 4 GLU C C -8.504 -1.394 -2.953 1.00 . A A . 4 GLU C 1 1 3 1296 1 1 4 GLU CA C -7.214 -1.932 -3.587 1.00 . A A . 4 GLU CA 1 1 3 1297 1 1 4 GLU CB C -7.536 -3.112 -4.517 1.00 . A A . 4 GLU CB 1 1 3 1298 1 1 4 GLU CD C -6.770 -4.604 -6.432 1.00 . A A . 4 GLU CD 1 1 3 1299 1 1 4 GLU CG C -6.377 -3.504 -5.441 1.00 . A A . 4 GLU CG 1 1 3 1300 1 1 4 GLU H H -5.974 -3.316 -2.518 1.00 . A A . 4 GLU H 1 1 3 1301 1 1 4 GLU HA H -6.770 -1.131 -4.180 1.00 . A A . 4 GLU HA 1 1 3 1302 1 1 4 GLU HB2 H -7.812 -3.973 -3.911 1.00 . A A . 4 GLU HB2 1 1 3 1303 1 1 4 GLU HB3 H -8.390 -2.845 -5.141 1.00 . A A . 4 GLU HB3 1 1 3 1304 1 1 4 GLU HG2 H -6.065 -2.626 -5.996 1.00 . A A . 4 GLU HG2 1 1 3 1305 1 1 4 GLU HG3 H -5.537 -3.844 -4.844 1.00 . A A . 4 GLU HG3 1 1 3 1306 1 1 4 GLU N N -6.269 -2.340 -2.555 1.00 . A A . 4 GLU N 1 1 3 1307 1 1 4 GLU O O -9.011 -0.362 -3.387 1.00 . A A . 4 GLU O 1 1 3 1308 1 1 4 GLU OE1 O -6.789 -5.805 -6.060 1.00 . A A . 4 GLU OE1 1 1 3 1309 1 1 4 GLU OE2 O -7.110 -4.299 -7.597 1.00 . A A . 4 GLU OE2 1 1 3 1310 1 1 5 GLN C C -10.162 -0.321 -0.565 1.00 . A A . 5 GLN C 1 1 3 1311 1 1 5 GLN CA C -10.301 -1.649 -1.303 1.00 . A A . 5 GLN CA 1 1 3 1312 1 1 5 GLN CB C -10.806 -2.773 -0.380 1.00 . A A . 5 GLN CB 1 1 3 1313 1 1 5 GLN CD C -13.247 -2.354 -1.015 1.00 . A A . 5 GLN CD 1 1 3 1314 1 1 5 GLN CG C -12.240 -2.552 0.121 1.00 . A A . 5 GLN CG 1 1 3 1315 1 1 5 GLN H H -8.603 -2.915 -1.604 1.00 . A A . 5 GLN H 1 1 3 1316 1 1 5 GLN HA H -11.022 -1.457 -2.094 1.00 . A A . 5 GLN HA 1 1 3 1317 1 1 5 GLN HB2 H -10.767 -3.726 -0.910 1.00 . A A . 5 GLN HB2 1 1 3 1318 1 1 5 GLN HB3 H -10.144 -2.853 0.484 1.00 . A A . 5 GLN HB3 1 1 3 1319 1 1 5 GLN HE21 H -13.723 -0.490 -0.366 1.00 . A A . 5 GLN HE21 1 1 3 1320 1 1 5 GLN HE22 H -14.596 -1.046 -1.778 1.00 . A A . 5 GLN HE22 1 1 3 1321 1 1 5 GLN HG2 H -12.541 -3.418 0.711 1.00 . A A . 5 GLN HG2 1 1 3 1322 1 1 5 GLN HG3 H -12.251 -1.690 0.786 1.00 . A A . 5 GLN HG3 1 1 3 1323 1 1 5 GLN N N -9.049 -2.065 -1.934 1.00 . A A . 5 GLN N 1 1 3 1324 1 1 5 GLN NE2 N -13.885 -1.200 -1.080 1.00 . A A . 5 GLN NE2 1 1 3 1325 1 1 5 GLN O O -11.114 0.464 -0.536 1.00 . A A . 5 GLN O 1 1 3 1326 1 1 5 GLN OE1 O -13.470 -3.239 -1.845 1.00 . A A . 5 GLN OE1 1 1 3 1327 1 1 6 CYS C C -8.559 2.321 -0.520 1.00 . A A . 6 CYS C 1 1 3 1328 1 1 6 CYS CA C -8.711 1.259 0.570 1.00 . A A . 6 CYS CA 1 1 3 1329 1 1 6 CYS CB C -7.480 1.150 1.455 1.00 . A A . 6 CYS CB 1 1 3 1330 1 1 6 CYS H H -8.273 -0.760 0.008 1.00 . A A . 6 CYS H 1 1 3 1331 1 1 6 CYS HA H -9.557 1.535 1.202 1.00 . A A . 6 CYS HA 1 1 3 1332 1 1 6 CYS HB2 H -7.561 0.212 1.996 1.00 . A A . 6 CYS HB2 1 1 3 1333 1 1 6 CYS HB3 H -6.595 1.094 0.833 1.00 . A A . 6 CYS HB3 1 1 3 1334 1 1 6 CYS N N -8.987 -0.038 -0.009 1.00 . A A . 6 CYS N 1 1 3 1335 1 1 6 CYS O O -9.022 3.440 -0.328 1.00 . A A . 6 CYS O 1 1 3 1336 1 1 6 CYS SG S -7.309 2.497 2.656 1.00 . A A . 6 CYS SG 1 1 3 1337 1 1 7 PHE C C -9.472 3.184 -3.285 1.00 . A A . 7 PHE C 1 1 3 1338 1 1 7 PHE CA C -8.030 2.886 -2.850 1.00 . A A . 7 PHE CA 1 1 3 1339 1 1 7 PHE CB C -7.189 2.311 -3.998 1.00 . A A . 7 PHE CB 1 1 3 1340 1 1 7 PHE CD1 C -4.789 2.764 -3.289 1.00 . A A . 7 PHE CD1 1 1 3 1341 1 1 7 PHE CD2 C -5.695 3.943 -5.223 1.00 . A A . 7 PHE CD2 1 1 3 1342 1 1 7 PHE CE1 C -3.561 3.417 -3.500 1.00 . A A . 7 PHE CE1 1 1 3 1343 1 1 7 PHE CE2 C -4.478 4.622 -5.393 1.00 . A A . 7 PHE CE2 1 1 3 1344 1 1 7 PHE CG C -5.861 3.020 -4.170 1.00 . A A . 7 PHE CG 1 1 3 1345 1 1 7 PHE CZ C -3.406 4.360 -4.527 1.00 . A A . 7 PHE CZ 1 1 3 1346 1 1 7 PHE H H -7.649 1.049 -1.817 1.00 . A A . 7 PHE H 1 1 3 1347 1 1 7 PHE HA H -7.588 3.839 -2.556 1.00 . A A . 7 PHE HA 1 1 3 1348 1 1 7 PHE HB2 H -6.999 1.249 -3.838 1.00 . A A . 7 PHE HB2 1 1 3 1349 1 1 7 PHE HB3 H -7.751 2.396 -4.930 1.00 . A A . 7 PHE HB3 1 1 3 1350 1 1 7 PHE HD1 H -4.896 2.096 -2.434 1.00 . A A . 7 PHE HD1 1 1 3 1351 1 1 7 PHE HD2 H -6.507 4.155 -5.903 1.00 . A A . 7 PHE HD2 1 1 3 1352 1 1 7 PHE HE1 H -2.735 3.255 -2.827 1.00 . A A . 7 PHE HE1 1 1 3 1353 1 1 7 PHE HE2 H -4.391 5.376 -6.164 1.00 . A A . 7 PHE HE2 1 1 3 1354 1 1 7 PHE HZ H -2.475 4.912 -4.617 1.00 . A A . 7 PHE HZ 1 1 3 1355 1 1 7 PHE N N -8.004 1.991 -1.692 1.00 . A A . 7 PHE N 1 1 3 1356 1 1 7 PHE O O -9.794 4.340 -3.568 1.00 . A A . 7 PHE O 1 1 3 1357 1 1 8 SER C C -12.471 3.026 -2.210 1.00 . A A . 8 SER C 1 1 3 1358 1 1 8 SER CA C -11.804 2.308 -3.395 1.00 . A A . 8 SER CA 1 1 3 1359 1 1 8 SER CB C -12.405 0.917 -3.608 1.00 . A A . 8 SER CB 1 1 3 1360 1 1 8 SER H H -9.985 1.248 -3.112 1.00 . A A . 8 SER H 1 1 3 1361 1 1 8 SER HA H -12.019 2.915 -4.274 1.00 . A A . 8 SER HA 1 1 3 1362 1 1 8 SER HB2 H -11.855 0.180 -3.029 1.00 . A A . 8 SER HB2 1 1 3 1363 1 1 8 SER HB3 H -13.443 0.907 -3.274 1.00 . A A . 8 SER HB3 1 1 3 1364 1 1 8 SER HG H -13.301 0.617 -5.269 1.00 . A A . 8 SER HG 1 1 3 1365 1 1 8 SER N N -10.352 2.181 -3.273 1.00 . A A . 8 SER N 1 1 3 1366 1 1 8 SER O O -13.696 3.161 -2.184 1.00 . A A . 8 SER O 1 1 3 1367 1 1 8 SER OG O -12.362 0.583 -4.981 1.00 . A A . 8 SER OG 1 1 3 1368 1 1 9 ASP C C -11.377 5.762 -0.322 1.00 . A A . 9 ASP C 1 1 3 1369 1 1 9 ASP CA C -12.153 4.440 -0.209 1.00 . A A . 9 ASP CA 1 1 3 1370 1 1 9 ASP CB C -11.956 3.784 1.156 1.00 . A A . 9 ASP CB 1 1 3 1371 1 1 9 ASP CG C -13.171 4.003 2.046 1.00 . A A . 9 ASP CG 1 1 3 1372 1 1 9 ASP H H -10.748 3.166 -1.145 1.00 . A A . 9 ASP H 1 1 3 1373 1 1 9 ASP HA H -13.213 4.663 -0.348 1.00 . A A . 9 ASP HA 1 1 3 1374 1 1 9 ASP HB2 H -11.815 2.712 1.028 1.00 . A A . 9 ASP HB2 1 1 3 1375 1 1 9 ASP HB3 H -11.041 4.138 1.624 1.00 . A A . 9 ASP HB3 1 1 3 1376 1 1 9 ASP N N -11.707 3.484 -1.221 1.00 . A A . 9 ASP N 1 1 3 1377 1 1 9 ASP O O -11.062 6.438 0.663 1.00 . A A . 9 ASP O 1 1 3 1378 1 1 9 ASP OD1 O -13.662 5.143 2.183 1.00 . A A . 9 ASP OD1 1 1 3 1379 1 1 9 ASP OD2 O -13.635 2.961 2.572 1.00 . A A . 9 ASP OD2 1 1 3 1380 1 1 10 GLY C C -8.858 7.311 -1.416 1.00 . A A . 10 GLY C 1 1 3 1381 1 1 10 GLY CA C -10.320 7.368 -1.863 1.00 . A A . 10 GLY CA 1 1 3 1382 1 1 10 GLY H H -11.299 5.543 -2.324 1.00 . A A . 10 GLY H 1 1 3 1383 1 1 10 GLY HA2 H -10.793 8.218 -1.374 1.00 . A A . 10 GLY HA2 1 1 3 1384 1 1 10 GLY HA3 H -10.333 7.521 -2.941 1.00 . A A . 10 GLY HA3 1 1 3 1385 1 1 10 GLY N N -11.083 6.167 -1.560 1.00 . A A . 10 GLY N 1 1 3 1386 1 1 10 GLY O O -8.212 8.359 -1.375 1.00 . A A . 10 GLY O 1 1 3 1387 1 1 11 GLY C C -5.968 6.394 -1.624 1.00 . A A . 11 GLY C 1 1 3 1388 1 1 11 GLY CA C -6.996 5.862 -0.642 1.00 . A A . 11 GLY CA 1 1 3 1389 1 1 11 GLY H H -8.972 5.324 -1.072 1.00 . A A . 11 GLY H 1 1 3 1390 1 1 11 GLY HA2 H -6.866 4.783 -0.594 1.00 . A A . 11 GLY HA2 1 1 3 1391 1 1 11 GLY HA3 H -6.835 6.264 0.350 1.00 . A A . 11 GLY HA3 1 1 3 1392 1 1 11 GLY N N -8.356 6.126 -1.067 1.00 . A A . 11 GLY N 1 1 3 1393 1 1 11 GLY O O -6.134 6.223 -2.827 1.00 . A A . 11 GLY O 1 1 3 1394 1 1 12 ASP C C -2.493 6.585 -1.292 1.00 . A A . 12 ASP C 1 1 3 1395 1 1 12 ASP CA C -3.700 7.346 -1.854 1.00 . A A . 12 ASP CA 1 1 3 1396 1 1 12 ASP CB C -3.470 8.869 -1.834 1.00 . A A . 12 ASP CB 1 1 3 1397 1 1 12 ASP CG C -3.771 9.652 -0.545 1.00 . A A . 12 ASP CG 1 1 3 1398 1 1 12 ASP H H -4.812 7.005 -0.098 1.00 . A A . 12 ASP H 1 1 3 1399 1 1 12 ASP HA H -3.815 7.043 -2.893 1.00 . A A . 12 ASP HA 1 1 3 1400 1 1 12 ASP HB2 H -2.451 9.065 -2.142 1.00 . A A . 12 ASP HB2 1 1 3 1401 1 1 12 ASP HB3 H -4.122 9.276 -2.610 1.00 . A A . 12 ASP HB3 1 1 3 1402 1 1 12 ASP N N -4.873 6.943 -1.098 1.00 . A A . 12 ASP N 1 1 3 1403 1 1 12 ASP O O -2.152 5.503 -1.766 1.00 . A A . 12 ASP O 1 1 3 1404 1 1 12 ASP OD1 O -3.482 9.173 0.579 1.00 . A A . 12 ASP OD1 1 1 3 1405 1 1 12 ASP OD2 O -4.188 10.828 -0.662 1.00 . A A . 12 ASP OD2 1 1 3 1406 1 1 13 CYS C C -0.867 6.938 1.891 1.00 . A A . 13 CYS C 1 1 3 1407 1 1 13 CYS CA C -0.674 6.617 0.415 1.00 . A A . 13 CYS CA 1 1 3 1408 1 1 13 CYS CB C 0.550 7.276 -0.257 1.00 . A A . 13 CYS CB 1 1 3 1409 1 1 13 CYS H H -2.277 7.957 0.145 1.00 . A A . 13 CYS H 1 1 3 1410 1 1 13 CYS HA H -0.616 5.538 0.315 1.00 . A A . 13 CYS HA 1 1 3 1411 1 1 13 CYS HB2 H 0.688 6.801 -1.227 1.00 . A A . 13 CYS HB2 1 1 3 1412 1 1 13 CYS HB3 H 0.298 8.314 -0.464 1.00 . A A . 13 CYS HB3 1 1 3 1413 1 1 13 CYS N N -1.868 7.109 -0.245 1.00 . A A . 13 CYS N 1 1 3 1414 1 1 13 CYS O O -1.028 6.020 2.703 1.00 . A A . 13 CYS O 1 1 3 1415 1 1 13 CYS SG S 2.171 7.325 0.568 1.00 . A A . 13 CYS SG 1 1 3 1416 1 1 14 THR C C -2.599 8.134 4.064 1.00 . A A . 14 THR C 1 1 3 1417 1 1 14 THR CA C -1.228 8.640 3.602 1.00 . A A . 14 THR CA 1 1 3 1418 1 1 14 THR CB C -1.072 10.160 3.745 1.00 . A A . 14 THR CB 1 1 3 1419 1 1 14 THR CG2 C -1.024 10.631 5.202 1.00 . A A . 14 THR CG2 1 1 3 1420 1 1 14 THR H H -0.895 8.952 1.524 1.00 . A A . 14 THR H 1 1 3 1421 1 1 14 THR HA H -0.482 8.162 4.238 1.00 . A A . 14 THR HA 1 1 3 1422 1 1 14 THR HB H -1.907 10.650 3.245 1.00 . A A . 14 THR HB 1 1 3 1423 1 1 14 THR HG1 H 0.666 9.770 2.981 1.00 . A A . 14 THR HG1 1 1 3 1424 1 1 14 THR HG21 H -1.920 10.306 5.735 1.00 . A A . 14 THR HG21 1 1 3 1425 1 1 14 THR HG22 H -0.147 10.222 5.704 1.00 . A A . 14 THR HG22 1 1 3 1426 1 1 14 THR HG23 H -0.980 11.720 5.235 1.00 . A A . 14 THR HG23 1 1 3 1427 1 1 14 THR N N -0.955 8.228 2.235 1.00 . A A . 14 THR N 1 1 3 1428 1 1 14 THR O O -2.662 7.540 5.137 1.00 . A A . 14 THR O 1 1 3 1429 1 1 14 THR OG1 O 0.137 10.563 3.128 1.00 . A A . 14 THR OG1 1 1 3 1430 1 1 15 THR C C -5.366 6.492 3.761 1.00 . A A . 15 THR C 1 1 3 1431 1 1 15 THR CA C -5.024 7.996 3.846 1.00 . A A . 15 THR CA 1 1 3 1432 1 1 15 THR CB C -6.036 8.913 3.112 1.00 . A A . 15 THR CB 1 1 3 1433 1 1 15 THR CG2 C -6.459 8.492 1.710 1.00 . A A . 15 THR CG2 1 1 3 1434 1 1 15 THR H H -3.625 8.692 2.366 1.00 . A A . 15 THR H 1 1 3 1435 1 1 15 THR HA H -5.035 8.276 4.901 1.00 . A A . 15 THR HA 1 1 3 1436 1 1 15 THR HB H -5.556 9.885 3.009 1.00 . A A . 15 THR HB 1 1 3 1437 1 1 15 THR HG1 H -7.968 9.011 3.279 1.00 . A A . 15 THR HG1 1 1 3 1438 1 1 15 THR HG21 H -5.612 8.072 1.185 1.00 . A A . 15 THR HG21 1 1 3 1439 1 1 15 THR HG22 H -7.249 7.746 1.766 1.00 . A A . 15 THR HG22 1 1 3 1440 1 1 15 THR HG23 H -6.828 9.352 1.151 1.00 . A A . 15 THR HG23 1 1 3 1441 1 1 15 THR N N -3.692 8.288 3.302 1.00 . A A . 15 THR N 1 1 3 1442 1 1 15 THR O O -6.535 6.124 3.656 1.00 . A A . 15 THR O 1 1 3 1443 1 1 15 THR OG1 O -7.210 9.121 3.874 1.00 . A A . 15 THR OG1 1 1 3 1444 1 1 16 CYS C C -3.497 3.645 5.052 1.00 . A A . 16 CYS C 1 1 3 1445 1 1 16 CYS CA C -4.509 4.162 4.037 1.00 . A A . 16 CYS CA 1 1 3 1446 1 1 16 CYS CB C -4.432 3.550 2.626 1.00 . A A . 16 CYS CB 1 1 3 1447 1 1 16 CYS H H -3.447 5.999 4.057 1.00 . A A . 16 CYS H 1 1 3 1448 1 1 16 CYS HA H -5.477 3.863 4.450 1.00 . A A . 16 CYS HA 1 1 3 1449 1 1 16 CYS HB2 H -3.642 4.043 2.059 1.00 . A A . 16 CYS HB2 1 1 3 1450 1 1 16 CYS HB3 H -4.216 2.480 2.635 1.00 . A A . 16 CYS HB3 1 1 3 1451 1 1 16 CYS N N -4.377 5.614 3.949 1.00 . A A . 16 CYS N 1 1 3 1452 1 1 16 CYS O O -3.917 2.886 5.915 1.00 . A A . 16 CYS O 1 1 3 1453 1 1 16 CYS SG S -6.005 3.762 1.751 1.00 . A A . 16 CYS SG 1 1 3 1454 1 1 17 PHE C C -1.509 3.378 7.387 1.00 . A A . 17 PHE C 1 1 3 1455 1 1 17 PHE CA C -1.179 3.486 5.885 1.00 . A A . 17 PHE CA 1 1 3 1456 1 1 17 PHE CB C 0.138 4.255 5.687 1.00 . A A . 17 PHE CB 1 1 3 1457 1 1 17 PHE CD1 C 1.693 2.335 6.196 1.00 . A A . 17 PHE CD1 1 1 3 1458 1 1 17 PHE CD2 C 2.045 4.415 7.391 1.00 . A A . 17 PHE CD2 1 1 3 1459 1 1 17 PHE CE1 C 2.759 1.736 6.890 1.00 . A A . 17 PHE CE1 1 1 3 1460 1 1 17 PHE CE2 C 3.133 3.822 8.066 1.00 . A A . 17 PHE CE2 1 1 3 1461 1 1 17 PHE CG C 1.327 3.669 6.436 1.00 . A A . 17 PHE CG 1 1 3 1462 1 1 17 PHE CZ C 3.497 2.490 7.806 1.00 . A A . 17 PHE CZ 1 1 3 1463 1 1 17 PHE H H -1.931 4.748 4.345 1.00 . A A . 17 PHE H 1 1 3 1464 1 1 17 PHE HA H -1.034 2.469 5.520 1.00 . A A . 17 PHE HA 1 1 3 1465 1 1 17 PHE HB2 H 0.380 4.269 4.623 1.00 . A A . 17 PHE HB2 1 1 3 1466 1 1 17 PHE HB3 H -0.018 5.283 6.005 1.00 . A A . 17 PHE HB3 1 1 3 1467 1 1 17 PHE HD1 H 1.141 1.780 5.459 1.00 . A A . 17 PHE HD1 1 1 3 1468 1 1 17 PHE HD2 H 1.767 5.435 7.620 1.00 . A A . 17 PHE HD2 1 1 3 1469 1 1 17 PHE HE1 H 3.032 0.701 6.723 1.00 . A A . 17 PHE HE1 1 1 3 1470 1 1 17 PHE HE2 H 3.684 4.367 8.817 1.00 . A A . 17 PHE HE2 1 1 3 1471 1 1 17 PHE HZ H 4.324 2.024 8.322 1.00 . A A . 17 PHE HZ 1 1 3 1472 1 1 17 PHE N N -2.230 4.082 5.048 1.00 . A A . 17 PHE N 1 1 3 1473 1 1 17 PHE O O -1.030 2.443 8.033 1.00 . A A . 17 PHE O 1 1 3 1474 1 1 18 ASN C C -1.571 4.402 10.376 1.00 . A A . 18 ASN C 1 1 3 1475 1 1 18 ASN CA C -2.724 4.341 9.370 1.00 . A A . 18 ASN CA 1 1 3 1476 1 1 18 ASN CB C -3.681 3.180 9.682 1.00 . A A . 18 ASN CB 1 1 3 1477 1 1 18 ASN CG C -4.867 3.603 10.545 1.00 . A A . 18 ASN CG 1 1 3 1478 1 1 18 ASN H H -2.625 5.084 7.404 1.00 . A A . 18 ASN H 1 1 3 1479 1 1 18 ASN HA H -3.281 5.269 9.501 1.00 . A A . 18 ASN HA 1 1 3 1480 1 1 18 ASN HB2 H -4.056 2.759 8.752 1.00 . A A . 18 ASN HB2 1 1 3 1481 1 1 18 ASN HB3 H -3.124 2.402 10.201 1.00 . A A . 18 ASN HB3 1 1 3 1482 1 1 18 ASN HD21 H -6.160 2.733 9.246 1.00 . A A . 18 ASN HD21 1 1 3 1483 1 1 18 ASN HD22 H -6.917 3.545 10.585 1.00 . A A . 18 ASN HD22 1 1 3 1484 1 1 18 ASN N N -2.288 4.306 7.961 1.00 . A A . 18 ASN N 1 1 3 1485 1 1 18 ASN ND2 N -6.068 3.256 10.120 1.00 . A A . 18 ASN ND2 1 1 3 1486 1 1 18 ASN O O -1.764 4.252 11.578 1.00 . A A . 18 ASN O 1 1 3 1487 1 1 18 ASN OD1 O -4.733 4.270 11.567 1.00 . A A . 18 ASN OD1 1 1 3 1488 1 1 19 ASN C C 1.052 2.970 11.023 1.00 . A A . 19 ASN C 1 1 3 1489 1 1 19 ASN CA C 0.887 4.444 10.638 1.00 . A A . 19 ASN CA 1 1 3 1490 1 1 19 ASN CB C 1.094 5.451 11.776 1.00 . A A . 19 ASN CB 1 1 3 1491 1 1 19 ASN CG C 2.570 5.507 12.155 1.00 . A A . 19 ASN CG 1 1 3 1492 1 1 19 ASN H H -0.294 4.710 8.895 1.00 . A A . 19 ASN H 1 1 3 1493 1 1 19 ASN HA H 1.685 4.655 9.940 1.00 . A A . 19 ASN HA 1 1 3 1494 1 1 19 ASN HB2 H 0.755 6.434 11.452 1.00 . A A . 19 ASN HB2 1 1 3 1495 1 1 19 ASN HB3 H 0.512 5.153 12.651 1.00 . A A . 19 ASN HB3 1 1 3 1496 1 1 19 ASN HD21 H 2.964 7.111 10.921 1.00 . A A . 19 ASN HD21 1 1 3 1497 1 1 19 ASN HD22 H 4.321 6.421 11.779 1.00 . A A . 19 ASN HD22 1 1 3 1498 1 1 19 ASN N N -0.352 4.660 9.901 1.00 . A A . 19 ASN N 1 1 3 1499 1 1 19 ASN ND2 N 3.336 6.407 11.555 1.00 . A A . 19 ASN ND2 1 1 3 1500 1 1 19 ASN O O 1.112 2.605 12.195 1.00 . A A . 19 ASN O 1 1 3 1501 1 1 19 ASN OD1 O 3.046 4.726 12.971 1.00 . A A . 19 ASN OD1 1 1 3 1502 1 1 20 GLY C C 0.574 -0.297 10.482 1.00 . A A . 20 GLY C 1 1 3 1503 1 1 20 GLY CA C 1.625 0.749 10.101 1.00 . A A . 20 GLY CA 1 1 3 1504 1 1 20 GLY H H 0.958 2.455 9.065 1.00 . A A . 20 GLY H 1 1 3 1505 1 1 20 GLY HA2 H 2.468 0.730 10.788 1.00 . A A . 20 GLY HA2 1 1 3 1506 1 1 20 GLY HA3 H 2.027 0.470 9.132 1.00 . A A . 20 GLY HA3 1 1 3 1507 1 1 20 GLY N N 1.119 2.112 10.002 1.00 . A A . 20 GLY N 1 1 3 1508 1 1 20 GLY O O 0.905 -1.483 10.571 1.00 . A A . 20 GLY O 1 1 3 1509 1 1 21 THR C C -2.943 -0.671 9.897 1.00 . A A . 21 THR C 1 1 3 1510 1 1 21 THR CA C -1.843 -0.735 10.972 1.00 . A A . 21 THR CA 1 1 3 1511 1 1 21 THR CB C -2.344 -0.272 12.352 1.00 . A A . 21 THR CB 1 1 3 1512 1 1 21 THR CG2 C -1.406 -0.781 13.454 1.00 . A A . 21 THR CG2 1 1 3 1513 1 1 21 THR H H -0.881 1.090 10.663 1.00 . A A . 21 THR H 1 1 3 1514 1 1 21 THR HA H -1.545 -1.781 11.049 1.00 . A A . 21 THR HA 1 1 3 1515 1 1 21 THR HB H -3.346 -0.660 12.538 1.00 . A A . 21 THR HB 1 1 3 1516 1 1 21 THR HG1 H -2.734 1.454 13.215 1.00 . A A . 21 THR HG1 1 1 3 1517 1 1 21 THR HG21 H -1.362 -1.868 13.420 1.00 . A A . 21 THR HG21 1 1 3 1518 1 1 21 THR HG22 H -0.403 -0.372 13.331 1.00 . A A . 21 THR HG22 1 1 3 1519 1 1 21 THR HG23 H -1.787 -0.496 14.433 1.00 . A A . 21 THR HG23 1 1 3 1520 1 1 21 THR N N -0.689 0.098 10.615 1.00 . A A . 21 THR N 1 1 3 1521 1 1 21 THR O O -4.022 -1.247 10.059 1.00 . A A . 21 THR O 1 1 3 1522 1 1 21 THR OG1 O -2.374 1.145 12.361 1.00 . A A . 21 THR OG1 1 1 3 1523 1 1 22 GLY C C -3.572 -1.096 6.763 1.00 . A A . 22 GLY C 1 1 3 1524 1 1 22 GLY CA C -3.561 0.154 7.644 1.00 . A A . 22 GLY CA 1 1 3 1525 1 1 22 GLY H H -1.803 0.527 8.730 1.00 . A A . 22 GLY H 1 1 3 1526 1 1 22 GLY HA2 H -3.191 0.981 7.049 1.00 . A A . 22 GLY HA2 1 1 3 1527 1 1 22 GLY HA3 H -4.574 0.376 7.978 1.00 . A A . 22 GLY HA3 1 1 3 1528 1 1 22 GLY N N -2.683 0.038 8.794 1.00 . A A . 22 GLY N 1 1 3 1529 1 1 22 GLY O O -2.917 -2.093 7.084 1.00 . A A . 22 GLY O 1 1 3 1530 1 1 23 PRO C C -3.064 -2.330 3.972 1.00 . A A . 23 PRO C 1 1 3 1531 1 1 23 PRO CA C -4.391 -2.180 4.724 1.00 . A A . 23 PRO CA 1 1 3 1532 1 1 23 PRO CB C -5.602 -1.885 3.841 1.00 . A A . 23 PRO CB 1 1 3 1533 1 1 23 PRO CD C -5.062 0.093 5.139 1.00 . A A . 23 PRO CD 1 1 3 1534 1 1 23 PRO CG C -5.795 -0.376 3.894 1.00 . A A . 23 PRO CG 1 1 3 1535 1 1 23 PRO HA H -4.576 -3.098 5.284 1.00 . A A . 23 PRO HA 1 1 3 1536 1 1 23 PRO HB2 H -5.455 -2.213 2.816 1.00 . A A . 23 PRO HB2 1 1 3 1537 1 1 23 PRO HB3 H -6.481 -2.363 4.277 1.00 . A A . 23 PRO HB3 1 1 3 1538 1 1 23 PRO HD2 H -4.421 0.925 4.850 1.00 . A A . 23 PRO HD2 1 1 3 1539 1 1 23 PRO HD3 H -5.778 0.439 5.880 1.00 . A A . 23 PRO HD3 1 1 3 1540 1 1 23 PRO HG2 H -5.347 0.084 3.013 1.00 . A A . 23 PRO HG2 1 1 3 1541 1 1 23 PRO HG3 H -6.853 -0.135 3.976 1.00 . A A . 23 PRO HG3 1 1 3 1542 1 1 23 PRO N N -4.302 -1.052 5.635 1.00 . A A . 23 PRO N 1 1 3 1543 1 1 23 PRO O O -2.314 -3.274 4.218 1.00 . A A . 23 PRO O 1 1 3 1544 1 1 24 CYS C C -0.490 -0.676 3.765 1.00 . A A . 24 CYS C 1 1 3 1545 1 1 24 CYS CA C -1.347 -1.221 2.622 1.00 . A A . 24 CYS CA 1 1 3 1546 1 1 24 CYS CB C -1.276 -0.331 1.370 1.00 . A A . 24 CYS CB 1 1 3 1547 1 1 24 CYS H H -3.322 -0.569 3.019 1.00 . A A . 24 CYS H 1 1 3 1548 1 1 24 CYS HA H -0.967 -2.208 2.352 1.00 . A A . 24 CYS HA 1 1 3 1549 1 1 24 CYS HB2 H -2.192 0.246 1.260 1.00 . A A . 24 CYS HB2 1 1 3 1550 1 1 24 CYS HB3 H -0.466 0.388 1.484 1.00 . A A . 24 CYS HB3 1 1 3 1551 1 1 24 CYS N N -2.709 -1.362 3.118 1.00 . A A . 24 CYS N 1 1 3 1552 1 1 24 CYS O O -0.188 0.514 3.820 1.00 . A A . 24 CYS O 1 1 3 1553 1 1 24 CYS SG S -0.921 -1.219 -0.162 1.00 . A A . 24 CYS SG 1 1 3 1554 1 1 25 ALA C C 1.992 -2.223 5.697 1.00 . A A . 25 ALA C 1 1 3 1555 1 1 25 ALA CA C 0.826 -1.255 5.760 1.00 . A A . 25 ALA CA 1 1 3 1556 1 1 25 ALA CB C 0.125 -1.224 7.113 1.00 . A A . 25 ALA CB 1 1 3 1557 1 1 25 ALA H H -0.556 -2.466 4.660 1.00 . A A . 25 ALA H 1 1 3 1558 1 1 25 ALA HA H 1.245 -0.270 5.587 1.00 . A A . 25 ALA HA 1 1 3 1559 1 1 25 ALA HB1 H 0.865 -1.005 7.878 1.00 . A A . 25 ALA HB1 1 1 3 1560 1 1 25 ALA HB2 H -0.341 -2.189 7.321 1.00 . A A . 25 ALA HB2 1 1 3 1561 1 1 25 ALA HB3 H -0.632 -0.440 7.098 1.00 . A A . 25 ALA HB3 1 1 3 1562 1 1 25 ALA N N -0.123 -1.548 4.702 1.00 . A A . 25 ALA N 1 1 3 1563 1 1 25 ALA O O 3.133 -1.802 5.531 1.00 . A A . 25 ALA O 1 1 3 1564 1 1 26 ASN C C 3.305 -4.587 4.137 1.00 . A A . 26 ASN C 1 1 3 1565 1 1 26 ASN CA C 2.792 -4.516 5.579 1.00 . A A . 26 ASN CA 1 1 3 1566 1 1 26 ASN CB C 2.319 -5.898 6.032 1.00 . A A . 26 ASN CB 1 1 3 1567 1 1 26 ASN CG C 1.109 -6.369 5.239 1.00 . A A . 26 ASN CG 1 1 3 1568 1 1 26 ASN H H 0.790 -3.849 5.934 1.00 . A A . 26 ASN H 1 1 3 1569 1 1 26 ASN HA H 3.630 -4.203 6.213 1.00 . A A . 26 ASN HA 1 1 3 1570 1 1 26 ASN HB2 H 3.136 -6.612 5.921 1.00 . A A . 26 ASN HB2 1 1 3 1571 1 1 26 ASN HB3 H 2.055 -5.850 7.089 1.00 . A A . 26 ASN HB3 1 1 3 1572 1 1 26 ASN HD21 H 2.216 -7.292 3.786 1.00 . A A . 26 ASN HD21 1 1 3 1573 1 1 26 ASN HD22 H 0.462 -7.322 3.617 1.00 . A A . 26 ASN HD22 1 1 3 1574 1 1 26 ASN N N 1.731 -3.526 5.748 1.00 . A A . 26 ASN N 1 1 3 1575 1 1 26 ASN ND2 N 1.294 -7.064 4.129 1.00 . A A . 26 ASN ND2 1 1 3 1576 1 1 26 ASN O O 4.362 -5.164 3.916 1.00 . A A . 26 ASN O 1 1 3 1577 1 1 26 ASN OD1 O -0.014 -6.057 5.611 1.00 . A A . 26 ASN OD1 1 1 3 1578 1 1 27 CYS C C 4.281 -2.574 1.939 1.00 . A A . 27 CYS C 1 1 3 1579 1 1 27 CYS CA C 3.214 -3.673 1.857 1.00 . A A . 27 CYS CA 1 1 3 1580 1 1 27 CYS CB C 2.145 -3.420 0.785 1.00 . A A . 27 CYS CB 1 1 3 1581 1 1 27 CYS H H 1.742 -3.539 3.391 1.00 . A A . 27 CYS H 1 1 3 1582 1 1 27 CYS HA H 3.714 -4.557 1.468 1.00 . A A . 27 CYS HA 1 1 3 1583 1 1 27 CYS HB2 H 1.522 -2.540 0.966 1.00 . A A . 27 CYS HB2 1 1 3 1584 1 1 27 CYS HB3 H 2.663 -3.206 -0.150 1.00 . A A . 27 CYS HB3 1 1 3 1585 1 1 27 CYS N N 2.624 -3.966 3.164 1.00 . A A . 27 CYS N 1 1 3 1586 1 1 27 CYS O O 4.710 -2.135 0.883 1.00 . A A . 27 CYS O 1 1 3 1587 1 1 27 CYS SG S 1.190 -4.948 0.543 1.00 . A A . 27 CYS SG 1 1 3 1588 1 1 28 LEU C C 6.950 -1.414 3.788 1.00 . A A . 28 LEU C 1 1 3 1589 1 1 28 LEU CA C 5.609 -0.951 3.249 1.00 . A A . 28 LEU CA 1 1 3 1590 1 1 28 LEU CB C 5.057 0.193 4.126 1.00 . A A . 28 LEU CB 1 1 3 1591 1 1 28 LEU CD1 C 4.155 2.382 3.299 1.00 . A A . 28 LEU CD1 1 1 3 1592 1 1 28 LEU CD2 C 3.058 0.353 2.433 1.00 . A A . 28 LEU CD2 1 1 3 1593 1 1 28 LEU CG C 3.799 0.937 3.630 1.00 . A A . 28 LEU CG 1 1 3 1594 1 1 28 LEU H H 4.257 -2.399 3.980 1.00 . A A . 28 LEU H 1 1 3 1595 1 1 28 LEU HA H 5.800 -0.541 2.261 1.00 . A A . 28 LEU HA 1 1 3 1596 1 1 28 LEU HB2 H 4.874 -0.151 5.144 1.00 . A A . 28 LEU HB2 1 1 3 1597 1 1 28 LEU HB3 H 5.867 0.916 4.233 1.00 . A A . 28 LEU HB3 1 1 3 1598 1 1 28 LEU HD11 H 4.581 2.852 4.186 1.00 . A A . 28 LEU HD11 1 1 3 1599 1 1 28 LEU HD12 H 4.883 2.397 2.488 1.00 . A A . 28 LEU HD12 1 1 3 1600 1 1 28 LEU HD13 H 3.262 2.930 3.011 1.00 . A A . 28 LEU HD13 1 1 3 1601 1 1 28 LEU HD21 H 3.722 0.329 1.564 1.00 . A A . 28 LEU HD21 1 1 3 1602 1 1 28 LEU HD22 H 2.676 -0.633 2.671 1.00 . A A . 28 LEU HD22 1 1 3 1603 1 1 28 LEU HD23 H 2.176 0.952 2.241 1.00 . A A . 28 LEU HD23 1 1 3 1604 1 1 28 LEU HG H 3.084 0.947 4.440 1.00 . A A . 28 LEU HG 1 1 3 1605 1 1 28 LEU N N 4.689 -2.082 3.123 1.00 . A A . 28 LEU N 1 1 3 1606 1 1 28 LEU O O 7.945 -1.322 3.075 1.00 . A A . 28 LEU O 1 1 3 1607 1 1 29 ALA C C 8.956 -3.292 5.098 1.00 . A A . 29 ALA C 1 1 3 1608 1 1 29 ALA CA C 8.249 -2.096 5.744 1.00 . A A . 29 ALA CA 1 1 3 1609 1 1 29 ALA CB C 7.953 -2.300 7.232 1.00 . A A . 29 ALA CB 1 1 3 1610 1 1 29 ALA H H 6.140 -1.877 5.582 1.00 . A A . 29 ALA H 1 1 3 1611 1 1 29 ALA HA H 8.903 -1.227 5.640 1.00 . A A . 29 ALA HA 1 1 3 1612 1 1 29 ALA HB1 H 8.877 -2.564 7.741 1.00 . A A . 29 ALA HB1 1 1 3 1613 1 1 29 ALA HB2 H 7.572 -1.373 7.661 1.00 . A A . 29 ALA HB2 1 1 3 1614 1 1 29 ALA HB3 H 7.210 -3.088 7.371 1.00 . A A . 29 ALA HB3 1 1 3 1615 1 1 29 ALA N N 6.996 -1.831 5.053 1.00 . A A . 29 ALA N 1 1 3 1616 1 1 29 ALA O O 9.923 -3.129 4.353 1.00 . A A . 29 ALA O 1 1 3 1617 1 1 30 GLY C C 8.170 -5.790 3.319 1.00 . A A . 30 GLY C 1 1 3 1618 1 1 30 GLY CA C 8.892 -5.693 4.648 1.00 . A A . 30 GLY CA 1 1 3 1619 1 1 30 GLY H H 7.634 -4.598 5.936 1.00 . A A . 30 GLY H 1 1 3 1620 1 1 30 GLY HA2 H 8.662 -6.568 5.253 1.00 . A A . 30 GLY HA2 1 1 3 1621 1 1 30 GLY HA3 H 9.968 -5.649 4.477 1.00 . A A . 30 GLY HA3 1 1 3 1622 1 1 30 GLY N N 8.437 -4.497 5.328 1.00 . A A . 30 GLY N 1 1 3 1623 1 1 30 GLY O O 7.262 -6.618 3.187 1.00 . A A . 30 GLY O 1 1 3 1624 1 1 31 TYR C C 8.925 -5.363 -0.121 1.00 . A A . 31 TYR C 1 1 3 1625 1 1 31 TYR CA C 7.957 -5.001 1.015 1.00 . A A . 31 TYR CA 1 1 3 1626 1 1 31 TYR CB C 7.326 -3.612 0.802 1.00 . A A . 31 TYR CB 1 1 3 1627 1 1 31 TYR CD1 C 9.560 -2.457 0.272 1.00 . A A . 31 TYR CD1 1 1 3 1628 1 1 31 TYR CD2 C 7.506 -1.567 -0.653 1.00 . A A . 31 TYR CD2 1 1 3 1629 1 1 31 TYR CE1 C 10.289 -1.487 -0.445 1.00 . A A . 31 TYR CE1 1 1 3 1630 1 1 31 TYR CE2 C 8.218 -0.625 -1.415 1.00 . A A . 31 TYR CE2 1 1 3 1631 1 1 31 TYR CG C 8.158 -2.494 0.176 1.00 . A A . 31 TYR CG 1 1 3 1632 1 1 31 TYR CZ C 9.625 -0.578 -1.304 1.00 . A A . 31 TYR CZ 1 1 3 1633 1 1 31 TYR H H 9.260 -4.250 2.556 1.00 . A A . 31 TYR H 1 1 3 1634 1 1 31 TYR HA H 7.156 -5.715 0.985 1.00 . A A . 31 TYR HA 1 1 3 1635 1 1 31 TYR HB2 H 6.481 -3.763 0.143 1.00 . A A . 31 TYR HB2 1 1 3 1636 1 1 31 TYR HB3 H 6.916 -3.264 1.746 1.00 . A A . 31 TYR HB3 1 1 3 1637 1 1 31 TYR HD1 H 10.062 -3.239 0.832 1.00 . A A . 31 TYR HD1 1 1 3 1638 1 1 31 TYR HD2 H 6.437 -1.611 -0.692 1.00 . A A . 31 TYR HD2 1 1 3 1639 1 1 31 TYR HE1 H 11.365 -1.473 -0.364 1.00 . A A . 31 TYR HE1 1 1 3 1640 1 1 31 TYR HE2 H 7.705 0.087 -2.061 1.00 . A A . 31 TYR HE2 1 1 3 1641 1 1 31 TYR HH H 11.235 0.450 -1.829 1.00 . A A . 31 TYR HH 1 1 3 1642 1 1 31 TYR N N 8.553 -4.946 2.348 1.00 . A A . 31 TYR N 1 1 3 1643 1 1 31 TYR O O 8.746 -4.863 -1.232 1.00 . A A . 31 TYR O 1 1 3 1644 1 1 31 TYR OH O 10.306 0.310 -2.078 1.00 . A A . 31 TYR OH 1 1 3 1645 1 1 32 PRO C C 10.047 -7.329 -2.319 1.00 . A A . 32 PRO C 1 1 3 1646 1 1 32 PRO CA C 10.706 -6.714 -1.078 1.00 . A A . 32 PRO CA 1 1 3 1647 1 1 32 PRO CB C 11.746 -7.638 -0.450 1.00 . A A . 32 PRO CB 1 1 3 1648 1 1 32 PRO CD C 9.986 -7.236 1.139 1.00 . A A . 32 PRO CD 1 1 3 1649 1 1 32 PRO CG C 11.000 -8.284 0.713 1.00 . A A . 32 PRO CG 1 1 3 1650 1 1 32 PRO HA H 11.187 -5.772 -1.347 1.00 . A A . 32 PRO HA 1 1 3 1651 1 1 32 PRO HB2 H 12.121 -8.381 -1.154 1.00 . A A . 32 PRO HB2 1 1 3 1652 1 1 32 PRO HB3 H 12.569 -7.037 -0.062 1.00 . A A . 32 PRO HB3 1 1 3 1653 1 1 32 PRO HD2 H 9.063 -7.697 1.491 1.00 . A A . 32 PRO HD2 1 1 3 1654 1 1 32 PRO HD3 H 10.425 -6.613 1.915 1.00 . A A . 32 PRO HD3 1 1 3 1655 1 1 32 PRO HG2 H 10.469 -9.170 0.376 1.00 . A A . 32 PRO HG2 1 1 3 1656 1 1 32 PRO HG3 H 11.682 -8.506 1.528 1.00 . A A . 32 PRO HG3 1 1 3 1657 1 1 32 PRO N N 9.736 -6.425 -0.028 1.00 . A A . 32 PRO N 1 1 3 1658 1 1 32 PRO O O 10.655 -7.372 -3.388 1.00 . A A . 32 PRO O 1 1 3 1659 1 1 33 ALA C C 6.735 -7.387 -3.516 1.00 . A A . 33 ALA C 1 1 3 1660 1 1 33 ALA CA C 7.935 -8.302 -3.233 1.00 . A A . 33 ALA CA 1 1 3 1661 1 1 33 ALA CB C 7.464 -9.692 -2.798 1.00 . A A . 33 ALA CB 1 1 3 1662 1 1 33 ALA H H 8.372 -7.672 -1.276 1.00 . A A . 33 ALA H 1 1 3 1663 1 1 33 ALA HA H 8.512 -8.398 -4.155 1.00 . A A . 33 ALA HA 1 1 3 1664 1 1 33 ALA HB1 H 6.885 -10.143 -3.603 1.00 . A A . 33 ALA HB1 1 1 3 1665 1 1 33 ALA HB2 H 8.325 -10.327 -2.576 1.00 . A A . 33 ALA HB2 1 1 3 1666 1 1 33 ALA HB3 H 6.825 -9.593 -1.918 1.00 . A A . 33 ALA HB3 1 1 3 1667 1 1 33 ALA N N 8.788 -7.758 -2.190 1.00 . A A . 33 ALA N 1 1 3 1668 1 1 33 ALA O O 5.876 -7.748 -4.318 1.00 . A A . 33 ALA O 1 1 3 1669 1 1 34 GLY C C 5.037 -4.975 -4.276 1.00 . A A . 34 GLY C 1 1 3 1670 1 1 34 GLY CA C 5.429 -5.400 -2.863 1.00 . A A . 34 GLY CA 1 1 3 1671 1 1 34 GLY H H 7.389 -5.937 -2.253 1.00 . A A . 34 GLY H 1 1 3 1672 1 1 34 GLY HA2 H 5.608 -4.516 -2.258 1.00 . A A . 34 GLY HA2 1 1 3 1673 1 1 34 GLY HA3 H 4.603 -5.948 -2.414 1.00 . A A . 34 GLY HA3 1 1 3 1674 1 1 34 GLY N N 6.623 -6.239 -2.841 1.00 . A A . 34 GLY N 1 1 3 1675 1 1 34 GLY O O 3.862 -5.050 -4.629 1.00 . A A . 34 GLY O 1 1 3 1676 1 1 35 CYS C C 5.267 -5.414 -7.351 1.00 . A A . 35 CYS C 1 1 3 1677 1 1 35 CYS CA C 5.800 -4.253 -6.509 1.00 . A A . 35 CYS CA 1 1 3 1678 1 1 35 CYS CB C 7.128 -3.835 -7.126 1.00 . A A . 35 CYS CB 1 1 3 1679 1 1 35 CYS H H 6.935 -4.444 -4.711 1.00 . A A . 35 CYS H 1 1 3 1680 1 1 35 CYS HA H 5.097 -3.422 -6.573 1.00 . A A . 35 CYS HA 1 1 3 1681 1 1 35 CYS HB2 H 7.762 -4.723 -7.157 1.00 . A A . 35 CYS HB2 1 1 3 1682 1 1 35 CYS HB3 H 6.948 -3.538 -8.161 1.00 . A A . 35 CYS HB3 1 1 3 1683 1 1 35 CYS N N 6.011 -4.593 -5.103 1.00 . A A . 35 CYS N 1 1 3 1684 1 1 35 CYS O O 4.785 -5.187 -8.457 1.00 . A A . 35 CYS O 1 1 3 1685 1 1 35 CYS SG S 7.948 -2.466 -6.270 1.00 . A A . 35 CYS SG 1 1 3 1686 1 1 36 SER C C 3.460 -8.194 -6.955 1.00 . A A . 36 SER C 1 1 3 1687 1 1 36 SER CA C 4.840 -7.833 -7.527 1.00 . A A . 36 SER CA 1 1 3 1688 1 1 36 SER CB C 5.824 -8.986 -7.330 1.00 . A A . 36 SER CB 1 1 3 1689 1 1 36 SER H H 5.772 -6.798 -5.950 1.00 . A A . 36 SER H 1 1 3 1690 1 1 36 SER HA H 4.775 -7.609 -8.589 1.00 . A A . 36 SER HA 1 1 3 1691 1 1 36 SER HB2 H 6.837 -8.619 -7.496 1.00 . A A . 36 SER HB2 1 1 3 1692 1 1 36 SER HB3 H 5.748 -9.362 -6.309 1.00 . A A . 36 SER HB3 1 1 3 1693 1 1 36 SER HG H 6.231 -10.729 -8.096 1.00 . A A . 36 SER HG 1 1 3 1694 1 1 36 SER N N 5.380 -6.654 -6.870 1.00 . A A . 36 SER N 1 1 3 1695 1 1 36 SER O O 2.679 -8.905 -7.588 1.00 . A A . 36 SER O 1 1 3 1696 1 1 36 SER OG O 5.561 -10.035 -8.236 1.00 . A A . 36 SER OG 1 1 3 1697 1 1 37 ASN C C 0.885 -6.968 -5.742 1.00 . A A . 37 ASN C 1 1 3 1698 1 1 37 ASN CA C 1.874 -7.921 -5.079 1.00 . A A . 37 ASN CA 1 1 3 1699 1 1 37 ASN CB C 2.007 -7.637 -3.559 1.00 . A A . 37 ASN CB 1 1 3 1700 1 1 37 ASN CG C 1.683 -8.807 -2.656 1.00 . A A . 37 ASN CG 1 1 3 1701 1 1 37 ASN H H 3.817 -7.086 -5.318 1.00 . A A . 37 ASN H 1 1 3 1702 1 1 37 ASN HA H 1.551 -8.951 -5.237 1.00 . A A . 37 ASN HA 1 1 3 1703 1 1 37 ASN HB2 H 3.002 -7.293 -3.321 1.00 . A A . 37 ASN HB2 1 1 3 1704 1 1 37 ASN HB3 H 1.339 -6.835 -3.256 1.00 . A A . 37 ASN HB3 1 1 3 1705 1 1 37 ASN HD21 H -0.137 -8.933 -3.466 1.00 . A A . 37 ASN HD21 1 1 3 1706 1 1 37 ASN HD22 H 0.101 -9.937 -2.052 1.00 . A A . 37 ASN HD22 1 1 3 1707 1 1 37 ASN N N 3.143 -7.703 -5.755 1.00 . A A . 37 ASN N 1 1 3 1708 1 1 37 ASN ND2 N 0.480 -9.326 -2.766 1.00 . A A . 37 ASN ND2 1 1 3 1709 1 1 37 ASN O O 0.783 -5.814 -5.335 1.00 . A A . 37 ASN O 1 1 3 1710 1 1 37 ASN OD1 O 2.478 -9.208 -1.812 1.00 . A A . 37 ASN OD1 1 1 3 1711 1 1 38 SER C C -1.875 -5.927 -6.696 1.00 . A A . 38 SER C 1 1 3 1712 1 1 38 SER CA C -0.758 -6.571 -7.542 1.00 . A A . 38 SER CA 1 1 3 1713 1 1 38 SER CB C -1.346 -7.407 -8.657 1.00 . A A . 38 SER CB 1 1 3 1714 1 1 38 SER H H 0.381 -8.310 -7.170 1.00 . A A . 38 SER H 1 1 3 1715 1 1 38 SER HA H -0.224 -5.783 -8.063 1.00 . A A . 38 SER HA 1 1 3 1716 1 1 38 SER HB2 H -1.897 -8.210 -8.199 1.00 . A A . 38 SER HB2 1 1 3 1717 1 1 38 SER HB3 H -2.019 -6.781 -9.238 1.00 . A A . 38 SER HB3 1 1 3 1718 1 1 38 SER HG H -0.464 -7.541 -10.385 1.00 . A A . 38 SER HG 1 1 3 1719 1 1 38 SER N N 0.187 -7.392 -6.791 1.00 . A A . 38 SER N 1 1 3 1720 1 1 38 SER O O -2.453 -4.948 -7.152 1.00 . A A . 38 SER O 1 1 3 1721 1 1 38 SER OG O -0.322 -7.922 -9.490 1.00 . A A . 38 SER OG 1 1 3 1722 1 1 39 ASP C C -2.406 -4.370 -4.080 1.00 . A A . 39 ASP C 1 1 3 1723 1 1 39 ASP CA C -3.053 -5.691 -4.524 1.00 . A A . 39 ASP CA 1 1 3 1724 1 1 39 ASP CB C -3.325 -6.600 -3.307 1.00 . A A . 39 ASP CB 1 1 3 1725 1 1 39 ASP CG C -4.278 -6.043 -2.233 1.00 . A A . 39 ASP CG 1 1 3 1726 1 1 39 ASP H H -1.713 -7.248 -5.170 1.00 . A A . 39 ASP H 1 1 3 1727 1 1 39 ASP HA H -4.005 -5.468 -5.002 1.00 . A A . 39 ASP HA 1 1 3 1728 1 1 39 ASP HB2 H -3.756 -7.532 -3.671 1.00 . A A . 39 ASP HB2 1 1 3 1729 1 1 39 ASP HB3 H -2.371 -6.846 -2.834 1.00 . A A . 39 ASP HB3 1 1 3 1730 1 1 39 ASP N N -2.176 -6.400 -5.480 1.00 . A A . 39 ASP N 1 1 3 1731 1 1 39 ASP O O -3.051 -3.326 -4.022 1.00 . A A . 39 ASP O 1 1 3 1732 1 1 39 ASP OD1 O -5.078 -5.117 -2.489 1.00 . A A . 39 ASP OD1 1 1 3 1733 1 1 39 ASP OD2 O -4.303 -6.644 -1.129 1.00 . A A . 39 ASP OD2 1 1 3 1734 1 1 40 CYS C C 0.466 -2.504 -4.304 1.00 . A A . 40 CYS C 1 1 3 1735 1 1 40 CYS CA C -0.303 -3.309 -3.264 1.00 . A A . 40 CYS CA 1 1 3 1736 1 1 40 CYS CB C 0.654 -3.927 -2.238 1.00 . A A . 40 CYS CB 1 1 3 1737 1 1 40 CYS H H -0.568 -5.184 -4.189 1.00 . A A . 40 CYS H 1 1 3 1738 1 1 40 CYS HA H -0.968 -2.621 -2.749 1.00 . A A . 40 CYS HA 1 1 3 1739 1 1 40 CYS HB2 H 1.181 -4.772 -2.679 1.00 . A A . 40 CYS HB2 1 1 3 1740 1 1 40 CYS HB3 H 1.423 -3.213 -1.928 1.00 . A A . 40 CYS HB3 1 1 3 1741 1 1 40 CYS N N -1.091 -4.386 -3.855 1.00 . A A . 40 CYS N 1 1 3 1742 1 1 40 CYS O O 0.876 -1.384 -4.026 1.00 . A A . 40 CYS O 1 1 3 1743 1 1 40 CYS SG S -0.256 -4.459 -0.773 1.00 . A A . 40 CYS SG 1 1 3 1744 1 1 41 THR C C 1.175 -1.044 -6.827 1.00 . A A . 41 THR C 1 1 3 1745 1 1 41 THR CA C 1.477 -2.518 -6.557 1.00 . A A . 41 THR CA 1 1 3 1746 1 1 41 THR CB C 1.237 -3.417 -7.775 1.00 . A A . 41 THR CB 1 1 3 1747 1 1 41 THR CG2 C 1.643 -2.886 -9.141 1.00 . A A . 41 THR CG2 1 1 3 1748 1 1 41 THR H H 0.276 -3.977 -5.644 1.00 . A A . 41 THR H 1 1 3 1749 1 1 41 THR HA H 2.514 -2.596 -6.225 1.00 . A A . 41 THR HA 1 1 3 1750 1 1 41 THR HB H 0.165 -3.608 -7.828 1.00 . A A . 41 THR HB 1 1 3 1751 1 1 41 THR HG1 H 1.815 -4.904 -6.657 1.00 . A A . 41 THR HG1 1 1 3 1752 1 1 41 THR HG21 H 1.249 -1.881 -9.313 1.00 . A A . 41 THR HG21 1 1 3 1753 1 1 41 THR HG22 H 2.727 -2.850 -9.222 1.00 . A A . 41 THR HG22 1 1 3 1754 1 1 41 THR HG23 H 1.222 -3.578 -9.870 1.00 . A A . 41 THR HG23 1 1 3 1755 1 1 41 THR N N 0.642 -3.047 -5.500 1.00 . A A . 41 THR N 1 1 3 1756 1 1 41 THR O O 2.091 -0.230 -6.764 1.00 . A A . 41 THR O 1 1 3 1757 1 1 41 THR OG1 O 1.893 -4.657 -7.591 1.00 . A A . 41 THR OG1 1 1 3 1758 1 1 42 ALA C C -0.303 1.667 -6.360 1.00 . A A . 42 ALA C 1 1 3 1759 1 1 42 ALA CA C -0.403 0.685 -7.524 1.00 . A A . 42 ALA CA 1 1 3 1760 1 1 42 ALA CB C -1.786 0.747 -8.167 1.00 . A A . 42 ALA CB 1 1 3 1761 1 1 42 ALA H H -0.831 -1.354 -7.012 1.00 . A A . 42 ALA H 1 1 3 1762 1 1 42 ALA HA H 0.327 0.998 -8.265 1.00 . A A . 42 ALA HA 1 1 3 1763 1 1 42 ALA HB1 H -1.795 0.180 -9.098 1.00 . A A . 42 ALA HB1 1 1 3 1764 1 1 42 ALA HB2 H -2.052 1.785 -8.373 1.00 . A A . 42 ALA HB2 1 1 3 1765 1 1 42 ALA HB3 H -2.521 0.342 -7.485 1.00 . A A . 42 ALA HB3 1 1 3 1766 1 1 42 ALA N N -0.079 -0.680 -7.112 1.00 . A A . 42 ALA N 1 1 3 1767 1 1 42 ALA O O 0.036 2.830 -6.575 1.00 . A A . 42 ALA O 1 1 3 1768 1 1 43 PHE C C 1.270 2.266 -3.954 1.00 . A A . 43 PHE C 1 1 3 1769 1 1 43 PHE CA C -0.232 1.998 -3.949 1.00 . A A . 43 PHE CA 1 1 3 1770 1 1 43 PHE CB C -0.709 1.273 -2.681 1.00 . A A . 43 PHE CB 1 1 3 1771 1 1 43 PHE CD1 C 1.048 1.766 -0.951 1.00 . A A . 43 PHE CD1 1 1 3 1772 1 1 43 PHE CD2 C -1.194 2.504 -0.491 1.00 . A A . 43 PHE CD2 1 1 3 1773 1 1 43 PHE CE1 C 1.500 2.336 0.239 1.00 . A A . 43 PHE CE1 1 1 3 1774 1 1 43 PHE CE2 C -0.768 3.026 0.744 1.00 . A A . 43 PHE CE2 1 1 3 1775 1 1 43 PHE CG C -0.282 1.891 -1.361 1.00 . A A . 43 PHE CG 1 1 3 1776 1 1 43 PHE CZ C 0.588 2.954 1.099 1.00 . A A . 43 PHE CZ 1 1 3 1777 1 1 43 PHE H H -0.766 0.232 -5.019 1.00 . A A . 43 PHE H 1 1 3 1778 1 1 43 PHE HA H -0.745 2.957 -4.023 1.00 . A A . 43 PHE HA 1 1 3 1779 1 1 43 PHE HB2 H -1.796 1.202 -2.717 1.00 . A A . 43 PHE HB2 1 1 3 1780 1 1 43 PHE HB3 H -0.309 0.262 -2.692 1.00 . A A . 43 PHE HB3 1 1 3 1781 1 1 43 PHE HD1 H 1.720 1.207 -1.557 1.00 . A A . 43 PHE HD1 1 1 3 1782 1 1 43 PHE HD2 H -2.231 2.530 -0.756 1.00 . A A . 43 PHE HD2 1 1 3 1783 1 1 43 PHE HE1 H 2.543 2.274 0.509 1.00 . A A . 43 PHE HE1 1 1 3 1784 1 1 43 PHE HE2 H -1.481 3.482 1.416 1.00 . A A . 43 PHE HE2 1 1 3 1785 1 1 43 PHE HZ H 0.957 3.341 2.032 1.00 . A A . 43 PHE HZ 1 1 3 1786 1 1 43 PHE N N -0.546 1.212 -5.129 1.00 . A A . 43 PHE N 1 1 3 1787 1 1 43 PHE O O 1.681 3.419 -3.927 1.00 . A A . 43 PHE O 1 1 3 1788 1 1 44 LEU C C 4.181 2.167 -5.022 1.00 . A A . 44 LEU C 1 1 3 1789 1 1 44 LEU CA C 3.559 1.402 -3.853 1.00 . A A . 44 LEU CA 1 1 3 1790 1 1 44 LEU CB C 4.226 0.035 -3.693 1.00 . A A . 44 LEU CB 1 1 3 1791 1 1 44 LEU CD1 C 4.350 -2.146 -2.527 1.00 . A A . 44 LEU CD1 1 1 3 1792 1 1 44 LEU CD2 C 3.983 -0.056 -1.131 1.00 . A A . 44 LEU CD2 1 1 3 1793 1 1 44 LEU CG C 3.729 -0.754 -2.468 1.00 . A A . 44 LEU CG 1 1 3 1794 1 1 44 LEU H H 1.738 0.287 -3.853 1.00 . A A . 44 LEU H 1 1 3 1795 1 1 44 LEU HA H 3.733 1.996 -2.961 1.00 . A A . 44 LEU HA 1 1 3 1796 1 1 44 LEU HB2 H 4.033 -0.551 -4.595 1.00 . A A . 44 LEU HB2 1 1 3 1797 1 1 44 LEU HB3 H 5.301 0.185 -3.615 1.00 . A A . 44 LEU HB3 1 1 3 1798 1 1 44 LEU HD11 H 5.427 -2.082 -2.683 1.00 . A A . 44 LEU HD11 1 1 3 1799 1 1 44 LEU HD12 H 4.148 -2.695 -1.612 1.00 . A A . 44 LEU HD12 1 1 3 1800 1 1 44 LEU HD13 H 3.904 -2.681 -3.364 1.00 . A A . 44 LEU HD13 1 1 3 1801 1 1 44 LEU HD21 H 3.733 0.999 -1.137 1.00 . A A . 44 LEU HD21 1 1 3 1802 1 1 44 LEU HD22 H 3.341 -0.525 -0.386 1.00 . A A . 44 LEU HD22 1 1 3 1803 1 1 44 LEU HD23 H 5.019 -0.145 -0.841 1.00 . A A . 44 LEU HD23 1 1 3 1804 1 1 44 LEU HG H 2.656 -0.893 -2.516 1.00 . A A . 44 LEU HG 1 1 3 1805 1 1 44 LEU N N 2.114 1.230 -3.981 1.00 . A A . 44 LEU N 1 1 3 1806 1 1 44 LEU O O 5.085 2.974 -4.819 1.00 . A A . 44 LEU O 1 1 3 1807 1 1 45 SER C C 3.820 4.284 -7.171 1.00 . A A . 45 SER C 1 1 3 1808 1 1 45 SER CA C 3.975 2.768 -7.415 1.00 . A A . 45 SER CA 1 1 3 1809 1 1 45 SER CB C 3.011 2.239 -8.479 1.00 . A A . 45 SER CB 1 1 3 1810 1 1 45 SER H H 2.939 1.295 -6.360 1.00 . A A . 45 SER H 1 1 3 1811 1 1 45 SER HA H 5.006 2.582 -7.718 1.00 . A A . 45 SER HA 1 1 3 1812 1 1 45 SER HB2 H 2.013 2.188 -8.054 1.00 . A A . 45 SER HB2 1 1 3 1813 1 1 45 SER HB3 H 2.943 2.908 -9.308 1.00 . A A . 45 SER HB3 1 1 3 1814 1 1 45 SER HG H 3.419 0.317 -8.262 1.00 . A A . 45 SER HG 1 1 3 1815 1 1 45 SER N N 3.664 1.991 -6.230 1.00 . A A . 45 SER N 1 1 3 1816 1 1 45 SER O O 4.498 5.093 -7.806 1.00 . A A . 45 SER O 1 1 3 1817 1 1 45 SER OG O 3.380 0.967 -8.986 1.00 . A A . 45 SER OG 1 1 3 1818 1 1 46 GLN C C 3.606 6.295 -4.444 1.00 . A A . 46 GLN C 1 1 3 1819 1 1 46 GLN CA C 2.804 6.051 -5.739 1.00 . A A . 46 GLN CA 1 1 3 1820 1 1 46 GLN CB C 1.283 6.305 -5.654 1.00 . A A . 46 GLN CB 1 1 3 1821 1 1 46 GLN CD C -0.804 6.389 -7.155 1.00 . A A . 46 GLN CD 1 1 3 1822 1 1 46 GLN CG C 0.717 6.437 -7.083 1.00 . A A . 46 GLN CG 1 1 3 1823 1 1 46 GLN H H 2.452 3.963 -5.733 1.00 . A A . 46 GLN H 1 1 3 1824 1 1 46 GLN HA H 3.202 6.742 -6.482 1.00 . A A . 46 GLN HA 1 1 3 1825 1 1 46 GLN HB2 H 0.791 5.480 -5.143 1.00 . A A . 46 GLN HB2 1 1 3 1826 1 1 46 GLN HB3 H 1.064 7.214 -5.096 1.00 . A A . 46 GLN HB3 1 1 3 1827 1 1 46 GLN HE21 H -0.835 4.374 -6.901 1.00 . A A . 46 GLN HE21 1 1 3 1828 1 1 46 GLN HE22 H -2.393 5.155 -7.140 1.00 . A A . 46 GLN HE22 1 1 3 1829 1 1 46 GLN HG2 H 1.063 7.375 -7.515 1.00 . A A . 46 GLN HG2 1 1 3 1830 1 1 46 GLN HG3 H 1.100 5.634 -7.713 1.00 . A A . 46 GLN HG3 1 1 3 1831 1 1 46 GLN N N 2.998 4.679 -6.196 1.00 . A A . 46 GLN N 1 1 3 1832 1 1 46 GLN NE2 N -1.394 5.214 -7.041 1.00 . A A . 46 GLN NE2 1 1 3 1833 1 1 46 GLN O O 4.538 7.096 -4.451 1.00 . A A . 46 GLN O 1 1 3 1834 1 1 46 GLN OE1 O -1.466 7.390 -7.405 1.00 . A A . 46 GLN OE1 1 1 3 1835 1 1 47 CYS C C 5.426 5.428 -1.922 1.00 . A A . 47 CYS C 1 1 3 1836 1 1 47 CYS CA C 3.913 5.734 -2.016 1.00 . A A . 47 CYS CA 1 1 3 1837 1 1 47 CYS CB C 3.130 4.842 -1.035 1.00 . A A . 47 CYS CB 1 1 3 1838 1 1 47 CYS H H 2.586 4.884 -3.459 1.00 . A A . 47 CYS H 1 1 3 1839 1 1 47 CYS HA H 3.764 6.777 -1.736 1.00 . A A . 47 CYS HA 1 1 3 1840 1 1 47 CYS HB2 H 2.126 4.695 -1.433 1.00 . A A . 47 CYS HB2 1 1 3 1841 1 1 47 CYS HB3 H 3.622 3.863 -0.981 1.00 . A A . 47 CYS HB3 1 1 3 1842 1 1 47 CYS N N 3.332 5.562 -3.358 1.00 . A A . 47 CYS N 1 1 3 1843 1 1 47 CYS O O 6.047 5.700 -0.891 1.00 . A A . 47 CYS O 1 1 3 1844 1 1 47 CYS SG S 2.894 5.420 0.675 1.00 . A A . 47 CYS SG 1 1 3 1845 1 1 48 TYR C C 8.019 4.900 -4.467 1.00 . A A . 48 TYR C 1 1 3 1846 1 1 48 TYR CA C 7.447 4.524 -3.095 1.00 . A A . 48 TYR CA 1 1 3 1847 1 1 48 TYR CB C 7.689 3.041 -2.850 1.00 . A A . 48 TYR CB 1 1 3 1848 1 1 48 TYR CD1 C 8.963 2.844 -0.678 1.00 . A A . 48 TYR CD1 1 1 3 1849 1 1 48 TYR CD2 C 6.639 2.124 -0.768 1.00 . A A . 48 TYR CD2 1 1 3 1850 1 1 48 TYR CE1 C 9.065 2.368 0.637 1.00 . A A . 48 TYR CE1 1 1 3 1851 1 1 48 TYR CE2 C 6.745 1.596 0.526 1.00 . A A . 48 TYR CE2 1 1 3 1852 1 1 48 TYR CG C 7.760 2.689 -1.388 1.00 . A A . 48 TYR CG 1 1 3 1853 1 1 48 TYR CZ C 7.969 1.709 1.230 1.00 . A A . 48 TYR CZ 1 1 3 1854 1 1 48 TYR H H 5.429 4.553 -3.734 1.00 . A A . 48 TYR H 1 1 3 1855 1 1 48 TYR HA H 8.019 5.034 -2.329 1.00 . A A . 48 TYR HA 1 1 3 1856 1 1 48 TYR HB2 H 6.928 2.436 -3.334 1.00 . A A . 48 TYR HB2 1 1 3 1857 1 1 48 TYR HB3 H 8.629 2.757 -3.318 1.00 . A A . 48 TYR HB3 1 1 3 1858 1 1 48 TYR HD1 H 9.827 3.279 -1.161 1.00 . A A . 48 TYR HD1 1 1 3 1859 1 1 48 TYR HD2 H 5.721 2.035 -1.324 1.00 . A A . 48 TYR HD2 1 1 3 1860 1 1 48 TYR HE1 H 10.000 2.451 1.169 1.00 . A A . 48 TYR HE1 1 1 3 1861 1 1 48 TYR HE2 H 5.892 1.077 0.931 1.00 . A A . 48 TYR HE2 1 1 3 1862 1 1 48 TYR HH H 8.085 0.242 2.493 1.00 . A A . 48 TYR HH 1 1 3 1863 1 1 48 TYR N N 6.020 4.836 -2.963 1.00 . A A . 48 TYR N 1 1 3 1864 1 1 48 TYR O O 9.238 4.891 -4.639 1.00 . A A . 48 TYR O 1 1 3 1865 1 1 48 TYR OH O 8.100 1.221 2.488 1.00 . A A . 48 TYR OH 1 1 3 1866 1 1 49 GLY C C 7.785 4.016 -7.582 1.00 . A A . 49 GLY C 1 1 3 1867 1 1 49 GLY CA C 7.576 5.345 -6.848 1.00 . A A . 49 GLY CA 1 1 3 1868 1 1 49 GLY H H 6.184 5.015 -5.284 1.00 . A A . 49 GLY H 1 1 3 1869 1 1 49 GLY HA2 H 8.510 5.905 -6.875 1.00 . A A . 49 GLY HA2 1 1 3 1870 1 1 49 GLY HA3 H 6.826 5.928 -7.376 1.00 . A A . 49 GLY HA3 1 1 3 1871 1 1 49 GLY N N 7.166 5.154 -5.460 1.00 . A A . 49 GLY N 1 1 3 1872 1 1 49 GLY O O 8.002 4.013 -8.793 1.00 . A A . 49 GLY O 1 1 3 1873 1 1 50 GLY C C 9.521 1.293 -6.818 1.00 . A A . 50 GLY C 1 1 3 1874 1 1 50 GLY CA C 8.110 1.579 -7.326 1.00 . A A . 50 GLY CA 1 1 3 1875 1 1 50 GLY H H 7.469 2.981 -5.889 1.00 . A A . 50 GLY H 1 1 3 1876 1 1 50 GLY HA2 H 8.114 1.539 -8.414 1.00 . A A . 50 GLY HA2 1 1 3 1877 1 1 50 GLY HA3 H 7.420 0.824 -6.951 1.00 . A A . 50 GLY HA3 1 1 3 1878 1 1 50 GLY N N 7.684 2.889 -6.868 1.00 . A A . 50 GLY N 1 1 3 1879 1 1 50 GLY O O 10.418 2.123 -6.968 1.00 . A A . 50 GLY O 1 1 3 1880 1 1 51 CYS C C 11.878 -0.761 -6.983 1.00 . A A . 51 CYS C 1 1 3 1881 1 1 51 CYS CA C 10.966 -0.450 -5.791 1.00 . A A . 51 CYS CA 1 1 3 1882 1 1 51 CYS CB C 10.670 -1.749 -5.037 1.00 . A A . 51 CYS CB 1 1 3 1883 1 1 51 CYS H H 8.879 -0.412 -5.938 1.00 . A A . 51 CYS H 1 1 3 1884 1 1 51 CYS HA H 11.501 0.232 -5.128 1.00 . A A . 51 CYS HA 1 1 3 1885 1 1 51 CYS HB2 H 11.631 -2.126 -4.695 1.00 . A A . 51 CYS HB2 1 1 3 1886 1 1 51 CYS HB3 H 10.068 -1.520 -4.159 1.00 . A A . 51 CYS HB3 1 1 3 1887 1 1 51 CYS N N 9.691 0.149 -6.157 1.00 . A A . 51 CYS N 1 1 3 1888 1 1 51 CYS O O 13.001 -1.259 -6.739 1.00 . A A . 51 CYS O 1 1 3 1889 1 1 51 CYS OXT O 11.437 -0.670 -8.147 1.00 . A A . 51 CYS OXT 1 1 3 1890 1 1 51 CYS SG S 9.872 -3.081 -5.992 1.00 . A A . 51 CYS SG 1 1 4 1891 1 1 1 GLY C C -8.723 -6.263 -0.302 1.00 . A A . 1 GLY C 1 1 4 1892 1 1 1 GLY CA C -8.569 -7.196 -1.482 1.00 . A A . 1 GLY CA 1 1 4 1893 1 1 1 GLY H1 H -8.371 -8.844 -0.307 1.00 . A A . 1 GLY H1 1 1 4 1894 1 1 1 GLY H2 H -9.909 -8.561 -0.802 1.00 . A A . 1 GLY H2 1 1 4 1895 1 1 1 GLY H3 H -8.802 -9.191 -1.863 1.00 . A A . 1 GLY H3 1 1 4 1896 1 1 1 GLY HA2 H -9.201 -6.857 -2.301 1.00 . A A . 1 GLY HA2 1 1 4 1897 1 1 1 GLY HA3 H -7.531 -7.191 -1.801 1.00 . A A . 1 GLY HA3 1 1 4 1898 1 1 1 GLY N N -8.941 -8.557 -1.092 1.00 . A A . 1 GLY N 1 1 4 1899 1 1 1 GLY O O -9.839 -6.037 0.160 1.00 . A A . 1 GLY O 1 1 4 1900 1 1 2 GLU C C -6.953 -3.504 0.877 1.00 . A A . 2 GLU C 1 1 4 1901 1 1 2 GLU CA C -7.556 -4.820 1.334 1.00 . A A . 2 GLU CA 1 1 4 1902 1 1 2 GLU CB C -6.839 -5.437 2.545 1.00 . A A . 2 GLU CB 1 1 4 1903 1 1 2 GLU CD C -5.172 -7.328 2.782 1.00 . A A . 2 GLU CD 1 1 4 1904 1 1 2 GLU CG C -5.408 -5.910 2.271 1.00 . A A . 2 GLU CG 1 1 4 1905 1 1 2 GLU H H -6.717 -6.026 -0.183 1.00 . A A . 2 GLU H 1 1 4 1906 1 1 2 GLU HA H -8.560 -4.604 1.664 1.00 . A A . 2 GLU HA 1 1 4 1907 1 1 2 GLU HB2 H -6.809 -4.703 3.348 1.00 . A A . 2 GLU HB2 1 1 4 1908 1 1 2 GLU HB3 H -7.439 -6.281 2.876 1.00 . A A . 2 GLU HB3 1 1 4 1909 1 1 2 GLU HG2 H -5.262 -5.912 1.196 1.00 . A A . 2 GLU HG2 1 1 4 1910 1 1 2 GLU HG3 H -4.699 -5.211 2.715 1.00 . A A . 2 GLU HG3 1 1 4 1911 1 1 2 GLU N N -7.607 -5.746 0.210 1.00 . A A . 2 GLU N 1 1 4 1912 1 1 2 GLU O O -7.608 -2.469 0.965 1.00 . A A . 2 GLU O 1 1 4 1913 1 1 2 GLU OE1 O -5.677 -8.270 2.125 1.00 . A A . 2 GLU OE1 1 1 4 1914 1 1 2 GLU OE2 O -4.568 -7.521 3.859 1.00 . A A . 2 GLU OE2 1 1 4 1915 1 1 3 CYS C C -5.868 -1.746 -1.236 1.00 . A A . 3 CYS C 1 1 4 1916 1 1 3 CYS CA C -5.030 -2.378 -0.125 1.00 . A A . 3 CYS CA 1 1 4 1917 1 1 3 CYS CB C -3.601 -2.773 -0.521 1.00 . A A . 3 CYS CB 1 1 4 1918 1 1 3 CYS H H -5.278 -4.442 0.209 1.00 . A A . 3 CYS H 1 1 4 1919 1 1 3 CYS HA H -4.982 -1.674 0.704 1.00 . A A . 3 CYS HA 1 1 4 1920 1 1 3 CYS HB2 H -3.123 -3.258 0.331 1.00 . A A . 3 CYS HB2 1 1 4 1921 1 1 3 CYS HB3 H -3.643 -3.491 -1.340 1.00 . A A . 3 CYS HB3 1 1 4 1922 1 1 3 CYS N N -5.730 -3.551 0.343 1.00 . A A . 3 CYS N 1 1 4 1923 1 1 3 CYS O O -6.282 -0.591 -1.099 1.00 . A A . 3 CYS O 1 1 4 1924 1 1 3 CYS SG S -2.557 -1.394 -1.041 1.00 . A A . 3 CYS SG 1 1 4 1925 1 1 4 GLU C C -8.399 -1.446 -2.825 1.00 . A A . 4 GLU C 1 1 4 1926 1 1 4 GLU CA C -7.075 -2.017 -3.352 1.00 . A A . 4 GLU CA 1 1 4 1927 1 1 4 GLU CB C -7.319 -3.139 -4.374 1.00 . A A . 4 GLU CB 1 1 4 1928 1 1 4 GLU CD C -6.204 -4.514 -6.245 1.00 . A A . 4 GLU CD 1 1 4 1929 1 1 4 GLU CG C -6.037 -3.457 -5.152 1.00 . A A . 4 GLU CG 1 1 4 1930 1 1 4 GLU H H -5.842 -3.450 -2.353 1.00 . A A . 4 GLU H 1 1 4 1931 1 1 4 GLU HA H -6.556 -1.195 -3.854 1.00 . A A . 4 GLU HA 1 1 4 1932 1 1 4 GLU HB2 H -7.653 -4.036 -3.854 1.00 . A A . 4 GLU HB2 1 1 4 1933 1 1 4 GLU HB3 H -8.096 -2.826 -5.068 1.00 . A A . 4 GLU HB3 1 1 4 1934 1 1 4 GLU HG2 H -5.654 -2.546 -5.604 1.00 . A A . 4 GLU HG2 1 1 4 1935 1 1 4 GLU HG3 H -5.292 -3.799 -4.447 1.00 . A A . 4 GLU HG3 1 1 4 1936 1 1 4 GLU N N -6.224 -2.511 -2.270 1.00 . A A . 4 GLU N 1 1 4 1937 1 1 4 GLU O O -8.850 -0.420 -3.328 1.00 . A A . 4 GLU O 1 1 4 1938 1 1 4 GLU OE1 O -6.609 -5.671 -5.971 1.00 . A A . 4 GLU OE1 1 1 4 1939 1 1 4 GLU OE2 O -5.856 -4.244 -7.415 1.00 . A A . 4 GLU OE2 1 1 4 1940 1 1 5 GLN C C -10.197 -0.252 -0.532 1.00 . A A . 5 GLN C 1 1 4 1941 1 1 5 GLN CA C -10.301 -1.592 -1.274 1.00 . A A . 5 GLN CA 1 1 4 1942 1 1 5 GLN CB C -10.926 -2.687 -0.390 1.00 . A A . 5 GLN CB 1 1 4 1943 1 1 5 GLN CD C -13.221 -3.017 -1.485 1.00 . A A . 5 GLN CD 1 1 4 1944 1 1 5 GLN CG C -12.456 -2.584 -0.229 1.00 . A A . 5 GLN CG 1 1 4 1945 1 1 5 GLN H H -8.565 -2.839 -1.359 1.00 . A A . 5 GLN H 1 1 4 1946 1 1 5 GLN HA H -10.942 -1.417 -2.132 1.00 . A A . 5 GLN HA 1 1 4 1947 1 1 5 GLN HB2 H -10.702 -3.664 -0.816 1.00 . A A . 5 GLN HB2 1 1 4 1948 1 1 5 GLN HB3 H -10.462 -2.647 0.596 1.00 . A A . 5 GLN HB3 1 1 4 1949 1 1 5 GLN HE21 H -13.001 -1.204 -2.387 1.00 . A A . 5 GLN HE21 1 1 4 1950 1 1 5 GLN HE22 H -13.766 -2.435 -3.355 1.00 . A A . 5 GLN HE22 1 1 4 1951 1 1 5 GLN HG2 H -12.751 -3.243 0.588 1.00 . A A . 5 GLN HG2 1 1 4 1952 1 1 5 GLN HG3 H -12.742 -1.568 0.050 1.00 . A A . 5 GLN HG3 1 1 4 1953 1 1 5 GLN N N -9.010 -2.046 -1.794 1.00 . A A . 5 GLN N 1 1 4 1954 1 1 5 GLN NE2 N -13.377 -2.139 -2.462 1.00 . A A . 5 GLN NE2 1 1 4 1955 1 1 5 GLN O O -11.163 0.514 -0.522 1.00 . A A . 5 GLN O 1 1 4 1956 1 1 5 GLN OE1 O -13.709 -4.146 -1.579 1.00 . A A . 5 GLN OE1 1 1 4 1957 1 1 6 CYS C C -8.619 2.390 -0.545 1.00 . A A . 6 CYS C 1 1 4 1958 1 1 6 CYS CA C -8.762 1.388 0.592 1.00 . A A . 6 CYS CA 1 1 4 1959 1 1 6 CYS CB C -7.481 1.345 1.415 1.00 . A A . 6 CYS CB 1 1 4 1960 1 1 6 CYS H H -8.297 -0.631 0.035 1.00 . A A . 6 CYS H 1 1 4 1961 1 1 6 CYS HA H -9.586 1.696 1.236 1.00 . A A . 6 CYS HA 1 1 4 1962 1 1 6 CYS HB2 H -7.559 0.476 2.056 1.00 . A A . 6 CYS HB2 1 1 4 1963 1 1 6 CYS HB3 H -6.636 1.196 0.745 1.00 . A A . 6 CYS HB3 1 1 4 1964 1 1 6 CYS N N -9.040 0.060 0.056 1.00 . A A . 6 CYS N 1 1 4 1965 1 1 6 CYS O O -9.179 3.485 -0.492 1.00 . A A . 6 CYS O 1 1 4 1966 1 1 6 CYS SG S -7.190 2.813 2.445 1.00 . A A . 6 CYS SG 1 1 4 1967 1 1 7 PHE C C -9.156 3.124 -3.374 1.00 . A A . 7 PHE C 1 1 4 1968 1 1 7 PHE CA C -7.767 2.821 -2.797 1.00 . A A . 7 PHE CA 1 1 4 1969 1 1 7 PHE CB C -6.800 2.154 -3.797 1.00 . A A . 7 PHE CB 1 1 4 1970 1 1 7 PHE CD1 C -4.759 3.468 -2.995 1.00 . A A . 7 PHE CD1 1 1 4 1971 1 1 7 PHE CD2 C -5.060 3.122 -5.370 1.00 . A A . 7 PHE CD2 1 1 4 1972 1 1 7 PHE CE1 C -3.611 4.234 -3.247 1.00 . A A . 7 PHE CE1 1 1 4 1973 1 1 7 PHE CE2 C -3.912 3.892 -5.626 1.00 . A A . 7 PHE CE2 1 1 4 1974 1 1 7 PHE CG C -5.518 2.937 -4.055 1.00 . A A . 7 PHE CG 1 1 4 1975 1 1 7 PHE CZ C -3.199 4.477 -4.564 1.00 . A A . 7 PHE CZ 1 1 4 1976 1 1 7 PHE H H -7.499 1.076 -1.609 1.00 . A A . 7 PHE H 1 1 4 1977 1 1 7 PHE HA H -7.345 3.782 -2.508 1.00 . A A . 7 PHE HA 1 1 4 1978 1 1 7 PHE HB2 H -6.519 1.163 -3.443 1.00 . A A . 7 PHE HB2 1 1 4 1979 1 1 7 PHE HB3 H -7.322 2.011 -4.744 1.00 . A A . 7 PHE HB3 1 1 4 1980 1 1 7 PHE HD1 H -5.025 3.263 -1.971 1.00 . A A . 7 PHE HD1 1 1 4 1981 1 1 7 PHE HD2 H -5.592 2.663 -6.187 1.00 . A A . 7 PHE HD2 1 1 4 1982 1 1 7 PHE HE1 H -3.044 4.640 -2.426 1.00 . A A . 7 PHE HE1 1 1 4 1983 1 1 7 PHE HE2 H -3.594 4.029 -6.645 1.00 . A A . 7 PHE HE2 1 1 4 1984 1 1 7 PHE HZ H -2.323 5.091 -4.735 1.00 . A A . 7 PHE HZ 1 1 4 1985 1 1 7 PHE N N -7.892 2.009 -1.598 1.00 . A A . 7 PHE N 1 1 4 1986 1 1 7 PHE O O -9.388 4.257 -3.789 1.00 . A A . 7 PHE O 1 1 4 1987 1 1 8 SER C C -12.200 3.481 -3.027 1.00 . A A . 8 SER C 1 1 4 1988 1 1 8 SER CA C -11.469 2.391 -3.810 1.00 . A A . 8 SER CA 1 1 4 1989 1 1 8 SER CB C -12.291 1.102 -3.705 1.00 . A A . 8 SER CB 1 1 4 1990 1 1 8 SER H H -9.836 1.223 -3.096 1.00 . A A . 8 SER H 1 1 4 1991 1 1 8 SER HA H -11.427 2.702 -4.850 1.00 . A A . 8 SER HA 1 1 4 1992 1 1 8 SER HB2 H -12.548 0.921 -2.660 1.00 . A A . 8 SER HB2 1 1 4 1993 1 1 8 SER HB3 H -13.218 1.224 -4.266 1.00 . A A . 8 SER HB3 1 1 4 1994 1 1 8 SER HG H -11.269 0.165 -5.092 1.00 . A A . 8 SER HG 1 1 4 1995 1 1 8 SER N N -10.096 2.171 -3.356 1.00 . A A . 8 SER N 1 1 4 1996 1 1 8 SER O O -13.124 4.100 -3.566 1.00 . A A . 8 SER O 1 1 4 1997 1 1 8 SER OG O -11.594 -0.024 -4.191 1.00 . A A . 8 SER OG 1 1 4 1998 1 1 9 ASP C C -11.614 5.777 -0.437 1.00 . A A . 9 ASP C 1 1 4 1999 1 1 9 ASP CA C -12.530 4.627 -0.867 1.00 . A A . 9 ASP CA 1 1 4 2000 1 1 9 ASP CB C -13.157 3.838 0.295 1.00 . A A . 9 ASP CB 1 1 4 2001 1 1 9 ASP CG C -14.386 4.569 0.835 1.00 . A A . 9 ASP CG 1 1 4 2002 1 1 9 ASP H H -11.027 3.227 -1.386 1.00 . A A . 9 ASP H 1 1 4 2003 1 1 9 ASP HA H -13.362 5.084 -1.405 1.00 . A A . 9 ASP HA 1 1 4 2004 1 1 9 ASP HB2 H -13.477 2.861 -0.068 1.00 . A A . 9 ASP HB2 1 1 4 2005 1 1 9 ASP HB3 H -12.432 3.662 1.085 1.00 . A A . 9 ASP HB3 1 1 4 2006 1 1 9 ASP N N -11.825 3.723 -1.771 1.00 . A A . 9 ASP N 1 1 4 2007 1 1 9 ASP O O -11.639 6.212 0.715 1.00 . A A . 9 ASP O 1 1 4 2008 1 1 9 ASP OD1 O -14.294 5.425 1.742 1.00 . A A . 9 ASP OD1 1 1 4 2009 1 1 9 ASP OD2 O -15.491 4.322 0.296 1.00 . A A . 9 ASP OD2 1 1 4 2010 1 1 10 GLY C C -8.588 7.415 -1.025 1.00 . A A . 10 GLY C 1 1 4 2011 1 1 10 GLY CA C -10.092 7.542 -1.247 1.00 . A A . 10 GLY CA 1 1 4 2012 1 1 10 GLY H H -10.766 5.808 -2.274 1.00 . A A . 10 GLY H 1 1 4 2013 1 1 10 GLY HA2 H -10.505 8.110 -0.418 1.00 . A A . 10 GLY HA2 1 1 4 2014 1 1 10 GLY HA3 H -10.254 8.119 -2.157 1.00 . A A . 10 GLY HA3 1 1 4 2015 1 1 10 GLY N N -10.801 6.275 -1.377 1.00 . A A . 10 GLY N 1 1 4 2016 1 1 10 GLY O O -7.935 8.435 -0.778 1.00 . A A . 10 GLY O 1 1 4 2017 1 1 11 GLY C C -5.750 6.686 -1.972 1.00 . A A . 11 GLY C 1 1 4 2018 1 1 11 GLY CA C -6.594 6.007 -0.891 1.00 . A A . 11 GLY CA 1 1 4 2019 1 1 11 GLY H H -8.609 5.398 -1.226 1.00 . A A . 11 GLY H 1 1 4 2020 1 1 11 GLY HA2 H -6.384 4.941 -0.886 1.00 . A A . 11 GLY HA2 1 1 4 2021 1 1 11 GLY HA3 H -6.343 6.415 0.085 1.00 . A A . 11 GLY HA3 1 1 4 2022 1 1 11 GLY N N -8.017 6.212 -1.105 1.00 . A A . 11 GLY N 1 1 4 2023 1 1 11 GLY O O -6.102 6.657 -3.154 1.00 . A A . 11 GLY O 1 1 4 2024 1 1 12 ASP C C -2.216 7.216 -2.067 1.00 . A A . 12 ASP C 1 1 4 2025 1 1 12 ASP CA C -3.579 7.810 -2.452 1.00 . A A . 12 ASP CA 1 1 4 2026 1 1 12 ASP CB C -3.552 9.334 -2.414 1.00 . A A . 12 ASP CB 1 1 4 2027 1 1 12 ASP CG C -2.646 9.970 -3.461 1.00 . A A . 12 ASP CG 1 1 4 2028 1 1 12 ASP H H -4.486 7.348 -0.561 1.00 . A A . 12 ASP H 1 1 4 2029 1 1 12 ASP HA H -3.797 7.515 -3.475 1.00 . A A . 12 ASP HA 1 1 4 2030 1 1 12 ASP HB2 H -4.555 9.712 -2.582 1.00 . A A . 12 ASP HB2 1 1 4 2031 1 1 12 ASP HB3 H -3.233 9.634 -1.421 1.00 . A A . 12 ASP HB3 1 1 4 2032 1 1 12 ASP N N -4.651 7.327 -1.566 1.00 . A A . 12 ASP N 1 1 4 2033 1 1 12 ASP O O -1.483 6.703 -2.908 1.00 . A A . 12 ASP O 1 1 4 2034 1 1 12 ASP OD1 O -2.889 9.758 -4.670 1.00 . A A . 12 ASP OD1 1 1 4 2035 1 1 12 ASP OD2 O -1.769 10.764 -3.050 1.00 . A A . 12 ASP OD2 1 1 4 2036 1 1 13 CYS C C -0.998 6.903 1.413 1.00 . A A . 13 CYS C 1 1 4 2037 1 1 13 CYS CA C -0.801 6.606 -0.065 1.00 . A A . 13 CYS CA 1 1 4 2038 1 1 13 CYS CB C 0.548 7.145 -0.551 1.00 . A A . 13 CYS CB 1 1 4 2039 1 1 13 CYS H H -2.624 7.632 -0.163 1.00 . A A . 13 CYS H 1 1 4 2040 1 1 13 CYS HA H -0.850 5.531 -0.202 1.00 . A A . 13 CYS HA 1 1 4 2041 1 1 13 CYS HB2 H 0.774 6.704 -1.521 1.00 . A A . 13 CYS HB2 1 1 4 2042 1 1 13 CYS HB3 H 0.418 8.206 -0.712 1.00 . A A . 13 CYS HB3 1 1 4 2043 1 1 13 CYS N N -1.909 7.251 -0.765 1.00 . A A . 13 CYS N 1 1 4 2044 1 1 13 CYS O O -1.386 6.014 2.176 1.00 . A A . 13 CYS O 1 1 4 2045 1 1 13 CYS SG S 1.996 6.992 0.540 1.00 . A A . 13 CYS SG 1 1 4 2046 1 1 14 THR C C -2.034 8.079 3.919 1.00 . A A . 14 THR C 1 1 4 2047 1 1 14 THR CA C -0.818 8.636 3.170 1.00 . A A . 14 THR CA 1 1 4 2048 1 1 14 THR CB C -0.734 10.176 3.171 1.00 . A A . 14 THR CB 1 1 4 2049 1 1 14 THR CG2 C -1.002 10.779 4.553 1.00 . A A . 14 THR CG2 1 1 4 2050 1 1 14 THR H H -0.540 8.841 1.078 1.00 . A A . 14 THR H 1 1 4 2051 1 1 14 THR HA H 0.067 8.242 3.665 1.00 . A A . 14 THR HA 1 1 4 2052 1 1 14 THR HB H -1.472 10.580 2.475 1.00 . A A . 14 THR HB 1 1 4 2053 1 1 14 THR HG1 H 0.718 10.398 1.836 1.00 . A A . 14 THR HG1 1 1 4 2054 1 1 14 THR HG21 H -0.331 10.343 5.293 1.00 . A A . 14 THR HG21 1 1 4 2055 1 1 14 THR HG22 H -0.851 11.855 4.513 1.00 . A A . 14 THR HG22 1 1 4 2056 1 1 14 THR HG23 H -2.034 10.598 4.852 1.00 . A A . 14 THR HG23 1 1 4 2057 1 1 14 THR N N -0.812 8.172 1.790 1.00 . A A . 14 THR N 1 1 4 2058 1 1 14 THR O O -1.883 7.425 4.950 1.00 . A A . 14 THR O 1 1 4 2059 1 1 14 THR OG1 O 0.556 10.604 2.766 1.00 . A A . 14 THR OG1 1 1 4 2060 1 1 15 THR C C -4.934 6.516 3.846 1.00 . A A . 15 THR C 1 1 4 2061 1 1 15 THR CA C -4.502 7.997 4.005 1.00 . A A . 15 THR CA 1 1 4 2062 1 1 15 THR CB C -5.456 9.106 3.472 1.00 . A A . 15 THR CB 1 1 4 2063 1 1 15 THR CG2 C -6.497 8.771 2.406 1.00 . A A . 15 THR CG2 1 1 4 2064 1 1 15 THR H H -3.278 8.708 2.453 1.00 . A A . 15 THR H 1 1 4 2065 1 1 15 THR HA H -4.353 8.162 5.074 1.00 . A A . 15 THR HA 1 1 4 2066 1 1 15 THR HB H -4.833 9.854 2.978 1.00 . A A . 15 THR HB 1 1 4 2067 1 1 15 THR HG1 H -7.011 9.922 4.310 1.00 . A A . 15 THR HG1 1 1 4 2068 1 1 15 THR HG21 H -6.056 8.171 1.610 1.00 . A A . 15 THR HG21 1 1 4 2069 1 1 15 THR HG22 H -7.326 8.236 2.860 1.00 . A A . 15 THR HG22 1 1 4 2070 1 1 15 THR HG23 H -6.882 9.691 1.968 1.00 . A A . 15 THR HG23 1 1 4 2071 1 1 15 THR N N -3.228 8.260 3.354 1.00 . A A . 15 THR N 1 1 4 2072 1 1 15 THR O O -6.114 6.205 3.684 1.00 . A A . 15 THR O 1 1 4 2073 1 1 15 THR OG1 O -6.083 9.750 4.564 1.00 . A A . 15 THR OG1 1 1 4 2074 1 1 16 CYS C C -3.122 3.533 4.963 1.00 . A A . 16 CYS C 1 1 4 2075 1 1 16 CYS CA C -4.208 4.139 4.079 1.00 . A A . 16 CYS CA 1 1 4 2076 1 1 16 CYS CB C -4.221 3.401 2.740 1.00 . A A . 16 CYS CB 1 1 4 2077 1 1 16 CYS H H -3.027 5.907 3.968 1.00 . A A . 16 CYS H 1 1 4 2078 1 1 16 CYS HA H -5.160 3.915 4.571 1.00 . A A . 16 CYS HA 1 1 4 2079 1 1 16 CYS HB2 H -3.295 3.617 2.229 1.00 . A A . 16 CYS HB2 1 1 4 2080 1 1 16 CYS HB3 H -4.226 2.335 2.958 1.00 . A A . 16 CYS HB3 1 1 4 2081 1 1 16 CYS N N -3.982 5.577 3.898 1.00 . A A . 16 CYS N 1 1 4 2082 1 1 16 CYS O O -3.397 2.531 5.604 1.00 . A A . 16 CYS O 1 1 4 2083 1 1 16 CYS SG S -5.592 3.751 1.608 1.00 . A A . 16 CYS SG 1 1 4 2084 1 1 17 PHE C C -1.273 3.322 7.324 1.00 . A A . 17 PHE C 1 1 4 2085 1 1 17 PHE CA C -0.876 3.405 5.843 1.00 . A A . 17 PHE CA 1 1 4 2086 1 1 17 PHE CB C 0.496 4.082 5.691 1.00 . A A . 17 PHE CB 1 1 4 2087 1 1 17 PHE CD1 C 1.769 2.015 6.439 1.00 . A A . 17 PHE CD1 1 1 4 2088 1 1 17 PHE CD2 C 2.474 4.169 7.296 1.00 . A A . 17 PHE CD2 1 1 4 2089 1 1 17 PHE CE1 C 2.791 1.370 7.161 1.00 . A A . 17 PHE CE1 1 1 4 2090 1 1 17 PHE CE2 C 3.495 3.533 8.026 1.00 . A A . 17 PHE CE2 1 1 4 2091 1 1 17 PHE CG C 1.608 3.411 6.489 1.00 . A A . 17 PHE CG 1 1 4 2092 1 1 17 PHE CZ C 3.657 2.138 7.954 1.00 . A A . 17 PHE CZ 1 1 4 2093 1 1 17 PHE H H -1.662 4.925 4.544 1.00 . A A . 17 PHE H 1 1 4 2094 1 1 17 PHE HA H -0.803 2.382 5.472 1.00 . A A . 17 PHE HA 1 1 4 2095 1 1 17 PHE HB2 H 0.778 4.068 4.637 1.00 . A A . 17 PHE HB2 1 1 4 2096 1 1 17 PHE HB3 H 0.408 5.124 5.998 1.00 . A A . 17 PHE HB3 1 1 4 2097 1 1 17 PHE HD1 H 1.100 1.445 5.818 1.00 . A A . 17 PHE HD1 1 1 4 2098 1 1 17 PHE HD2 H 2.368 5.242 7.348 1.00 . A A . 17 PHE HD2 1 1 4 2099 1 1 17 PHE HE1 H 2.922 0.291 7.100 1.00 . A A . 17 PHE HE1 1 1 4 2100 1 1 17 PHE HE2 H 4.170 4.119 8.633 1.00 . A A . 17 PHE HE2 1 1 4 2101 1 1 17 PHE HZ H 4.447 1.663 8.513 1.00 . A A . 17 PHE HZ 1 1 4 2102 1 1 17 PHE N N -1.900 4.079 5.041 1.00 . A A . 17 PHE N 1 1 4 2103 1 1 17 PHE O O -0.837 2.406 8.028 1.00 . A A . 17 PHE O 1 1 4 2104 1 1 18 ASN C C -1.450 4.363 10.228 1.00 . A A . 18 ASN C 1 1 4 2105 1 1 18 ASN CA C -2.567 4.389 9.183 1.00 . A A . 18 ASN CA 1 1 4 2106 1 1 18 ASN CB C -3.604 3.294 9.436 1.00 . A A . 18 ASN CB 1 1 4 2107 1 1 18 ASN CG C -4.547 3.608 10.593 1.00 . A A . 18 ASN CG 1 1 4 2108 1 1 18 ASN H H -2.496 4.942 7.156 1.00 . A A . 18 ASN H 1 1 4 2109 1 1 18 ASN HA H -3.050 5.360 9.276 1.00 . A A . 18 ASN HA 1 1 4 2110 1 1 18 ASN HB2 H -4.212 3.148 8.543 1.00 . A A . 18 ASN HB2 1 1 4 2111 1 1 18 ASN HB3 H -3.038 2.384 9.640 1.00 . A A . 18 ASN HB3 1 1 4 2112 1 1 18 ASN HD21 H -5.206 1.673 10.675 1.00 . A A . 18 ASN HD21 1 1 4 2113 1 1 18 ASN HD22 H -5.910 2.806 11.818 1.00 . A A . 18 ASN HD22 1 1 4 2114 1 1 18 ASN N N -2.083 4.277 7.804 1.00 . A A . 18 ASN N 1 1 4 2115 1 1 18 ASN ND2 N -5.316 2.628 11.021 1.00 . A A . 18 ASN ND2 1 1 4 2116 1 1 18 ASN O O -1.690 4.171 11.420 1.00 . A A . 18 ASN O 1 1 4 2117 1 1 18 ASN OD1 O -4.619 4.730 11.100 1.00 . A A . 18 ASN OD1 1 1 4 2118 1 1 19 ASN C C 1.181 3.010 11.065 1.00 . A A . 19 ASN C 1 1 4 2119 1 1 19 ASN CA C 1.013 4.434 10.519 1.00 . A A . 19 ASN CA 1 1 4 2120 1 1 19 ASN CB C 1.113 5.573 11.526 1.00 . A A . 19 ASN CB 1 1 4 2121 1 1 19 ASN CG C 2.344 5.495 12.409 1.00 . A A . 19 ASN CG 1 1 4 2122 1 1 19 ASN H H -0.131 4.718 8.776 1.00 . A A . 19 ASN H 1 1 4 2123 1 1 19 ASN HA H 1.819 4.574 9.814 1.00 . A A . 19 ASN HA 1 1 4 2124 1 1 19 ASN HB2 H 1.098 6.520 10.986 1.00 . A A . 19 ASN HB2 1 1 4 2125 1 1 19 ASN HB3 H 0.232 5.547 12.152 1.00 . A A . 19 ASN HB3 1 1 4 2126 1 1 19 ASN HD21 H 1.194 5.545 14.068 1.00 . A A . 19 ASN HD21 1 1 4 2127 1 1 19 ASN HD22 H 2.909 5.522 14.379 1.00 . A A . 19 ASN HD22 1 1 4 2128 1 1 19 ASN N N -0.216 4.589 9.772 1.00 . A A . 19 ASN N 1 1 4 2129 1 1 19 ASN ND2 N 2.144 5.541 13.713 1.00 . A A . 19 ASN ND2 1 1 4 2130 1 1 19 ASN O O 1.294 2.779 12.269 1.00 . A A . 19 ASN O 1 1 4 2131 1 1 19 ASN OD1 O 3.472 5.432 11.927 1.00 . A A . 19 ASN OD1 1 1 4 2132 1 1 20 GLY C C 0.482 -0.185 10.925 1.00 . A A . 20 GLY C 1 1 4 2133 1 1 20 GLY CA C 1.620 0.671 10.370 1.00 . A A . 20 GLY CA 1 1 4 2134 1 1 20 GLY H H 1.064 2.318 9.166 1.00 . A A . 20 GLY H 1 1 4 2135 1 1 20 GLY HA2 H 2.481 0.654 11.035 1.00 . A A . 20 GLY HA2 1 1 4 2136 1 1 20 GLY HA3 H 1.934 0.231 9.428 1.00 . A A . 20 GLY HA3 1 1 4 2137 1 1 20 GLY N N 1.228 2.054 10.131 1.00 . A A . 20 GLY N 1 1 4 2138 1 1 20 GLY O O 0.733 -1.151 11.647 1.00 . A A . 20 GLY O 1 1 4 2139 1 1 21 THR C C -3.143 -0.243 10.124 1.00 . A A . 21 THR C 1 1 4 2140 1 1 21 THR CA C -1.970 -0.495 11.098 1.00 . A A . 21 THR CA 1 1 4 2141 1 1 21 THR CB C -2.170 -0.179 12.588 1.00 . A A . 21 THR CB 1 1 4 2142 1 1 21 THR CG2 C -2.261 1.310 12.813 1.00 . A A . 21 THR CG2 1 1 4 2143 1 1 21 THR H H -0.895 0.982 10.016 1.00 . A A . 21 THR H 1 1 4 2144 1 1 21 THR HA H -1.784 -1.543 11.106 1.00 . A A . 21 THR HA 1 1 4 2145 1 1 21 THR HB H -1.291 -0.534 13.126 1.00 . A A . 21 THR HB 1 1 4 2146 1 1 21 THR HG1 H -2.943 -1.267 13.968 1.00 . A A . 21 THR HG1 1 1 4 2147 1 1 21 THR HG21 H -3.051 1.691 12.181 1.00 . A A . 21 THR HG21 1 1 4 2148 1 1 21 THR HG22 H -2.450 1.522 13.859 1.00 . A A . 21 THR HG22 1 1 4 2149 1 1 21 THR HG23 H -1.311 1.742 12.519 1.00 . A A . 21 THR HG23 1 1 4 2150 1 1 21 THR N N -0.764 0.172 10.607 1.00 . A A . 21 THR N 1 1 4 2151 1 1 21 THR O O -4.274 0.065 10.505 1.00 . A A . 21 THR O 1 1 4 2152 1 1 21 THR OG1 O -3.280 -0.824 13.168 1.00 . A A . 21 THR OG1 1 1 4 2153 1 1 22 GLY C C -3.614 -1.115 6.653 1.00 . A A . 22 GLY C 1 1 4 2154 1 1 22 GLY CA C -3.775 -0.037 7.729 1.00 . A A . 22 GLY CA 1 1 4 2155 1 1 22 GLY H H -1.922 -0.561 8.552 1.00 . A A . 22 GLY H 1 1 4 2156 1 1 22 GLY HA2 H -3.580 0.940 7.305 1.00 . A A . 22 GLY HA2 1 1 4 2157 1 1 22 GLY HA3 H -4.800 -0.066 8.096 1.00 . A A . 22 GLY HA3 1 1 4 2158 1 1 22 GLY N N -2.841 -0.258 8.824 1.00 . A A . 22 GLY N 1 1 4 2159 1 1 22 GLY O O -2.803 -2.028 6.825 1.00 . A A . 22 GLY O 1 1 4 2160 1 1 23 PRO C C -3.198 -2.405 3.878 1.00 . A A . 23 PRO C 1 1 4 2161 1 1 23 PRO CA C -4.506 -2.194 4.647 1.00 . A A . 23 PRO CA 1 1 4 2162 1 1 23 PRO CB C -5.720 -1.913 3.770 1.00 . A A . 23 PRO CB 1 1 4 2163 1 1 23 PRO CD C -5.196 0.061 5.115 1.00 . A A . 23 PRO CD 1 1 4 2164 1 1 23 PRO CG C -6.041 -0.433 3.955 1.00 . A A . 23 PRO CG 1 1 4 2165 1 1 23 PRO HA H -4.712 -3.100 5.218 1.00 . A A . 23 PRO HA 1 1 4 2166 1 1 23 PRO HB2 H -5.513 -2.142 2.731 1.00 . A A . 23 PRO HB2 1 1 4 2167 1 1 23 PRO HB3 H -6.562 -2.507 4.120 1.00 . A A . 23 PRO HB3 1 1 4 2168 1 1 23 PRO HD2 H -4.557 0.839 4.713 1.00 . A A . 23 PRO HD2 1 1 4 2169 1 1 23 PRO HD3 H -5.811 0.487 5.901 1.00 . A A . 23 PRO HD3 1 1 4 2170 1 1 23 PRO HG2 H -5.735 0.117 3.072 1.00 . A A . 23 PRO HG2 1 1 4 2171 1 1 23 PRO HG3 H -7.102 -0.284 4.154 1.00 . A A . 23 PRO HG3 1 1 4 2172 1 1 23 PRO N N -4.396 -1.069 5.563 1.00 . A A . 23 PRO N 1 1 4 2173 1 1 23 PRO O O -2.601 -3.476 3.994 1.00 . A A . 23 PRO O 1 1 4 2174 1 1 24 CYS C C -0.472 -0.892 3.915 1.00 . A A . 24 CYS C 1 1 4 2175 1 1 24 CYS CA C -1.297 -1.391 2.733 1.00 . A A . 24 CYS CA 1 1 4 2176 1 1 24 CYS CB C -1.021 -0.557 1.476 1.00 . A A . 24 CYS CB 1 1 4 2177 1 1 24 CYS H H -3.198 -0.516 3.140 1.00 . A A . 24 CYS H 1 1 4 2178 1 1 24 CYS HA H -0.984 -2.411 2.507 1.00 . A A . 24 CYS HA 1 1 4 2179 1 1 24 CYS HB2 H -1.771 0.214 1.334 1.00 . A A . 24 CYS HB2 1 1 4 2180 1 1 24 CYS HB3 H -0.082 -0.029 1.626 1.00 . A A . 24 CYS HB3 1 1 4 2181 1 1 24 CYS N N -2.697 -1.396 3.153 1.00 . A A . 24 CYS N 1 1 4 2182 1 1 24 CYS O O -0.177 0.298 4.021 1.00 . A A . 24 CYS O 1 1 4 2183 1 1 24 CYS SG S -0.802 -1.529 -0.034 1.00 . A A . 24 CYS SG 1 1 4 2184 1 1 25 ALA C C 2.001 -2.563 5.791 1.00 . A A . 25 ALA C 1 1 4 2185 1 1 25 ALA CA C 0.858 -1.570 5.865 1.00 . A A . 25 ALA CA 1 1 4 2186 1 1 25 ALA CB C 0.176 -1.586 7.222 1.00 . A A . 25 ALA CB 1 1 4 2187 1 1 25 ALA H H -0.467 -2.748 4.671 1.00 . A A . 25 ALA H 1 1 4 2188 1 1 25 ALA HA H 1.296 -0.591 5.722 1.00 . A A . 25 ALA HA 1 1 4 2189 1 1 25 ALA HB1 H 0.919 -1.456 8.007 1.00 . A A . 25 ALA HB1 1 1 4 2190 1 1 25 ALA HB2 H -0.328 -2.545 7.354 1.00 . A A . 25 ALA HB2 1 1 4 2191 1 1 25 ALA HB3 H -0.546 -0.770 7.252 1.00 . A A . 25 ALA HB3 1 1 4 2192 1 1 25 ALA N N -0.121 -1.804 4.817 1.00 . A A . 25 ALA N 1 1 4 2193 1 1 25 ALA O O 3.169 -2.187 5.891 1.00 . A A . 25 ALA O 1 1 4 2194 1 1 26 ASN C C 3.446 -4.805 4.215 1.00 . A A . 26 ASN C 1 1 4 2195 1 1 26 ASN CA C 2.733 -4.860 5.568 1.00 . A A . 26 ASN CA 1 1 4 2196 1 1 26 ASN CB C 2.135 -6.250 5.828 1.00 . A A . 26 ASN CB 1 1 4 2197 1 1 26 ASN CG C 1.504 -6.358 7.211 1.00 . A A . 26 ASN CG 1 1 4 2198 1 1 26 ASN H H 0.734 -4.143 5.518 1.00 . A A . 26 ASN H 1 1 4 2199 1 1 26 ASN HA H 3.448 -4.607 6.358 1.00 . A A . 26 ASN HA 1 1 4 2200 1 1 26 ASN HB2 H 1.366 -6.452 5.083 1.00 . A A . 26 ASN HB2 1 1 4 2201 1 1 26 ASN HB3 H 2.917 -7.001 5.712 1.00 . A A . 26 ASN HB3 1 1 4 2202 1 1 26 ASN HD21 H 2.731 -7.871 7.810 1.00 . A A . 26 ASN HD21 1 1 4 2203 1 1 26 ASN HD22 H 1.420 -7.435 8.890 1.00 . A A . 26 ASN HD22 1 1 4 2204 1 1 26 ASN N N 1.698 -3.842 5.610 1.00 . A A . 26 ASN N 1 1 4 2205 1 1 26 ASN ND2 N 1.977 -7.246 8.063 1.00 . A A . 26 ASN ND2 1 1 4 2206 1 1 26 ASN O O 4.632 -5.133 4.143 1.00 . A A . 26 ASN O 1 1 4 2207 1 1 26 ASN OD1 O 0.591 -5.612 7.543 1.00 . A A . 26 ASN OD1 1 1 4 2208 1 1 27 CYS C C 4.338 -2.720 2.023 1.00 . A A . 27 CYS C 1 1 4 2209 1 1 27 CYS CA C 3.371 -3.901 1.895 1.00 . A A . 27 CYS CA 1 1 4 2210 1 1 27 CYS CB C 2.313 -3.672 0.799 1.00 . A A . 27 CYS CB 1 1 4 2211 1 1 27 CYS H H 1.782 -4.093 3.337 1.00 . A A . 27 CYS H 1 1 4 2212 1 1 27 CYS HA H 3.960 -4.736 1.526 1.00 . A A . 27 CYS HA 1 1 4 2213 1 1 27 CYS HB2 H 1.683 -2.788 0.954 1.00 . A A . 27 CYS HB2 1 1 4 2214 1 1 27 CYS HB3 H 2.845 -3.464 -0.131 1.00 . A A . 27 CYS HB3 1 1 4 2215 1 1 27 CYS N N 2.766 -4.290 3.177 1.00 . A A . 27 CYS N 1 1 4 2216 1 1 27 CYS O O 4.810 -2.241 1.001 1.00 . A A . 27 CYS O 1 1 4 2217 1 1 27 CYS SG S 1.342 -5.190 0.566 1.00 . A A . 27 CYS SG 1 1 4 2218 1 1 28 LEU C C 6.706 -1.552 4.210 1.00 . A A . 28 LEU C 1 1 4 2219 1 1 28 LEU CA C 5.471 -1.060 3.465 1.00 . A A . 28 LEU CA 1 1 4 2220 1 1 28 LEU CB C 4.747 0.028 4.293 1.00 . A A . 28 LEU CB 1 1 4 2221 1 1 28 LEU CD1 C 3.715 2.186 3.508 1.00 . A A . 28 LEU CD1 1 1 4 2222 1 1 28 LEU CD2 C 2.836 0.097 2.488 1.00 . A A . 28 LEU CD2 1 1 4 2223 1 1 28 LEU CG C 3.473 0.697 3.735 1.00 . A A . 28 LEU CG 1 1 4 2224 1 1 28 LEU H H 4.142 -2.588 4.040 1.00 . A A . 28 LEU H 1 1 4 2225 1 1 28 LEU HA H 5.788 -0.630 2.516 1.00 . A A . 28 LEU HA 1 1 4 2226 1 1 28 LEU HB2 H 4.504 -0.363 5.273 1.00 . A A . 28 LEU HB2 1 1 4 2227 1 1 28 LEU HB3 H 5.472 0.803 4.525 1.00 . A A . 28 LEU HB3 1 1 4 2228 1 1 28 LEU HD11 H 4.033 2.634 4.450 1.00 . A A . 28 LEU HD11 1 1 4 2229 1 1 28 LEU HD12 H 4.494 2.320 2.761 1.00 . A A . 28 LEU HD12 1 1 4 2230 1 1 28 LEU HD13 H 2.798 2.672 3.183 1.00 . A A . 28 LEU HD13 1 1 4 2231 1 1 28 LEU HD21 H 3.539 0.126 1.653 1.00 . A A . 28 LEU HD21 1 1 4 2232 1 1 28 LEU HD22 H 2.497 -0.914 2.684 1.00 . A A . 28 LEU HD22 1 1 4 2233 1 1 28 LEU HD23 H 1.938 0.660 2.266 1.00 . A A . 28 LEU HD23 1 1 4 2234 1 1 28 LEU HG H 2.711 0.617 4.497 1.00 . A A . 28 LEU HG 1 1 4 2235 1 1 28 LEU N N 4.610 -2.211 3.231 1.00 . A A . 28 LEU N 1 1 4 2236 1 1 28 LEU O O 7.827 -1.514 3.704 1.00 . A A . 28 LEU O 1 1 4 2237 1 1 29 ALA C C 8.547 -3.378 5.980 1.00 . A A . 29 ALA C 1 1 4 2238 1 1 29 ALA CA C 7.563 -2.288 6.390 1.00 . A A . 29 ALA CA 1 1 4 2239 1 1 29 ALA CB C 6.938 -2.634 7.732 1.00 . A A . 29 ALA CB 1 1 4 2240 1 1 29 ALA H H 5.541 -2.066 5.771 1.00 . A A . 29 ALA H 1 1 4 2241 1 1 29 ALA HA H 8.131 -1.367 6.492 1.00 . A A . 29 ALA HA 1 1 4 2242 1 1 29 ALA HB1 H 7.725 -2.758 8.471 1.00 . A A . 29 ALA HB1 1 1 4 2243 1 1 29 ALA HB2 H 6.372 -3.562 7.650 1.00 . A A . 29 ALA HB2 1 1 4 2244 1 1 29 ALA HB3 H 6.284 -1.822 8.045 1.00 . A A . 29 ALA HB3 1 1 4 2245 1 1 29 ALA N N 6.493 -2.053 5.430 1.00 . A A . 29 ALA N 1 1 4 2246 1 1 29 ALA O O 9.661 -3.420 6.500 1.00 . A A . 29 ALA O 1 1 4 2247 1 1 30 GLY C C 8.522 -5.520 3.089 1.00 . A A . 30 GLY C 1 1 4 2248 1 1 30 GLY CA C 9.034 -5.243 4.480 1.00 . A A . 30 GLY CA 1 1 4 2249 1 1 30 GLY H H 7.246 -4.134 4.638 1.00 . A A . 30 GLY H 1 1 4 2250 1 1 30 GLY HA2 H 8.999 -6.152 5.077 1.00 . A A . 30 GLY HA2 1 1 4 2251 1 1 30 GLY HA3 H 10.057 -4.881 4.440 1.00 . A A . 30 GLY HA3 1 1 4 2252 1 1 30 GLY N N 8.159 -4.248 5.055 1.00 . A A . 30 GLY N 1 1 4 2253 1 1 30 GLY O O 7.778 -6.486 2.914 1.00 . A A . 30 GLY O 1 1 4 2254 1 1 31 TYR C C 9.188 -5.123 -0.367 1.00 . A A . 31 TYR C 1 1 4 2255 1 1 31 TYR CA C 8.231 -4.767 0.792 1.00 . A A . 31 TYR CA 1 1 4 2256 1 1 31 TYR CB C 7.566 -3.386 0.645 1.00 . A A . 31 TYR CB 1 1 4 2257 1 1 31 TYR CD1 C 9.728 -2.196 -0.004 1.00 . A A . 31 TYR CD1 1 1 4 2258 1 1 31 TYR CD2 C 7.598 -1.244 -0.667 1.00 . A A . 31 TYR CD2 1 1 4 2259 1 1 31 TYR CE1 C 10.395 -1.181 -0.706 1.00 . A A . 31 TYR CE1 1 1 4 2260 1 1 31 TYR CE2 C 8.243 -0.178 -1.319 1.00 . A A . 31 TYR CE2 1 1 4 2261 1 1 31 TYR CG C 8.328 -2.282 -0.067 1.00 . A A . 31 TYR CG 1 1 4 2262 1 1 31 TYR CZ C 9.659 -0.166 -1.370 1.00 . A A . 31 TYR CZ 1 1 4 2263 1 1 31 TYR H H 9.449 -3.873 2.322 1.00 . A A . 31 TYR H 1 1 4 2264 1 1 31 TYR HA H 7.434 -5.492 0.791 1.00 . A A . 31 TYR HA 1 1 4 2265 1 1 31 TYR HB2 H 6.683 -3.570 0.045 1.00 . A A . 31 TYR HB2 1 1 4 2266 1 1 31 TYR HB3 H 7.215 -3.013 1.607 1.00 . A A . 31 TYR HB3 1 1 4 2267 1 1 31 TYR HD1 H 10.288 -2.998 0.464 1.00 . A A . 31 TYR HD1 1 1 4 2268 1 1 31 TYR HD2 H 6.528 -1.277 -0.571 1.00 . A A . 31 TYR HD2 1 1 4 2269 1 1 31 TYR HE1 H 11.472 -1.226 -0.744 1.00 . A A . 31 TYR HE1 1 1 4 2270 1 1 31 TYR HE2 H 7.637 0.611 -1.766 1.00 . A A . 31 TYR HE2 1 1 4 2271 1 1 31 TYR HH H 11.278 0.687 -2.036 1.00 . A A . 31 TYR HH 1 1 4 2272 1 1 31 TYR N N 8.864 -4.673 2.109 1.00 . A A . 31 TYR N 1 1 4 2273 1 1 31 TYR O O 9.005 -4.647 -1.490 1.00 . A A . 31 TYR O 1 1 4 2274 1 1 31 TYR OH O 10.306 0.801 -2.078 1.00 . A A . 31 TYR OH 1 1 4 2275 1 1 32 PRO C C 10.312 -7.348 -2.403 1.00 . A A . 32 PRO C 1 1 4 2276 1 1 32 PRO CA C 10.971 -6.498 -1.307 1.00 . A A . 32 PRO CA 1 1 4 2277 1 1 32 PRO CB C 12.096 -7.281 -0.619 1.00 . A A . 32 PRO CB 1 1 4 2278 1 1 32 PRO CD C 10.315 -6.954 0.932 1.00 . A A . 32 PRO CD 1 1 4 2279 1 1 32 PRO CG C 11.365 -7.973 0.525 1.00 . A A . 32 PRO CG 1 1 4 2280 1 1 32 PRO HA H 11.357 -5.555 -1.715 1.00 . A A . 32 PRO HA 1 1 4 2281 1 1 32 PRO HB2 H 12.583 -7.998 -1.281 1.00 . A A . 32 PRO HB2 1 1 4 2282 1 1 32 PRO HB3 H 12.838 -6.594 -0.216 1.00 . A A . 32 PRO HB3 1 1 4 2283 1 1 32 PRO HD2 H 9.418 -7.449 1.290 1.00 . A A . 32 PRO HD2 1 1 4 2284 1 1 32 PRO HD3 H 10.729 -6.304 1.699 1.00 . A A . 32 PRO HD3 1 1 4 2285 1 1 32 PRO HG2 H 10.872 -8.876 0.160 1.00 . A A . 32 PRO HG2 1 1 4 2286 1 1 32 PRO HG3 H 12.037 -8.186 1.352 1.00 . A A . 32 PRO HG3 1 1 4 2287 1 1 32 PRO N N 10.025 -6.169 -0.250 1.00 . A A . 32 PRO N 1 1 4 2288 1 1 32 PRO O O 10.998 -7.765 -3.340 1.00 . A A . 32 PRO O 1 1 4 2289 1 1 33 ALA C C 6.911 -7.513 -3.554 1.00 . A A . 33 ALA C 1 1 4 2290 1 1 33 ALA CA C 8.169 -8.334 -3.217 1.00 . A A . 33 ALA CA 1 1 4 2291 1 1 33 ALA CB C 7.788 -9.716 -2.682 1.00 . A A . 33 ALA CB 1 1 4 2292 1 1 33 ALA H H 8.556 -7.329 -1.418 1.00 . A A . 33 ALA H 1 1 4 2293 1 1 33 ALA HA H 8.731 -8.466 -4.145 1.00 . A A . 33 ALA HA 1 1 4 2294 1 1 33 ALA HB1 H 7.178 -10.240 -3.418 1.00 . A A . 33 ALA HB1 1 1 4 2295 1 1 33 ALA HB2 H 8.690 -10.299 -2.493 1.00 . A A . 33 ALA HB2 1 1 4 2296 1 1 33 ALA HB3 H 7.215 -9.599 -1.761 1.00 . A A . 33 ALA HB3 1 1 4 2297 1 1 33 ALA N N 9.024 -7.683 -2.237 1.00 . A A . 33 ALA N 1 1 4 2298 1 1 33 ALA O O 6.113 -7.971 -4.373 1.00 . A A . 33 ALA O 1 1 4 2299 1 1 34 GLY C C 5.090 -5.161 -4.482 1.00 . A A . 34 GLY C 1 1 4 2300 1 1 34 GLY CA C 5.367 -5.683 -3.074 1.00 . A A . 34 GLY CA 1 1 4 2301 1 1 34 GLY H H 7.380 -5.924 -2.374 1.00 . A A . 34 GLY H 1 1 4 2302 1 1 34 GLY HA2 H 5.286 -4.872 -2.357 1.00 . A A . 34 GLY HA2 1 1 4 2303 1 1 34 GLY HA3 H 4.588 -6.406 -2.837 1.00 . A A . 34 GLY HA3 1 1 4 2304 1 1 34 GLY N N 6.662 -6.352 -2.939 1.00 . A A . 34 GLY N 1 1 4 2305 1 1 34 GLY O O 3.939 -5.176 -4.919 1.00 . A A . 34 GLY O 1 1 4 2306 1 1 35 CYS C C 5.580 -5.651 -7.493 1.00 . A A . 35 CYS C 1 1 4 2307 1 1 35 CYS CA C 6.083 -4.478 -6.647 1.00 . A A . 35 CYS CA 1 1 4 2308 1 1 35 CYS CB C 7.490 -4.084 -7.125 1.00 . A A . 35 CYS CB 1 1 4 2309 1 1 35 CYS H H 7.035 -4.703 -4.775 1.00 . A A . 35 CYS H 1 1 4 2310 1 1 35 CYS HA H 5.391 -3.647 -6.773 1.00 . A A . 35 CYS HA 1 1 4 2311 1 1 35 CYS HB2 H 8.094 -4.993 -7.147 1.00 . A A . 35 CYS HB2 1 1 4 2312 1 1 35 CYS HB3 H 7.427 -3.708 -8.146 1.00 . A A . 35 CYS HB3 1 1 4 2313 1 1 35 CYS N N 6.135 -4.794 -5.224 1.00 . A A . 35 CYS N 1 1 4 2314 1 1 35 CYS O O 5.129 -5.448 -8.619 1.00 . A A . 35 CYS O 1 1 4 2315 1 1 35 CYS SG S 8.302 -2.848 -6.066 1.00 . A A . 35 CYS SG 1 1 4 2316 1 1 36 SER C C 3.613 -8.199 -7.301 1.00 . A A . 36 SER C 1 1 4 2317 1 1 36 SER CA C 5.097 -8.031 -7.657 1.00 . A A . 36 SER CA 1 1 4 2318 1 1 36 SER CB C 5.973 -9.245 -7.327 1.00 . A A . 36 SER CB 1 1 4 2319 1 1 36 SER H H 6.082 -7.097 -6.101 1.00 . A A . 36 SER H 1 1 4 2320 1 1 36 SER HA H 5.176 -7.855 -8.728 1.00 . A A . 36 SER HA 1 1 4 2321 1 1 36 SER HB2 H 5.802 -9.976 -8.093 1.00 . A A . 36 SER HB2 1 1 4 2322 1 1 36 SER HB3 H 7.024 -8.960 -7.378 1.00 . A A . 36 SER HB3 1 1 4 2323 1 1 36 SER HG H 5.846 -9.182 -5.371 1.00 . A A . 36 SER HG 1 1 4 2324 1 1 36 SER N N 5.664 -6.890 -6.995 1.00 . A A . 36 SER N 1 1 4 2325 1 1 36 SER O O 2.836 -8.613 -8.164 1.00 . A A . 36 SER O 1 1 4 2326 1 1 36 SER OG O 5.719 -9.854 -6.077 1.00 . A A . 36 SER OG 1 1 4 2327 1 1 37 ASN C C 0.962 -6.952 -6.039 1.00 . A A . 37 ASN C 1 1 4 2328 1 1 37 ASN CA C 1.868 -8.062 -5.527 1.00 . A A . 37 ASN CA 1 1 4 2329 1 1 37 ASN CB C 1.878 -8.074 -3.976 1.00 . A A . 37 ASN CB 1 1 4 2330 1 1 37 ASN CG C 1.508 -9.458 -3.476 1.00 . A A . 37 ASN CG 1 1 4 2331 1 1 37 ASN H H 3.888 -7.415 -5.466 1.00 . A A . 37 ASN H 1 1 4 2332 1 1 37 ASN HA H 1.483 -9.019 -5.882 1.00 . A A . 37 ASN HA 1 1 4 2333 1 1 37 ASN HB2 H 2.841 -7.748 -3.573 1.00 . A A . 37 ASN HB2 1 1 4 2334 1 1 37 ASN HB3 H 1.140 -7.381 -3.575 1.00 . A A . 37 ASN HB3 1 1 4 2335 1 1 37 ASN HD21 H -0.421 -8.916 -3.006 1.00 . A A . 37 ASN HD21 1 1 4 2336 1 1 37 ASN HD22 H -0.008 -10.589 -2.809 1.00 . A A . 37 ASN HD22 1 1 4 2337 1 1 37 ASN N N 3.215 -7.873 -6.065 1.00 . A A . 37 ASN N 1 1 4 2338 1 1 37 ASN ND2 N 0.266 -9.654 -3.055 1.00 . A A . 37 ASN ND2 1 1 4 2339 1 1 37 ASN O O 0.946 -5.885 -5.431 1.00 . A A . 37 ASN O 1 1 4 2340 1 1 37 ASN OD1 O 2.316 -10.375 -3.517 1.00 . A A . 37 ASN OD1 1 1 4 2341 1 1 38 SER C C -1.463 -5.312 -6.846 1.00 . A A . 38 SER C 1 1 4 2342 1 1 38 SER CA C -0.524 -6.083 -7.793 1.00 . A A . 38 SER CA 1 1 4 2343 1 1 38 SER CB C -1.261 -6.616 -9.025 1.00 . A A . 38 SER CB 1 1 4 2344 1 1 38 SER H H 0.264 -8.074 -7.566 1.00 . A A . 38 SER H 1 1 4 2345 1 1 38 SER HA H 0.217 -5.374 -8.156 1.00 . A A . 38 SER HA 1 1 4 2346 1 1 38 SER HB2 H -1.333 -7.700 -8.986 1.00 . A A . 38 SER HB2 1 1 4 2347 1 1 38 SER HB3 H -2.270 -6.205 -9.061 1.00 . A A . 38 SER HB3 1 1 4 2348 1 1 38 SER HG H 0.386 -6.399 -10.070 1.00 . A A . 38 SER HG 1 1 4 2349 1 1 38 SER N N 0.217 -7.161 -7.127 1.00 . A A . 38 SER N 1 1 4 2350 1 1 38 SER O O -1.585 -4.092 -6.980 1.00 . A A . 38 SER O 1 1 4 2351 1 1 38 SER OG O -0.567 -6.216 -10.194 1.00 . A A . 38 SER OG 1 1 4 2352 1 1 39 ASP C C -2.210 -4.247 -4.100 1.00 . A A . 39 ASP C 1 1 4 2353 1 1 39 ASP CA C -2.896 -5.418 -4.800 1.00 . A A . 39 ASP CA 1 1 4 2354 1 1 39 ASP CB C -3.207 -6.524 -3.783 1.00 . A A . 39 ASP CB 1 1 4 2355 1 1 39 ASP CG C -3.965 -6.110 -2.507 1.00 . A A . 39 ASP CG 1 1 4 2356 1 1 39 ASP H H -1.971 -6.997 -5.875 1.00 . A A . 39 ASP H 1 1 4 2357 1 1 39 ASP HA H -3.823 -5.077 -5.245 1.00 . A A . 39 ASP HA 1 1 4 2358 1 1 39 ASP HB2 H -3.786 -7.294 -4.291 1.00 . A A . 39 ASP HB2 1 1 4 2359 1 1 39 ASP HB3 H -2.259 -6.978 -3.483 1.00 . A A . 39 ASP HB3 1 1 4 2360 1 1 39 ASP N N -2.053 -5.991 -5.858 1.00 . A A . 39 ASP N 1 1 4 2361 1 1 39 ASP O O -2.833 -3.228 -3.806 1.00 . A A . 39 ASP O 1 1 4 2362 1 1 39 ASP OD1 O -5.035 -5.464 -2.577 1.00 . A A . 39 ASP OD1 1 1 4 2363 1 1 39 ASP OD2 O -3.595 -6.635 -1.430 1.00 . A A . 39 ASP OD2 1 1 4 2364 1 1 40 CYS C C 0.671 -2.556 -4.190 1.00 . A A . 40 CYS C 1 1 4 2365 1 1 40 CYS CA C -0.061 -3.440 -3.197 1.00 . A A . 40 CYS CA 1 1 4 2366 1 1 40 CYS CB C 0.880 -4.197 -2.255 1.00 . A A . 40 CYS CB 1 1 4 2367 1 1 40 CYS H H -0.441 -5.169 -4.336 1.00 . A A . 40 CYS H 1 1 4 2368 1 1 40 CYS HA H -0.690 -2.782 -2.600 1.00 . A A . 40 CYS HA 1 1 4 2369 1 1 40 CYS HB2 H 1.340 -5.050 -2.765 1.00 . A A . 40 CYS HB2 1 1 4 2370 1 1 40 CYS HB3 H 1.683 -3.534 -1.923 1.00 . A A . 40 CYS HB3 1 1 4 2371 1 1 40 CYS N N -0.905 -4.393 -3.882 1.00 . A A . 40 CYS N 1 1 4 2372 1 1 40 CYS O O 0.692 -1.350 -3.983 1.00 . A A . 40 CYS O 1 1 4 2373 1 1 40 CYS SG S -0.062 -4.745 -0.808 1.00 . A A . 40 CYS SG 1 1 4 2374 1 1 41 THR C C 1.243 -1.116 -6.707 1.00 . A A . 41 THR C 1 1 4 2375 1 1 41 THR CA C 1.928 -2.430 -6.334 1.00 . A A . 41 THR CA 1 1 4 2376 1 1 41 THR CB C 1.924 -3.359 -7.553 1.00 . A A . 41 THR CB 1 1 4 2377 1 1 41 THR CG2 C 2.513 -2.761 -8.820 1.00 . A A . 41 THR CG2 1 1 4 2378 1 1 41 THR H H 1.102 -4.113 -5.406 1.00 . A A . 41 THR H 1 1 4 2379 1 1 41 THR HA H 2.950 -2.231 -6.003 1.00 . A A . 41 THR HA 1 1 4 2380 1 1 41 THR HB H 0.883 -3.566 -7.778 1.00 . A A . 41 THR HB 1 1 4 2381 1 1 41 THR HG1 H 2.735 -4.704 -6.364 1.00 . A A . 41 THR HG1 1 1 4 2382 1 1 41 THR HG21 H 2.055 -1.793 -9.042 1.00 . A A . 41 THR HG21 1 1 4 2383 1 1 41 THR HG22 H 3.587 -2.632 -8.697 1.00 . A A . 41 THR HG22 1 1 4 2384 1 1 41 THR HG23 H 2.304 -3.450 -9.635 1.00 . A A . 41 THR HG23 1 1 4 2385 1 1 41 THR N N 1.208 -3.116 -5.274 1.00 . A A . 41 THR N 1 1 4 2386 1 1 41 THR O O 1.922 -0.101 -6.843 1.00 . A A . 41 THR O 1 1 4 2387 1 1 41 THR OG1 O 2.596 -4.582 -7.319 1.00 . A A . 41 THR OG1 1 1 4 2388 1 1 42 ALA C C -0.773 1.209 -6.491 1.00 . A A . 42 ALA C 1 1 4 2389 1 1 42 ALA CA C -0.770 0.024 -7.458 1.00 . A A . 42 ALA CA 1 1 4 2390 1 1 42 ALA CB C -2.202 -0.352 -7.806 1.00 . A A . 42 ALA CB 1 1 4 2391 1 1 42 ALA H H -0.592 -1.999 -6.804 1.00 . A A . 42 ALA H 1 1 4 2392 1 1 42 ALA HA H -0.258 0.327 -8.373 1.00 . A A . 42 ALA HA 1 1 4 2393 1 1 42 ALA HB1 H -2.212 -1.146 -8.554 1.00 . A A . 42 ALA HB1 1 1 4 2394 1 1 42 ALA HB2 H -2.676 0.537 -8.211 1.00 . A A . 42 ALA HB2 1 1 4 2395 1 1 42 ALA HB3 H -2.738 -0.670 -6.911 1.00 . A A . 42 ALA HB3 1 1 4 2396 1 1 42 ALA N N -0.077 -1.134 -6.923 1.00 . A A . 42 ALA N 1 1 4 2397 1 1 42 ALA O O -0.761 2.350 -6.954 1.00 . A A . 42 ALA O 1 1 4 2398 1 1 43 PHE C C 0.906 2.232 -4.066 1.00 . A A . 43 PHE C 1 1 4 2399 1 1 43 PHE CA C -0.585 1.919 -4.122 1.00 . A A . 43 PHE CA 1 1 4 2400 1 1 43 PHE CB C -1.134 1.350 -2.804 1.00 . A A . 43 PHE CB 1 1 4 2401 1 1 43 PHE CD1 C 0.628 1.548 -1.013 1.00 . A A . 43 PHE CD1 1 1 4 2402 1 1 43 PHE CD2 C -1.469 2.705 -0.665 1.00 . A A . 43 PHE CD2 1 1 4 2403 1 1 43 PHE CE1 C 1.117 2.036 0.202 1.00 . A A . 43 PHE CE1 1 1 4 2404 1 1 43 PHE CE2 C -1.000 3.133 0.589 1.00 . A A . 43 PHE CE2 1 1 4 2405 1 1 43 PHE CG C -0.640 1.923 -1.488 1.00 . A A . 43 PHE CG 1 1 4 2406 1 1 43 PHE CZ C 0.290 2.805 1.027 1.00 . A A . 43 PHE CZ 1 1 4 2407 1 1 43 PHE H H -0.823 -0.025 -4.898 1.00 . A A . 43 PHE H 1 1 4 2408 1 1 43 PHE HA H -1.130 2.831 -4.361 1.00 . A A . 43 PHE HA 1 1 4 2409 1 1 43 PHE HB2 H -2.217 1.405 -2.841 1.00 . A A . 43 PHE HB2 1 1 4 2410 1 1 43 PHE HB3 H -0.870 0.308 -2.771 1.00 . A A . 43 PHE HB3 1 1 4 2411 1 1 43 PHE HD1 H 1.216 0.843 -1.567 1.00 . A A . 43 PHE HD1 1 1 4 2412 1 1 43 PHE HD2 H -2.481 2.933 -0.964 1.00 . A A . 43 PHE HD2 1 1 4 2413 1 1 43 PHE HE1 H 2.122 1.806 0.511 1.00 . A A . 43 PHE HE1 1 1 4 2414 1 1 43 PHE HE2 H -1.620 3.735 1.219 1.00 . A A . 43 PHE HE2 1 1 4 2415 1 1 43 PHE HZ H 0.656 3.134 1.990 1.00 . A A . 43 PHE HZ 1 1 4 2416 1 1 43 PHE N N -0.799 0.945 -5.183 1.00 . A A . 43 PHE N 1 1 4 2417 1 1 43 PHE O O 1.278 3.403 -4.162 1.00 . A A . 43 PHE O 1 1 4 2418 1 1 44 LEU C C 3.861 2.265 -4.818 1.00 . A A . 44 LEU C 1 1 4 2419 1 1 44 LEU CA C 3.198 1.427 -3.711 1.00 . A A . 44 LEU CA 1 1 4 2420 1 1 44 LEU CB C 3.966 0.101 -3.571 1.00 . A A . 44 LEU CB 1 1 4 2421 1 1 44 LEU CD1 C 4.430 -2.147 -2.614 1.00 . A A . 44 LEU CD1 1 1 4 2422 1 1 44 LEU CD2 C 3.769 -0.243 -1.075 1.00 . A A . 44 LEU CD2 1 1 4 2423 1 1 44 LEU CG C 3.588 -0.875 -2.447 1.00 . A A . 44 LEU CG 1 1 4 2424 1 1 44 LEU H H 1.436 0.276 -3.719 1.00 . A A . 44 LEU H 1 1 4 2425 1 1 44 LEU HA H 3.235 1.972 -2.776 1.00 . A A . 44 LEU HA 1 1 4 2426 1 1 44 LEU HB2 H 3.910 -0.449 -4.502 1.00 . A A . 44 LEU HB2 1 1 4 2427 1 1 44 LEU HB3 H 5.006 0.370 -3.443 1.00 . A A . 44 LEU HB3 1 1 4 2428 1 1 44 LEU HD11 H 4.235 -2.594 -3.596 1.00 . A A . 44 LEU HD11 1 1 4 2429 1 1 44 LEU HD12 H 5.490 -1.910 -2.560 1.00 . A A . 44 LEU HD12 1 1 4 2430 1 1 44 LEU HD13 H 4.183 -2.861 -1.832 1.00 . A A . 44 LEU HD13 1 1 4 2431 1 1 44 LEU HD21 H 3.331 0.746 -1.027 1.00 . A A . 44 LEU HD21 1 1 4 2432 1 1 44 LEU HD22 H 3.263 -0.869 -0.343 1.00 . A A . 44 LEU HD22 1 1 4 2433 1 1 44 LEU HD23 H 4.817 -0.158 -0.831 1.00 . A A . 44 LEU HD23 1 1 4 2434 1 1 44 LEU HG H 2.550 -1.171 -2.510 1.00 . A A . 44 LEU HG 1 1 4 2435 1 1 44 LEU N N 1.777 1.216 -3.932 1.00 . A A . 44 LEU N 1 1 4 2436 1 1 44 LEU O O 4.828 2.983 -4.549 1.00 . A A . 44 LEU O 1 1 4 2437 1 1 45 SER C C 3.701 4.477 -6.803 1.00 . A A . 45 SER C 1 1 4 2438 1 1 45 SER CA C 3.640 3.001 -7.203 1.00 . A A . 45 SER CA 1 1 4 2439 1 1 45 SER CB C 2.580 2.709 -8.288 1.00 . A A . 45 SER CB 1 1 4 2440 1 1 45 SER H H 2.588 1.501 -6.144 1.00 . A A . 45 SER H 1 1 4 2441 1 1 45 SER HA H 4.623 2.697 -7.568 1.00 . A A . 45 SER HA 1 1 4 2442 1 1 45 SER HB2 H 2.473 1.635 -8.409 1.00 . A A . 45 SER HB2 1 1 4 2443 1 1 45 SER HB3 H 1.598 3.046 -7.974 1.00 . A A . 45 SER HB3 1 1 4 2444 1 1 45 SER HG H 2.967 4.209 -9.529 1.00 . A A . 45 SER HG 1 1 4 2445 1 1 45 SER N N 3.316 2.196 -6.034 1.00 . A A . 45 SER N 1 1 4 2446 1 1 45 SER O O 4.727 5.123 -6.986 1.00 . A A . 45 SER O 1 1 4 2447 1 1 45 SER OG O 2.894 3.236 -9.564 1.00 . A A . 45 SER OG 1 1 4 2448 1 1 46 GLN C C 3.223 6.548 -4.394 1.00 . A A . 46 GLN C 1 1 4 2449 1 1 46 GLN CA C 2.551 6.378 -5.755 1.00 . A A . 46 GLN CA 1 1 4 2450 1 1 46 GLN CB C 1.076 6.803 -5.680 1.00 . A A . 46 GLN CB 1 1 4 2451 1 1 46 GLN CD C -0.041 5.772 -7.737 1.00 . A A . 46 GLN CD 1 1 4 2452 1 1 46 GLN CG C 0.495 7.037 -7.085 1.00 . A A . 46 GLN CG 1 1 4 2453 1 1 46 GLN H H 1.857 4.378 -5.989 1.00 . A A . 46 GLN H 1 1 4 2454 1 1 46 GLN HA H 3.076 7.022 -6.464 1.00 . A A . 46 GLN HA 1 1 4 2455 1 1 46 GLN HB2 H 0.494 6.060 -5.135 1.00 . A A . 46 GLN HB2 1 1 4 2456 1 1 46 GLN HB3 H 0.994 7.728 -5.113 1.00 . A A . 46 GLN HB3 1 1 4 2457 1 1 46 GLN HE21 H -1.289 5.498 -6.206 1.00 . A A . 46 GLN HE21 1 1 4 2458 1 1 46 GLN HE22 H -1.083 4.121 -7.277 1.00 . A A . 46 GLN HE22 1 1 4 2459 1 1 46 GLN HG2 H -0.311 7.762 -7.015 1.00 . A A . 46 GLN HG2 1 1 4 2460 1 1 46 GLN HG3 H 1.268 7.462 -7.721 1.00 . A A . 46 GLN HG3 1 1 4 2461 1 1 46 GLN N N 2.624 4.998 -6.213 1.00 . A A . 46 GLN N 1 1 4 2462 1 1 46 GLN NE2 N -0.999 5.122 -7.098 1.00 . A A . 46 GLN NE2 1 1 4 2463 1 1 46 GLN O O 3.850 7.576 -4.138 1.00 . A A . 46 GLN O 1 1 4 2464 1 1 46 GLN OE1 O 0.375 5.369 -8.820 1.00 . A A . 46 GLN OE1 1 1 4 2465 1 1 47 CYS C C 4.964 5.757 -1.897 1.00 . A A . 47 CYS C 1 1 4 2466 1 1 47 CYS CA C 3.452 5.740 -2.105 1.00 . A A . 47 CYS CA 1 1 4 2467 1 1 47 CYS CB C 2.801 4.643 -1.254 1.00 . A A . 47 CYS CB 1 1 4 2468 1 1 47 CYS H H 2.486 4.786 -3.764 1.00 . A A . 47 CYS H 1 1 4 2469 1 1 47 CYS HA H 3.075 6.714 -1.805 1.00 . A A . 47 CYS HA 1 1 4 2470 1 1 47 CYS HB2 H 1.816 4.427 -1.670 1.00 . A A . 47 CYS HB2 1 1 4 2471 1 1 47 CYS HB3 H 3.404 3.732 -1.304 1.00 . A A . 47 CYS HB3 1 1 4 2472 1 1 47 CYS N N 3.066 5.571 -3.498 1.00 . A A . 47 CYS N 1 1 4 2473 1 1 47 CYS O O 5.440 6.418 -0.976 1.00 . A A . 47 CYS O 1 1 4 2474 1 1 47 CYS SG S 2.543 5.037 0.496 1.00 . A A . 47 CYS SG 1 1 4 2475 1 1 48 TYR C C 7.807 5.282 -3.995 1.00 . A A . 48 TYR C 1 1 4 2476 1 1 48 TYR CA C 7.152 4.920 -2.667 1.00 . A A . 48 TYR CA 1 1 4 2477 1 1 48 TYR CB C 7.554 3.507 -2.288 1.00 . A A . 48 TYR CB 1 1 4 2478 1 1 48 TYR CD1 C 8.336 3.435 0.082 1.00 . A A . 48 TYR CD1 1 1 4 2479 1 1 48 TYR CD2 C 6.234 2.337 -0.492 1.00 . A A . 48 TYR CD2 1 1 4 2480 1 1 48 TYR CE1 C 8.258 2.929 1.384 1.00 . A A . 48 TYR CE1 1 1 4 2481 1 1 48 TYR CE2 C 6.192 1.766 0.789 1.00 . A A . 48 TYR CE2 1 1 4 2482 1 1 48 TYR CG C 7.336 3.126 -0.854 1.00 . A A . 48 TYR CG 1 1 4 2483 1 1 48 TYR CZ C 7.212 2.054 1.723 1.00 . A A . 48 TYR CZ 1 1 4 2484 1 1 48 TYR H H 5.230 4.533 -3.476 1.00 . A A . 48 TYR H 1 1 4 2485 1 1 48 TYR HA H 7.554 5.557 -1.886 1.00 . A A . 48 TYR HA 1 1 4 2486 1 1 48 TYR HB2 H 7.088 2.781 -2.957 1.00 . A A . 48 TYR HB2 1 1 4 2487 1 1 48 TYR HB3 H 8.628 3.454 -2.413 1.00 . A A . 48 TYR HB3 1 1 4 2488 1 1 48 TYR HD1 H 9.181 4.044 -0.209 1.00 . A A . 48 TYR HD1 1 1 4 2489 1 1 48 TYR HD2 H 5.481 2.097 -1.224 1.00 . A A . 48 TYR HD2 1 1 4 2490 1 1 48 TYR HE1 H 9.008 3.186 2.119 1.00 . A A . 48 TYR HE1 1 1 4 2491 1 1 48 TYR HE2 H 5.407 1.072 1.033 1.00 . A A . 48 TYR HE2 1 1 4 2492 1 1 48 TYR HH H 8.124 1.354 3.276 1.00 . A A . 48 TYR HH 1 1 4 2493 1 1 48 TYR N N 5.704 5.037 -2.738 1.00 . A A . 48 TYR N 1 1 4 2494 1 1 48 TYR O O 8.860 5.922 -3.999 1.00 . A A . 48 TYR O 1 1 4 2495 1 1 48 TYR OH O 7.214 1.475 2.942 1.00 . A A . 48 TYR OH 1 1 4 2496 1 1 49 GLY C C 7.812 3.744 -7.254 1.00 . A A . 49 GLY C 1 1 4 2497 1 1 49 GLY CA C 7.775 5.038 -6.447 1.00 . A A . 49 GLY CA 1 1 4 2498 1 1 49 GLY H H 6.307 4.415 -5.064 1.00 . A A . 49 GLY H 1 1 4 2499 1 1 49 GLY HA2 H 8.784 5.443 -6.392 1.00 . A A . 49 GLY HA2 1 1 4 2500 1 1 49 GLY HA3 H 7.149 5.743 -6.980 1.00 . A A . 49 GLY HA3 1 1 4 2501 1 1 49 GLY N N 7.208 4.874 -5.114 1.00 . A A . 49 GLY N 1 1 4 2502 1 1 49 GLY O O 8.183 3.769 -8.432 1.00 . A A . 49 GLY O 1 1 4 2503 1 1 50 GLY C C 8.770 0.711 -7.355 1.00 . A A . 50 GLY C 1 1 4 2504 1 1 50 GLY CA C 7.373 1.319 -7.272 1.00 . A A . 50 GLY CA 1 1 4 2505 1 1 50 GLY H H 7.093 2.700 -5.695 1.00 . A A . 50 GLY H 1 1 4 2506 1 1 50 GLY HA2 H 6.942 1.393 -8.269 1.00 . A A . 50 GLY HA2 1 1 4 2507 1 1 50 GLY HA3 H 6.745 0.679 -6.657 1.00 . A A . 50 GLY HA3 1 1 4 2508 1 1 50 GLY N N 7.399 2.627 -6.653 1.00 . A A . 50 GLY N 1 1 4 2509 1 1 50 GLY O O 9.328 0.571 -8.450 1.00 . A A . 50 GLY O 1 1 4 2510 1 1 51 CYS C C 11.684 0.832 -5.986 1.00 . A A . 51 CYS C 1 1 4 2511 1 1 51 CYS CA C 10.607 -0.250 -5.909 1.00 . A A . 51 CYS CA 1 1 4 2512 1 1 51 CYS CB C 10.948 -1.459 -6.785 1.00 . A A . 51 CYS CB 1 1 4 2513 1 1 51 CYS H H 8.718 0.522 -5.378 1.00 . A A . 51 CYS H 1 1 4 2514 1 1 51 CYS HA H 10.612 -0.593 -4.876 1.00 . A A . 51 CYS HA 1 1 4 2515 1 1 51 CYS HB2 H 10.651 -1.260 -7.804 1.00 . A A . 51 CYS HB2 1 1 4 2516 1 1 51 CYS HB3 H 12.028 -1.530 -6.813 1.00 . A A . 51 CYS HB3 1 1 4 2517 1 1 51 CYS N N 9.270 0.281 -6.191 1.00 . A A . 51 CYS N 1 1 4 2518 1 1 51 CYS O O 12.856 0.495 -5.716 1.00 . A A . 51 CYS O 1 1 4 2519 1 1 51 CYS OXT O 11.331 2.018 -6.136 1.00 . A A . 51 CYS OXT 1 1 4 2520 1 1 51 CYS SG S 10.314 -3.071 -6.251 1.00 . A A . 51 CYS SG 1 1 5 2521 1 1 1 GLY C C -7.768 -5.697 -0.947 1.00 . A A . 1 GLY C 1 1 5 2522 1 1 1 GLY CA C -7.560 -6.965 -1.749 1.00 . A A . 1 GLY CA 1 1 5 2523 1 1 1 GLY H1 H -8.623 -6.163 -3.279 1.00 . A A . 1 GLY H1 1 1 5 2524 1 1 1 GLY H2 H -7.002 -6.123 -3.520 1.00 . A A . 1 GLY H2 1 1 5 2525 1 1 1 GLY H3 H -7.825 -7.551 -3.695 1.00 . A A . 1 GLY H3 1 1 5 2526 1 1 1 GLY HA2 H -6.545 -7.331 -1.599 1.00 . A A . 1 GLY HA2 1 1 5 2527 1 1 1 GLY HA3 H -8.270 -7.716 -1.423 1.00 . A A . 1 GLY HA3 1 1 5 2528 1 1 1 GLY N N -7.768 -6.689 -3.173 1.00 . A A . 1 GLY N 1 1 5 2529 1 1 1 GLY O O -8.157 -4.681 -1.511 1.00 . A A . 1 GLY O 1 1 5 2530 1 1 2 GLU C C -7.072 -3.322 0.787 1.00 . A A . 2 GLU C 1 1 5 2531 1 1 2 GLU CA C -7.749 -4.601 1.267 1.00 . A A . 2 GLU CA 1 1 5 2532 1 1 2 GLU CB C -7.136 -4.925 2.624 1.00 . A A . 2 GLU CB 1 1 5 2533 1 1 2 GLU CD C -9.274 -5.294 3.973 1.00 . A A . 2 GLU CD 1 1 5 2534 1 1 2 GLU CG C -7.949 -5.881 3.471 1.00 . A A . 2 GLU CG 1 1 5 2535 1 1 2 GLU H H -7.208 -6.603 0.774 1.00 . A A . 2 GLU H 1 1 5 2536 1 1 2 GLU HA H -8.820 -4.421 1.369 1.00 . A A . 2 GLU HA 1 1 5 2537 1 1 2 GLU HB2 H -6.145 -5.356 2.477 1.00 . A A . 2 GLU HB2 1 1 5 2538 1 1 2 GLU HB3 H -7.002 -4.015 3.195 1.00 . A A . 2 GLU HB3 1 1 5 2539 1 1 2 GLU HG2 H -8.119 -6.815 2.934 1.00 . A A . 2 GLU HG2 1 1 5 2540 1 1 2 GLU HG3 H -7.292 -6.063 4.304 1.00 . A A . 2 GLU HG3 1 1 5 2541 1 1 2 GLU N N -7.521 -5.734 0.365 1.00 . A A . 2 GLU N 1 1 5 2542 1 1 2 GLU O O -7.644 -2.238 0.862 1.00 . A A . 2 GLU O 1 1 5 2543 1 1 2 GLU OE1 O -9.303 -4.138 4.449 1.00 . A A . 2 GLU OE1 1 1 5 2544 1 1 2 GLU OE2 O -10.320 -5.977 3.858 1.00 . A A . 2 GLU OE2 1 1 5 2545 1 1 3 CYS C C -5.770 -1.669 -1.380 1.00 . A A . 3 CYS C 1 1 5 2546 1 1 3 CYS CA C -5.073 -2.312 -0.168 1.00 . A A . 3 CYS CA 1 1 5 2547 1 1 3 CYS CB C -3.619 -2.694 -0.438 1.00 . A A . 3 CYS CB 1 1 5 2548 1 1 3 CYS H H -5.468 -4.396 0.376 1.00 . A A . 3 CYS H 1 1 5 2549 1 1 3 CYS HA H -5.065 -1.566 0.626 1.00 . A A . 3 CYS HA 1 1 5 2550 1 1 3 CYS HB2 H -3.191 -3.113 0.472 1.00 . A A . 3 CYS HB2 1 1 5 2551 1 1 3 CYS HB3 H -3.593 -3.457 -1.213 1.00 . A A . 3 CYS HB3 1 1 5 2552 1 1 3 CYS N N -5.831 -3.454 0.328 1.00 . A A . 3 CYS N 1 1 5 2553 1 1 3 CYS O O -6.025 -0.461 -1.351 1.00 . A A . 3 CYS O 1 1 5 2554 1 1 3 CYS SG S -2.616 -1.272 -0.947 1.00 . A A . 3 CYS SG 1 1 5 2555 1 1 4 GLU C C -8.288 -1.376 -2.988 1.00 . A A . 4 GLU C 1 1 5 2556 1 1 4 GLU CA C -6.978 -1.965 -3.511 1.00 . A A . 4 GLU CA 1 1 5 2557 1 1 4 GLU CB C -7.318 -3.085 -4.508 1.00 . A A . 4 GLU CB 1 1 5 2558 1 1 4 GLU CD C -6.438 -4.789 -6.161 1.00 . A A . 4 GLU CD 1 1 5 2559 1 1 4 GLU CG C -6.115 -3.548 -5.330 1.00 . A A . 4 GLU CG 1 1 5 2560 1 1 4 GLU H H -5.895 -3.435 -2.387 1.00 . A A . 4 GLU H 1 1 5 2561 1 1 4 GLU HA H -6.437 -1.180 -4.037 1.00 . A A . 4 GLU HA 1 1 5 2562 1 1 4 GLU HB2 H -7.729 -3.930 -3.959 1.00 . A A . 4 GLU HB2 1 1 5 2563 1 1 4 GLU HB3 H -8.083 -2.728 -5.200 1.00 . A A . 4 GLU HB3 1 1 5 2564 1 1 4 GLU HG2 H -5.790 -2.735 -5.981 1.00 . A A . 4 GLU HG2 1 1 5 2565 1 1 4 GLU HG3 H -5.306 -3.799 -4.653 1.00 . A A . 4 GLU HG3 1 1 5 2566 1 1 4 GLU N N -6.147 -2.452 -2.400 1.00 . A A . 4 GLU N 1 1 5 2567 1 1 4 GLU O O -8.734 -0.335 -3.462 1.00 . A A . 4 GLU O 1 1 5 2568 1 1 4 GLU OE1 O -6.759 -5.843 -5.566 1.00 . A A . 4 GLU OE1 1 1 5 2569 1 1 4 GLU OE2 O -6.298 -4.763 -7.408 1.00 . A A . 4 GLU OE2 1 1 5 2570 1 1 5 GLN C C -10.094 -0.328 -0.673 1.00 . A A . 5 GLN C 1 1 5 2571 1 1 5 GLN CA C -10.180 -1.658 -1.430 1.00 . A A . 5 GLN CA 1 1 5 2572 1 1 5 GLN CB C -10.644 -2.809 -0.513 1.00 . A A . 5 GLN CB 1 1 5 2573 1 1 5 GLN CD C -12.935 -3.000 -1.563 1.00 . A A . 5 GLN CD 1 1 5 2574 1 1 5 GLN CG C -12.150 -2.837 -0.263 1.00 . A A . 5 GLN CG 1 1 5 2575 1 1 5 GLN H H -8.467 -2.884 -1.672 1.00 . A A . 5 GLN H 1 1 5 2576 1 1 5 GLN HA H -10.879 -1.544 -2.259 1.00 . A A . 5 GLN HA 1 1 5 2577 1 1 5 GLN HB2 H -10.391 -3.764 -0.970 1.00 . A A . 5 GLN HB2 1 1 5 2578 1 1 5 GLN HB3 H -10.136 -2.741 0.448 1.00 . A A . 5 GLN HB3 1 1 5 2579 1 1 5 GLN HE21 H -14.019 -1.313 -1.220 1.00 . A A . 5 GLN HE21 1 1 5 2580 1 1 5 GLN HE22 H -14.238 -2.054 -2.800 1.00 . A A . 5 GLN HE22 1 1 5 2581 1 1 5 GLN HG2 H -12.376 -3.678 0.388 1.00 . A A . 5 GLN HG2 1 1 5 2582 1 1 5 GLN HG3 H -12.437 -1.929 0.256 1.00 . A A . 5 GLN HG3 1 1 5 2583 1 1 5 GLN N N -8.899 -2.027 -2.001 1.00 . A A . 5 GLN N 1 1 5 2584 1 1 5 GLN NE2 N -13.828 -2.075 -1.865 1.00 . A A . 5 GLN NE2 1 1 5 2585 1 1 5 GLN O O -11.116 0.331 -0.479 1.00 . A A . 5 GLN O 1 1 5 2586 1 1 5 GLN OE1 O -12.732 -3.956 -2.314 1.00 . A A . 5 GLN OE1 1 1 5 2587 1 1 6 CYS C C -8.507 2.440 -0.678 1.00 . A A . 6 CYS C 1 1 5 2588 1 1 6 CYS CA C -8.674 1.376 0.403 1.00 . A A . 6 CYS CA 1 1 5 2589 1 1 6 CYS CB C -7.451 1.302 1.315 1.00 . A A . 6 CYS CB 1 1 5 2590 1 1 6 CYS H H -8.124 -0.559 -0.325 1.00 . A A . 6 CYS H 1 1 5 2591 1 1 6 CYS HA H -9.533 1.645 1.017 1.00 . A A . 6 CYS HA 1 1 5 2592 1 1 6 CYS HB2 H -7.576 0.434 1.960 1.00 . A A . 6 CYS HB2 1 1 5 2593 1 1 6 CYS HB3 H -6.549 1.161 0.721 1.00 . A A . 6 CYS HB3 1 1 5 2594 1 1 6 CYS N N -8.910 0.077 -0.210 1.00 . A A . 6 CYS N 1 1 5 2595 1 1 6 CYS O O -9.098 3.513 -0.575 1.00 . A A . 6 CYS O 1 1 5 2596 1 1 6 CYS SG S -7.264 2.769 2.361 1.00 . A A . 6 CYS SG 1 1 5 2597 1 1 7 PHE C C -9.114 3.216 -3.493 1.00 . A A . 7 PHE C 1 1 5 2598 1 1 7 PHE CA C -7.706 2.982 -2.931 1.00 . A A . 7 PHE CA 1 1 5 2599 1 1 7 PHE CB C -6.788 2.338 -3.986 1.00 . A A . 7 PHE CB 1 1 5 2600 1 1 7 PHE CD1 C -4.539 2.831 -2.937 1.00 . A A . 7 PHE CD1 1 1 5 2601 1 1 7 PHE CD2 C -4.981 3.651 -5.187 1.00 . A A . 7 PHE CD2 1 1 5 2602 1 1 7 PHE CE1 C -3.296 3.479 -2.961 1.00 . A A . 7 PHE CE1 1 1 5 2603 1 1 7 PHE CE2 C -3.721 4.266 -5.225 1.00 . A A . 7 PHE CE2 1 1 5 2604 1 1 7 PHE CG C -5.401 2.944 -4.043 1.00 . A A . 7 PHE CG 1 1 5 2605 1 1 7 PHE CZ C -2.894 4.197 -4.099 1.00 . A A . 7 PHE CZ 1 1 5 2606 1 1 7 PHE H H -7.326 1.216 -1.782 1.00 . A A . 7 PHE H 1 1 5 2607 1 1 7 PHE HA H -7.298 3.954 -2.631 1.00 . A A . 7 PHE HA 1 1 5 2608 1 1 7 PHE HB2 H -6.690 1.265 -3.807 1.00 . A A . 7 PHE HB2 1 1 5 2609 1 1 7 PHE HB3 H -7.254 2.456 -4.964 1.00 . A A . 7 PHE HB3 1 1 5 2610 1 1 7 PHE HD1 H -4.831 2.278 -2.054 1.00 . A A . 7 PHE HD1 1 1 5 2611 1 1 7 PHE HD2 H -5.622 3.755 -6.046 1.00 . A A . 7 PHE HD2 1 1 5 2612 1 1 7 PHE HE1 H -2.652 3.455 -2.098 1.00 . A A . 7 PHE HE1 1 1 5 2613 1 1 7 PHE HE2 H -3.411 4.815 -6.104 1.00 . A A . 7 PHE HE2 1 1 5 2614 1 1 7 PHE HZ H -1.949 4.716 -4.094 1.00 . A A . 7 PHE HZ 1 1 5 2615 1 1 7 PHE N N -7.769 2.128 -1.747 1.00 . A A . 7 PHE N 1 1 5 2616 1 1 7 PHE O O -9.453 4.338 -3.886 1.00 . A A . 7 PHE O 1 1 5 2617 1 1 8 SER C C -12.132 3.156 -3.086 1.00 . A A . 8 SER C 1 1 5 2618 1 1 8 SER CA C -11.320 2.196 -3.960 1.00 . A A . 8 SER CA 1 1 5 2619 1 1 8 SER CB C -11.867 0.764 -3.955 1.00 . A A . 8 SER CB 1 1 5 2620 1 1 8 SER H H -9.554 1.271 -3.251 1.00 . A A . 8 SER H 1 1 5 2621 1 1 8 SER HA H -11.330 2.567 -4.987 1.00 . A A . 8 SER HA 1 1 5 2622 1 1 8 SER HB2 H -11.164 0.119 -4.485 1.00 . A A . 8 SER HB2 1 1 5 2623 1 1 8 SER HB3 H -11.979 0.406 -2.931 1.00 . A A . 8 SER HB3 1 1 5 2624 1 1 8 SER HG H -13.811 0.868 -3.937 1.00 . A A . 8 SER HG 1 1 5 2625 1 1 8 SER N N -9.943 2.171 -3.513 1.00 . A A . 8 SER N 1 1 5 2626 1 1 8 SER O O -12.880 3.968 -3.633 1.00 . A A . 8 SER O 1 1 5 2627 1 1 8 SER OG O -13.113 0.694 -4.615 1.00 . A A . 8 SER OG 1 1 5 2628 1 1 9 ASP C C -11.754 5.421 -0.805 1.00 . A A . 9 ASP C 1 1 5 2629 1 1 9 ASP CA C -12.620 4.149 -0.906 1.00 . A A . 9 ASP CA 1 1 5 2630 1 1 9 ASP CB C -12.897 3.546 0.490 1.00 . A A . 9 ASP CB 1 1 5 2631 1 1 9 ASP CG C -14.114 2.615 0.565 1.00 . A A . 9 ASP CG 1 1 5 2632 1 1 9 ASP H H -11.308 2.509 -1.324 1.00 . A A . 9 ASP H 1 1 5 2633 1 1 9 ASP HA H -13.582 4.427 -1.336 1.00 . A A . 9 ASP HA 1 1 5 2634 1 1 9 ASP HB2 H -12.010 3.011 0.835 1.00 . A A . 9 ASP HB2 1 1 5 2635 1 1 9 ASP HB3 H -13.090 4.353 1.197 1.00 . A A . 9 ASP HB3 1 1 5 2636 1 1 9 ASP N N -11.954 3.153 -1.759 1.00 . A A . 9 ASP N 1 1 5 2637 1 1 9 ASP O O -11.894 6.216 0.125 1.00 . A A . 9 ASP O 1 1 5 2638 1 1 9 ASP OD1 O -14.569 2.053 -0.459 1.00 . A A . 9 ASP OD1 1 1 5 2639 1 1 9 ASP OD2 O -14.564 2.326 1.696 1.00 . A A . 9 ASP OD2 1 1 5 2640 1 1 10 GLY C C -9.316 7.384 -1.163 1.00 . A A . 10 GLY C 1 1 5 2641 1 1 10 GLY CA C -10.439 7.059 -2.130 1.00 . A A . 10 GLY CA 1 1 5 2642 1 1 10 GLY H H -10.961 5.071 -2.611 1.00 . A A . 10 GLY H 1 1 5 2643 1 1 10 GLY HA2 H -11.188 7.839 -2.056 1.00 . A A . 10 GLY HA2 1 1 5 2644 1 1 10 GLY HA3 H -10.037 7.076 -3.140 1.00 . A A . 10 GLY HA3 1 1 5 2645 1 1 10 GLY N N -11.070 5.774 -1.896 1.00 . A A . 10 GLY N 1 1 5 2646 1 1 10 GLY O O -9.382 8.428 -0.503 1.00 . A A . 10 GLY O 1 1 5 2647 1 1 11 GLY C C -5.844 6.645 -1.365 1.00 . A A . 11 GLY C 1 1 5 2648 1 1 11 GLY CA C -7.034 6.813 -0.425 1.00 . A A . 11 GLY CA 1 1 5 2649 1 1 11 GLY H H -8.308 5.695 -1.669 1.00 . A A . 11 GLY H 1 1 5 2650 1 1 11 GLY HA2 H -6.936 6.107 0.396 1.00 . A A . 11 GLY HA2 1 1 5 2651 1 1 11 GLY HA3 H -7.041 7.836 -0.051 1.00 . A A . 11 GLY HA3 1 1 5 2652 1 1 11 GLY N N -8.286 6.540 -1.115 1.00 . A A . 11 GLY N 1 1 5 2653 1 1 11 GLY O O -5.974 5.985 -2.393 1.00 . A A . 11 GLY O 1 1 5 2654 1 1 12 ASP C C -2.289 6.580 -1.238 1.00 . A A . 12 ASP C 1 1 5 2655 1 1 12 ASP CA C -3.500 7.244 -1.879 1.00 . A A . 12 ASP CA 1 1 5 2656 1 1 12 ASP CB C -3.131 8.684 -2.241 1.00 . A A . 12 ASP CB 1 1 5 2657 1 1 12 ASP CG C -3.575 9.070 -3.646 1.00 . A A . 12 ASP CG 1 1 5 2658 1 1 12 ASP H H -4.679 7.767 -0.155 1.00 . A A . 12 ASP H 1 1 5 2659 1 1 12 ASP HA H -3.714 6.705 -2.804 1.00 . A A . 12 ASP HA 1 1 5 2660 1 1 12 ASP HB2 H -3.558 9.361 -1.505 1.00 . A A . 12 ASP HB2 1 1 5 2661 1 1 12 ASP HB3 H -2.045 8.808 -2.189 1.00 . A A . 12 ASP HB3 1 1 5 2662 1 1 12 ASP N N -4.686 7.216 -1.006 1.00 . A A . 12 ASP N 1 1 5 2663 1 1 12 ASP O O -1.598 5.785 -1.867 1.00 . A A . 12 ASP O 1 1 5 2664 1 1 12 ASP OD1 O -4.775 9.374 -3.841 1.00 . A A . 12 ASP OD1 1 1 5 2665 1 1 12 ASP OD2 O -2.689 9.223 -4.515 1.00 . A A . 12 ASP OD2 1 1 5 2666 1 1 13 CYS C C -1.150 6.528 2.246 1.00 . A A . 13 CYS C 1 1 5 2667 1 1 13 CYS CA C -0.935 6.266 0.770 1.00 . A A . 13 CYS CA 1 1 5 2668 1 1 13 CYS CB C 0.474 6.711 0.360 1.00 . A A . 13 CYS CB 1 1 5 2669 1 1 13 CYS H H -2.535 7.666 0.435 1.00 . A A . 13 CYS H 1 1 5 2670 1 1 13 CYS HA H -1.032 5.197 0.587 1.00 . A A . 13 CYS HA 1 1 5 2671 1 1 13 CYS HB2 H 0.631 6.418 -0.679 1.00 . A A . 13 CYS HB2 1 1 5 2672 1 1 13 CYS HB3 H 0.554 7.797 0.428 1.00 . A A . 13 CYS HB3 1 1 5 2673 1 1 13 CYS N N -1.966 6.947 -0.001 1.00 . A A . 13 CYS N 1 1 5 2674 1 1 13 CYS O O -1.309 5.590 3.023 1.00 . A A . 13 CYS O 1 1 5 2675 1 1 13 CYS SG S 1.772 5.954 1.384 1.00 . A A . 13 CYS SG 1 1 5 2676 1 1 14 THR C C -2.550 7.625 4.613 1.00 . A A . 14 THR C 1 1 5 2677 1 1 14 THR CA C -1.271 8.223 4.027 1.00 . A A . 14 THR CA 1 1 5 2678 1 1 14 THR CB C -1.224 9.763 4.085 1.00 . A A . 14 THR CB 1 1 5 2679 1 1 14 THR CG2 C -0.744 10.263 5.446 1.00 . A A . 14 THR CG2 1 1 5 2680 1 1 14 THR H H -1.125 8.548 1.956 1.00 . A A . 14 THR H 1 1 5 2681 1 1 14 THR HA H -0.428 7.823 4.587 1.00 . A A . 14 THR HA 1 1 5 2682 1 1 14 THR HB H -2.217 10.166 3.883 1.00 . A A . 14 THR HB 1 1 5 2683 1 1 14 THR HG1 H 0.539 9.862 3.236 1.00 . A A . 14 THR HG1 1 1 5 2684 1 1 14 THR HG21 H -1.419 9.915 6.228 1.00 . A A . 14 THR HG21 1 1 5 2685 1 1 14 THR HG22 H 0.261 9.901 5.660 1.00 . A A . 14 THR HG22 1 1 5 2686 1 1 14 THR HG23 H -0.742 11.353 5.452 1.00 . A A . 14 THR HG23 1 1 5 2687 1 1 14 THR N N -1.155 7.799 2.642 1.00 . A A . 14 THR N 1 1 5 2688 1 1 14 THR O O -2.504 6.826 5.550 1.00 . A A . 14 THR O 1 1 5 2689 1 1 14 THR OG1 O -0.339 10.268 3.094 1.00 . A A . 14 THR OG1 1 1 5 2690 1 1 15 THR C C -5.344 6.033 4.126 1.00 . A A . 15 THR C 1 1 5 2691 1 1 15 THR CA C -4.991 7.509 4.463 1.00 . A A . 15 THR CA 1 1 5 2692 1 1 15 THR CB C -5.926 8.609 3.888 1.00 . A A . 15 THR CB 1 1 5 2693 1 1 15 THR CG2 C -6.447 8.359 2.477 1.00 . A A . 15 THR CG2 1 1 5 2694 1 1 15 THR H H -3.649 8.467 3.124 1.00 . A A . 15 THR H 1 1 5 2695 1 1 15 THR HA H -4.953 7.613 5.547 1.00 . A A . 15 THR HA 1 1 5 2696 1 1 15 THR HB H -5.325 9.512 3.779 1.00 . A A . 15 THR HB 1 1 5 2697 1 1 15 THR HG1 H -6.814 8.572 5.637 1.00 . A A . 15 THR HG1 1 1 5 2698 1 1 15 THR HG21 H -5.613 8.129 1.816 1.00 . A A . 15 THR HG21 1 1 5 2699 1 1 15 THR HG22 H -7.160 7.539 2.461 1.00 . A A . 15 THR HG22 1 1 5 2700 1 1 15 THR HG23 H -6.946 9.259 2.114 1.00 . A A . 15 THR HG23 1 1 5 2701 1 1 15 THR N N -3.683 7.875 3.947 1.00 . A A . 15 THR N 1 1 5 2702 1 1 15 THR O O -6.511 5.667 4.001 1.00 . A A . 15 THR O 1 1 5 2703 1 1 15 THR OG1 O -7.001 8.939 4.749 1.00 . A A . 15 THR OG1 1 1 5 2704 1 1 16 CYS C C -3.106 3.043 4.594 1.00 . A A . 16 CYS C 1 1 5 2705 1 1 16 CYS CA C -4.337 3.702 3.944 1.00 . A A . 16 CYS CA 1 1 5 2706 1 1 16 CYS CB C -4.305 3.367 2.441 1.00 . A A . 16 CYS CB 1 1 5 2707 1 1 16 CYS H H -3.427 5.570 4.336 1.00 . A A . 16 CYS H 1 1 5 2708 1 1 16 CYS HA H -5.234 3.266 4.396 1.00 . A A . 16 CYS HA 1 1 5 2709 1 1 16 CYS HB2 H -3.438 3.852 1.990 1.00 . A A . 16 CYS HB2 1 1 5 2710 1 1 16 CYS HB3 H -4.171 2.289 2.329 1.00 . A A . 16 CYS HB3 1 1 5 2711 1 1 16 CYS N N -4.327 5.156 4.146 1.00 . A A . 16 CYS N 1 1 5 2712 1 1 16 CYS O O -3.064 1.818 4.718 1.00 . A A . 16 CYS O 1 1 5 2713 1 1 16 CYS SG S -5.768 3.836 1.484 1.00 . A A . 16 CYS SG 1 1 5 2714 1 1 17 PHE C C -1.329 3.391 7.278 1.00 . A A . 17 PHE C 1 1 5 2715 1 1 17 PHE CA C -0.979 3.322 5.796 1.00 . A A . 17 PHE CA 1 1 5 2716 1 1 17 PHE CB C 0.288 4.127 5.485 1.00 . A A . 17 PHE CB 1 1 5 2717 1 1 17 PHE CD1 C 1.908 2.267 5.960 1.00 . A A . 17 PHE CD1 1 1 5 2718 1 1 17 PHE CD2 C 2.197 4.353 7.159 1.00 . A A . 17 PHE CD2 1 1 5 2719 1 1 17 PHE CE1 C 2.965 1.685 6.685 1.00 . A A . 17 PHE CE1 1 1 5 2720 1 1 17 PHE CE2 C 3.284 3.789 7.853 1.00 . A A . 17 PHE CE2 1 1 5 2721 1 1 17 PHE CG C 1.507 3.587 6.203 1.00 . A A . 17 PHE CG 1 1 5 2722 1 1 17 PHE CZ C 3.665 2.454 7.624 1.00 . A A . 17 PHE CZ 1 1 5 2723 1 1 17 PHE H H -2.083 4.798 4.780 1.00 . A A . 17 PHE H 1 1 5 2724 1 1 17 PHE HA H -0.804 2.279 5.540 1.00 . A A . 17 PHE HA 1 1 5 2725 1 1 17 PHE HB2 H 0.476 4.086 4.412 1.00 . A A . 17 PHE HB2 1 1 5 2726 1 1 17 PHE HB3 H 0.123 5.166 5.765 1.00 . A A . 17 PHE HB3 1 1 5 2727 1 1 17 PHE HD1 H 1.385 1.697 5.209 1.00 . A A . 17 PHE HD1 1 1 5 2728 1 1 17 PHE HD2 H 1.898 5.372 7.375 1.00 . A A . 17 PHE HD2 1 1 5 2729 1 1 17 PHE HE1 H 3.234 0.642 6.540 1.00 . A A . 17 PHE HE1 1 1 5 2730 1 1 17 PHE HE2 H 3.792 4.373 8.606 1.00 . A A . 17 PHE HE2 1 1 5 2731 1 1 17 PHE HZ H 4.476 1.997 8.178 1.00 . A A . 17 PHE HZ 1 1 5 2732 1 1 17 PHE N N -2.093 3.812 5.003 1.00 . A A . 17 PHE N 1 1 5 2733 1 1 17 PHE O O -0.993 2.463 8.016 1.00 . A A . 17 PHE O 1 1 5 2734 1 1 18 ASN C C -1.442 4.416 10.108 1.00 . A A . 18 ASN C 1 1 5 2735 1 1 18 ASN CA C -2.546 4.633 9.064 1.00 . A A . 18 ASN CA 1 1 5 2736 1 1 18 ASN CB C -3.695 3.670 9.291 1.00 . A A . 18 ASN CB 1 1 5 2737 1 1 18 ASN CG C -4.565 4.049 10.485 1.00 . A A . 18 ASN CG 1 1 5 2738 1 1 18 ASN H H -2.183 5.216 7.053 1.00 . A A . 18 ASN H 1 1 5 2739 1 1 18 ASN HA H -2.921 5.652 9.152 1.00 . A A . 18 ASN HA 1 1 5 2740 1 1 18 ASN HB2 H -4.321 3.615 8.399 1.00 . A A . 18 ASN HB2 1 1 5 2741 1 1 18 ASN HB3 H -3.192 2.727 9.463 1.00 . A A . 18 ASN HB3 1 1 5 2742 1 1 18 ASN HD21 H -6.128 2.900 9.820 1.00 . A A . 18 ASN HD21 1 1 5 2743 1 1 18 ASN HD22 H -6.438 3.967 11.179 1.00 . A A . 18 ASN HD22 1 1 5 2744 1 1 18 ASN N N -2.043 4.445 7.699 1.00 . A A . 18 ASN N 1 1 5 2745 1 1 18 ASN ND2 N -5.793 3.570 10.507 1.00 . A A . 18 ASN ND2 1 1 5 2746 1 1 18 ASN O O -1.533 3.609 11.043 1.00 . A A . 18 ASN O 1 1 5 2747 1 1 18 ASN OD1 O -4.183 4.832 11.352 1.00 . A A . 18 ASN OD1 1 1 5 2748 1 1 19 ASN C C 1.426 3.492 10.768 1.00 . A A . 19 ASN C 1 1 5 2749 1 1 19 ASN CA C 0.998 4.912 10.378 1.00 . A A . 19 ASN CA 1 1 5 2750 1 1 19 ASN CB C 1.312 6.002 11.405 1.00 . A A . 19 ASN CB 1 1 5 2751 1 1 19 ASN CG C 2.817 6.139 11.587 1.00 . A A . 19 ASN CG 1 1 5 2752 1 1 19 ASN H H -0.376 5.690 9.025 1.00 . A A . 19 ASN H 1 1 5 2753 1 1 19 ASN HA H 1.587 5.123 9.511 1.00 . A A . 19 ASN HA 1 1 5 2754 1 1 19 ASN HB2 H 0.939 6.951 11.020 1.00 . A A . 19 ASN HB2 1 1 5 2755 1 1 19 ASN HB3 H 0.816 5.773 12.348 1.00 . A A . 19 ASN HB3 1 1 5 2756 1 1 19 ASN HD21 H 2.765 5.434 13.482 1.00 . A A . 19 ASN HD21 1 1 5 2757 1 1 19 ASN HD22 H 4.353 5.786 12.819 1.00 . A A . 19 ASN HD22 1 1 5 2758 1 1 19 ASN N N -0.328 5.071 9.828 1.00 . A A . 19 ASN N 1 1 5 2759 1 1 19 ASN ND2 N 3.343 5.891 12.772 1.00 . A A . 19 ASN ND2 1 1 5 2760 1 1 19 ASN O O 2.072 3.283 11.791 1.00 . A A . 19 ASN O 1 1 5 2761 1 1 19 ASN OD1 O 3.526 6.480 10.644 1.00 . A A . 19 ASN OD1 1 1 5 2762 1 1 20 GLY C C 0.463 0.217 10.569 1.00 . A A . 20 GLY C 1 1 5 2763 1 1 20 GLY CA C 1.554 1.137 10.029 1.00 . A A . 20 GLY CA 1 1 5 2764 1 1 20 GLY H H 0.589 2.724 9.085 1.00 . A A . 20 GLY H 1 1 5 2765 1 1 20 GLY HA2 H 2.428 1.096 10.666 1.00 . A A . 20 GLY HA2 1 1 5 2766 1 1 20 GLY HA3 H 1.849 0.782 9.045 1.00 . A A . 20 GLY HA3 1 1 5 2767 1 1 20 GLY N N 1.127 2.518 9.909 1.00 . A A . 20 GLY N 1 1 5 2768 1 1 20 GLY O O 0.731 -0.954 10.822 1.00 . A A . 20 GLY O 1 1 5 2769 1 1 21 THR C C -3.132 0.309 10.368 1.00 . A A . 21 THR C 1 1 5 2770 1 1 21 THR CA C -1.916 0.007 11.255 1.00 . A A . 21 THR CA 1 1 5 2771 1 1 21 THR CB C -2.082 0.364 12.750 1.00 . A A . 21 THR CB 1 1 5 2772 1 1 21 THR CG2 C -1.176 -0.537 13.586 1.00 . A A . 21 THR CG2 1 1 5 2773 1 1 21 THR H H -0.934 1.661 10.420 1.00 . A A . 21 THR H 1 1 5 2774 1 1 21 THR HA H -1.742 -1.068 11.180 1.00 . A A . 21 THR HA 1 1 5 2775 1 1 21 THR HB H -3.112 0.196 13.061 1.00 . A A . 21 THR HB 1 1 5 2776 1 1 21 THR HG1 H -1.819 2.243 12.277 1.00 . A A . 21 THR HG1 1 1 5 2777 1 1 21 THR HG21 H -0.147 -0.414 13.258 1.00 . A A . 21 THR HG21 1 1 5 2778 1 1 21 THR HG22 H -1.260 -0.283 14.641 1.00 . A A . 21 THR HG22 1 1 5 2779 1 1 21 THR HG23 H -1.465 -1.580 13.447 1.00 . A A . 21 THR HG23 1 1 5 2780 1 1 21 THR N N -0.764 0.713 10.713 1.00 . A A . 21 THR N 1 1 5 2781 1 1 21 THR O O -4.159 0.807 10.833 1.00 . A A . 21 THR O 1 1 5 2782 1 1 21 THR OG1 O -1.700 1.699 13.076 1.00 . A A . 21 THR OG1 1 1 5 2783 1 1 22 GLY C C -3.812 -0.743 6.905 1.00 . A A . 22 GLY C 1 1 5 2784 1 1 22 GLY CA C -3.957 0.305 8.015 1.00 . A A . 22 GLY CA 1 1 5 2785 1 1 22 GLY H H -2.092 -0.313 8.768 1.00 . A A . 22 GLY H 1 1 5 2786 1 1 22 GLY HA2 H -3.827 1.299 7.590 1.00 . A A . 22 GLY HA2 1 1 5 2787 1 1 22 GLY HA3 H -4.956 0.228 8.447 1.00 . A A . 22 GLY HA3 1 1 5 2788 1 1 22 GLY N N -2.961 0.107 9.059 1.00 . A A . 22 GLY N 1 1 5 2789 1 1 22 GLY O O -2.854 -1.518 6.906 1.00 . A A . 22 GLY O 1 1 5 2790 1 1 23 PRO C C -3.886 -2.161 4.007 1.00 . A A . 23 PRO C 1 1 5 2791 1 1 23 PRO CA C -4.979 -1.898 5.039 1.00 . A A . 23 PRO CA 1 1 5 2792 1 1 23 PRO CB C -6.305 -1.582 4.346 1.00 . A A . 23 PRO CB 1 1 5 2793 1 1 23 PRO CD C -5.660 0.308 5.629 1.00 . A A . 23 PRO CD 1 1 5 2794 1 1 23 PRO CG C -6.319 -0.061 4.308 1.00 . A A . 23 PRO CG 1 1 5 2795 1 1 23 PRO HA H -5.098 -2.794 5.643 1.00 . A A . 23 PRO HA 1 1 5 2796 1 1 23 PRO HB2 H -6.367 -2.016 3.350 1.00 . A A . 23 PRO HB2 1 1 5 2797 1 1 23 PRO HB3 H -7.134 -1.935 4.953 1.00 . A A . 23 PRO HB3 1 1 5 2798 1 1 23 PRO HD2 H -5.188 1.282 5.565 1.00 . A A . 23 PRO HD2 1 1 5 2799 1 1 23 PRO HD3 H -6.388 0.343 6.413 1.00 . A A . 23 PRO HD3 1 1 5 2800 1 1 23 PRO HG2 H -5.704 0.295 3.481 1.00 . A A . 23 PRO HG2 1 1 5 2801 1 1 23 PRO HG3 H -7.330 0.334 4.234 1.00 . A A . 23 PRO HG3 1 1 5 2802 1 1 23 PRO N N -4.724 -0.758 5.919 1.00 . A A . 23 PRO N 1 1 5 2803 1 1 23 PRO O O -3.923 -3.190 3.326 1.00 . A A . 23 PRO O 1 1 5 2804 1 1 24 CYS C C -0.431 -1.371 3.833 1.00 . A A . 24 CYS C 1 1 5 2805 1 1 24 CYS CA C -1.744 -1.444 3.045 1.00 . A A . 24 CYS CA 1 1 5 2806 1 1 24 CYS CB C -1.766 -0.499 1.842 1.00 . A A . 24 CYS CB 1 1 5 2807 1 1 24 CYS H H -3.043 -0.406 4.452 1.00 . A A . 24 CYS H 1 1 5 2808 1 1 24 CYS HA H -1.794 -2.451 2.641 1.00 . A A . 24 CYS HA 1 1 5 2809 1 1 24 CYS HB2 H -2.792 -0.210 1.615 1.00 . A A . 24 CYS HB2 1 1 5 2810 1 1 24 CYS HB3 H -1.203 0.394 2.097 1.00 . A A . 24 CYS HB3 1 1 5 2811 1 1 24 CYS N N -2.924 -1.245 3.885 1.00 . A A . 24 CYS N 1 1 5 2812 1 1 24 CYS O O 0.640 -1.296 3.234 1.00 . A A . 24 CYS O 1 1 5 2813 1 1 24 CYS SG S -1.046 -1.228 0.348 1.00 . A A . 24 CYS SG 1 1 5 2814 1 1 25 ALA C C 1.790 -2.220 5.758 1.00 . A A . 25 ALA C 1 1 5 2815 1 1 25 ALA CA C 0.688 -1.200 6.021 1.00 . A A . 25 ALA CA 1 1 5 2816 1 1 25 ALA CB C 0.270 -1.282 7.485 1.00 . A A . 25 ALA CB 1 1 5 2817 1 1 25 ALA H H -1.379 -1.526 5.627 1.00 . A A . 25 ALA H 1 1 5 2818 1 1 25 ALA HA H 1.110 -0.220 5.834 1.00 . A A . 25 ALA HA 1 1 5 2819 1 1 25 ALA HB1 H -0.235 -2.232 7.662 1.00 . A A . 25 ALA HB1 1 1 5 2820 1 1 25 ALA HB2 H -0.395 -0.455 7.729 1.00 . A A . 25 ALA HB2 1 1 5 2821 1 1 25 ALA HB3 H 1.163 -1.245 8.110 1.00 . A A . 25 ALA HB3 1 1 5 2822 1 1 25 ALA N N -0.483 -1.379 5.171 1.00 . A A . 25 ALA N 1 1 5 2823 1 1 25 ALA O O 2.969 -1.863 5.688 1.00 . A A . 25 ALA O 1 1 5 2824 1 1 26 ASN C C 3.146 -4.592 4.287 1.00 . A A . 26 ASN C 1 1 5 2825 1 1 26 ASN CA C 2.428 -4.558 5.633 1.00 . A A . 26 ASN CA 1 1 5 2826 1 1 26 ASN CB C 1.795 -5.919 5.955 1.00 . A A . 26 ASN CB 1 1 5 2827 1 1 26 ASN CG C 1.659 -6.101 7.454 1.00 . A A . 26 ASN CG 1 1 5 2828 1 1 26 ASN H H 0.449 -3.731 5.604 1.00 . A A . 26 ASN H 1 1 5 2829 1 1 26 ASN HA H 3.183 -4.324 6.393 1.00 . A A . 26 ASN HA 1 1 5 2830 1 1 26 ASN HB2 H 0.825 -6.013 5.468 1.00 . A A . 26 ASN HB2 1 1 5 2831 1 1 26 ASN HB3 H 2.447 -6.708 5.578 1.00 . A A . 26 ASN HB3 1 1 5 2832 1 1 26 ASN HD21 H -0.410 -5.978 7.455 1.00 . A A . 26 ASN HD21 1 1 5 2833 1 1 26 ASN HD22 H 0.375 -6.143 9.002 1.00 . A A . 26 ASN HD22 1 1 5 2834 1 1 26 ASN N N 1.431 -3.498 5.676 1.00 . A A . 26 ASN N 1 1 5 2835 1 1 26 ASN ND2 N 0.452 -6.078 7.991 1.00 . A A . 26 ASN ND2 1 1 5 2836 1 1 26 ASN O O 4.275 -5.079 4.224 1.00 . A A . 26 ASN O 1 1 5 2837 1 1 26 ASN OD1 O 2.669 -6.237 8.143 1.00 . A A . 26 ASN OD1 1 1 5 2838 1 1 27 CYS C C 4.390 -2.823 1.999 1.00 . A A . 27 CYS C 1 1 5 2839 1 1 27 CYS CA C 3.217 -3.812 1.942 1.00 . A A . 27 CYS CA 1 1 5 2840 1 1 27 CYS CB C 2.183 -3.499 0.854 1.00 . A A . 27 CYS CB 1 1 5 2841 1 1 27 CYS H H 1.663 -3.558 3.401 1.00 . A A . 27 CYS H 1 1 5 2842 1 1 27 CYS HA H 3.633 -4.759 1.605 1.00 . A A . 27 CYS HA 1 1 5 2843 1 1 27 CYS HB2 H 1.605 -2.590 1.050 1.00 . A A . 27 CYS HB2 1 1 5 2844 1 1 27 CYS HB3 H 2.722 -3.331 -0.077 1.00 . A A . 27 CYS HB3 1 1 5 2845 1 1 27 CYS N N 2.569 -3.992 3.242 1.00 . A A . 27 CYS N 1 1 5 2846 1 1 27 CYS O O 4.929 -2.499 0.949 1.00 . A A . 27 CYS O 1 1 5 2847 1 1 27 CYS SG S 1.137 -4.968 0.635 1.00 . A A . 27 CYS SG 1 1 5 2848 1 1 28 LEU C C 6.982 -1.683 4.063 1.00 . A A . 28 LEU C 1 1 5 2849 1 1 28 LEU CA C 5.737 -1.220 3.323 1.00 . A A . 28 LEU CA 1 1 5 2850 1 1 28 LEU CB C 5.139 -0.035 4.105 1.00 . A A . 28 LEU CB 1 1 5 2851 1 1 28 LEU CD1 C 4.244 2.171 3.360 1.00 . A A . 28 LEU CD1 1 1 5 2852 1 1 28 LEU CD2 C 3.338 0.191 2.222 1.00 . A A . 28 LEU CD2 1 1 5 2853 1 1 28 LEU CG C 3.907 0.694 3.535 1.00 . A A . 28 LEU CG 1 1 5 2854 1 1 28 LEU H H 4.255 -2.583 3.998 1.00 . A A . 28 LEU H 1 1 5 2855 1 1 28 LEU HA H 6.043 -0.867 2.338 1.00 . A A . 28 LEU HA 1 1 5 2856 1 1 28 LEU HB2 H 4.896 -0.353 5.119 1.00 . A A . 28 LEU HB2 1 1 5 2857 1 1 28 LEU HB3 H 5.947 0.685 4.227 1.00 . A A . 28 LEU HB3 1 1 5 2858 1 1 28 LEU HD11 H 4.619 2.561 4.302 1.00 . A A . 28 LEU HD11 1 1 5 2859 1 1 28 LEU HD12 H 5.009 2.278 2.591 1.00 . A A . 28 LEU HD12 1 1 5 2860 1 1 28 LEU HD13 H 3.355 2.725 3.074 1.00 . A A . 28 LEU HD13 1 1 5 2861 1 1 28 LEU HD21 H 4.116 0.180 1.468 1.00 . A A . 28 LEU HD21 1 1 5 2862 1 1 28 LEU HD22 H 2.919 -0.797 2.347 1.00 . A A . 28 LEU HD22 1 1 5 2863 1 1 28 LEU HD23 H 2.504 0.803 1.919 1.00 . A A . 28 LEU HD23 1 1 5 2864 1 1 28 LEU HG H 3.104 0.602 4.255 1.00 . A A . 28 LEU HG 1 1 5 2865 1 1 28 LEU N N 4.774 -2.309 3.179 1.00 . A A . 28 LEU N 1 1 5 2866 1 1 28 LEU O O 8.092 -1.495 3.572 1.00 . A A . 28 LEU O 1 1 5 2867 1 1 29 ALA C C 9.024 -3.141 5.729 1.00 . A A . 29 ALA C 1 1 5 2868 1 1 29 ALA CA C 7.852 -2.327 6.279 1.00 . A A . 29 ALA CA 1 1 5 2869 1 1 29 ALA CB C 7.271 -2.933 7.562 1.00 . A A . 29 ALA CB 1 1 5 2870 1 1 29 ALA H H 5.842 -2.308 5.601 1.00 . A A . 29 ALA H 1 1 5 2871 1 1 29 ALA HA H 8.222 -1.331 6.508 1.00 . A A . 29 ALA HA 1 1 5 2872 1 1 29 ALA HB1 H 8.064 -3.042 8.304 1.00 . A A . 29 ALA HB1 1 1 5 2873 1 1 29 ALA HB2 H 6.835 -3.914 7.360 1.00 . A A . 29 ALA HB2 1 1 5 2874 1 1 29 ALA HB3 H 6.500 -2.273 7.966 1.00 . A A . 29 ALA HB3 1 1 5 2875 1 1 29 ALA N N 6.793 -2.196 5.285 1.00 . A A . 29 ALA N 1 1 5 2876 1 1 29 ALA O O 10.172 -2.693 5.737 1.00 . A A . 29 ALA O 1 1 5 2877 1 1 30 GLY C C 8.816 -5.464 3.147 1.00 . A A . 30 GLY C 1 1 5 2878 1 1 30 GLY CA C 9.589 -5.130 4.404 1.00 . A A . 30 GLY CA 1 1 5 2879 1 1 30 GLY H H 7.731 -4.585 5.182 1.00 . A A . 30 GLY H 1 1 5 2880 1 1 30 GLY HA2 H 9.806 -6.036 4.959 1.00 . A A . 30 GLY HA2 1 1 5 2881 1 1 30 GLY HA3 H 10.513 -4.598 4.167 1.00 . A A . 30 GLY HA3 1 1 5 2882 1 1 30 GLY N N 8.704 -4.316 5.199 1.00 . A A . 30 GLY N 1 1 5 2883 1 1 30 GLY O O 7.868 -6.252 3.218 1.00 . A A . 30 GLY O 1 1 5 2884 1 1 31 TYR C C 9.252 -5.324 -0.432 1.00 . A A . 31 TYR C 1 1 5 2885 1 1 31 TYR CA C 8.400 -4.944 0.788 1.00 . A A . 31 TYR CA 1 1 5 2886 1 1 31 TYR CB C 7.723 -3.566 0.647 1.00 . A A . 31 TYR CB 1 1 5 2887 1 1 31 TYR CD1 C 9.952 -2.432 0.097 1.00 . A A . 31 TYR CD1 1 1 5 2888 1 1 31 TYR CD2 C 7.876 -1.488 -0.743 1.00 . A A . 31 TYR CD2 1 1 5 2889 1 1 31 TYR CE1 C 10.684 -1.483 -0.633 1.00 . A A . 31 TYR CE1 1 1 5 2890 1 1 31 TYR CE2 C 8.597 -0.588 -1.543 1.00 . A A . 31 TYR CE2 1 1 5 2891 1 1 31 TYR CG C 8.543 -2.436 0.046 1.00 . A A . 31 TYR CG 1 1 5 2892 1 1 31 TYR CZ C 10.011 -0.584 -1.491 1.00 . A A . 31 TYR CZ 1 1 5 2893 1 1 31 TYR H H 9.981 -4.243 2.026 1.00 . A A . 31 TYR H 1 1 5 2894 1 1 31 TYR HA H 7.630 -5.703 0.868 1.00 . A A . 31 TYR HA 1 1 5 2895 1 1 31 TYR HB2 H 6.861 -3.689 -0.002 1.00 . A A . 31 TYR HB2 1 1 5 2896 1 1 31 TYR HB3 H 7.341 -3.250 1.617 1.00 . A A . 31 TYR HB3 1 1 5 2897 1 1 31 TYR HD1 H 10.476 -3.227 0.615 1.00 . A A . 31 TYR HD1 1 1 5 2898 1 1 31 TYR HD2 H 6.799 -1.484 -0.735 1.00 . A A . 31 TYR HD2 1 1 5 2899 1 1 31 TYR HE1 H 11.765 -1.486 -0.578 1.00 . A A . 31 TYR HE1 1 1 5 2900 1 1 31 TYR HE2 H 8.064 0.098 -2.192 1.00 . A A . 31 TYR HE2 1 1 5 2901 1 1 31 TYR HH H 11.645 -0.062 -2.395 1.00 . A A . 31 TYR HH 1 1 5 2902 1 1 31 TYR N N 9.169 -4.846 2.023 1.00 . A A . 31 TYR N 1 1 5 2903 1 1 31 TYR O O 9.074 -4.753 -1.511 1.00 . A A . 31 TYR O 1 1 5 2904 1 1 31 TYR OH O 10.722 0.229 -2.314 1.00 . A A . 31 TYR OH 1 1 5 2905 1 1 32 PRO C C 10.333 -7.153 -2.714 1.00 . A A . 32 PRO C 1 1 5 2906 1 1 32 PRO CA C 11.022 -6.639 -1.441 1.00 . A A . 32 PRO CA 1 1 5 2907 1 1 32 PRO CB C 12.027 -7.625 -0.846 1.00 . A A . 32 PRO CB 1 1 5 2908 1 1 32 PRO CD C 10.240 -7.315 0.724 1.00 . A A . 32 PRO CD 1 1 5 2909 1 1 32 PRO CG C 11.257 -8.341 0.259 1.00 . A A . 32 PRO CG 1 1 5 2910 1 1 32 PRO HA H 11.534 -5.701 -1.653 1.00 . A A . 32 PRO HA 1 1 5 2911 1 1 32 PRO HB2 H 12.393 -8.327 -1.583 1.00 . A A . 32 PRO HB2 1 1 5 2912 1 1 32 PRO HB3 H 12.861 -7.075 -0.409 1.00 . A A . 32 PRO HB3 1 1 5 2913 1 1 32 PRO HD2 H 9.298 -7.790 1.000 1.00 . A A . 32 PRO HD2 1 1 5 2914 1 1 32 PRO HD3 H 10.665 -6.790 1.574 1.00 . A A . 32 PRO HD3 1 1 5 2915 1 1 32 PRO HG2 H 10.750 -9.219 -0.139 1.00 . A A . 32 PRO HG2 1 1 5 2916 1 1 32 PRO HG3 H 11.915 -8.588 1.086 1.00 . A A . 32 PRO HG3 1 1 5 2917 1 1 32 PRO N N 10.056 -6.395 -0.380 1.00 . A A . 32 PRO N 1 1 5 2918 1 1 32 PRO O O 10.812 -6.930 -3.829 1.00 . A A . 32 PRO O 1 1 5 2919 1 1 33 ALA C C 7.066 -7.547 -3.846 1.00 . A A . 33 ALA C 1 1 5 2920 1 1 33 ALA CA C 8.322 -8.381 -3.552 1.00 . A A . 33 ALA CA 1 1 5 2921 1 1 33 ALA CB C 7.892 -9.736 -2.995 1.00 . A A . 33 ALA CB 1 1 5 2922 1 1 33 ALA H H 8.870 -7.906 -1.580 1.00 . A A . 33 ALA H 1 1 5 2923 1 1 33 ALA HA H 8.885 -8.531 -4.474 1.00 . A A . 33 ALA HA 1 1 5 2924 1 1 33 ALA HB1 H 7.260 -10.253 -3.720 1.00 . A A . 33 ALA HB1 1 1 5 2925 1 1 33 ALA HB2 H 8.770 -10.346 -2.781 1.00 . A A . 33 ALA HB2 1 1 5 2926 1 1 33 ALA HB3 H 7.328 -9.566 -2.071 1.00 . A A . 33 ALA HB3 1 1 5 2927 1 1 33 ALA N N 9.170 -7.782 -2.536 1.00 . A A . 33 ALA N 1 1 5 2928 1 1 33 ALA O O 6.232 -7.961 -4.650 1.00 . A A . 33 ALA O 1 1 5 2929 1 1 34 GLY C C 5.096 -5.283 -4.488 1.00 . A A . 34 GLY C 1 1 5 2930 1 1 34 GLY CA C 5.579 -5.741 -3.119 1.00 . A A . 34 GLY CA 1 1 5 2931 1 1 34 GLY H H 7.621 -6.042 -2.606 1.00 . A A . 34 GLY H 1 1 5 2932 1 1 34 GLY HA2 H 5.639 -4.881 -2.463 1.00 . A A . 34 GLY HA2 1 1 5 2933 1 1 34 GLY HA3 H 4.844 -6.430 -2.709 1.00 . A A . 34 GLY HA3 1 1 5 2934 1 1 34 GLY N N 6.869 -6.417 -3.163 1.00 . A A . 34 GLY N 1 1 5 2935 1 1 34 GLY O O 3.897 -5.323 -4.744 1.00 . A A . 34 GLY O 1 1 5 2936 1 1 35 CYS C C 5.052 -5.659 -7.565 1.00 . A A . 35 CYS C 1 1 5 2937 1 1 35 CYS CA C 5.671 -4.522 -6.753 1.00 . A A . 35 CYS CA 1 1 5 2938 1 1 35 CYS CB C 6.929 -4.061 -7.478 1.00 . A A . 35 CYS CB 1 1 5 2939 1 1 35 CYS H H 6.962 -4.798 -5.070 1.00 . A A . 35 CYS H 1 1 5 2940 1 1 35 CYS HA H 4.965 -3.691 -6.717 1.00 . A A . 35 CYS HA 1 1 5 2941 1 1 35 CYS HB2 H 7.600 -4.919 -7.564 1.00 . A A . 35 CYS HB2 1 1 5 2942 1 1 35 CYS HB3 H 6.652 -3.759 -8.490 1.00 . A A . 35 CYS HB3 1 1 5 2943 1 1 35 CYS N N 6.008 -4.912 -5.388 1.00 . A A . 35 CYS N 1 1 5 2944 1 1 35 CYS O O 4.325 -5.378 -8.519 1.00 . A A . 35 CYS O 1 1 5 2945 1 1 35 CYS SG S 7.732 -2.644 -6.680 1.00 . A A . 35 CYS SG 1 1 5 2946 1 1 36 SER C C 3.286 -8.313 -7.296 1.00 . A A . 36 SER C 1 1 5 2947 1 1 36 SER CA C 4.698 -8.075 -7.850 1.00 . A A . 36 SER CA 1 1 5 2948 1 1 36 SER CB C 5.591 -9.294 -7.596 1.00 . A A . 36 SER CB 1 1 5 2949 1 1 36 SER H H 5.904 -7.096 -6.407 1.00 . A A . 36 SER H 1 1 5 2950 1 1 36 SER HA H 4.660 -7.877 -8.921 1.00 . A A . 36 SER HA 1 1 5 2951 1 1 36 SER HB2 H 6.611 -9.004 -7.837 1.00 . A A . 36 SER HB2 1 1 5 2952 1 1 36 SER HB3 H 5.549 -9.577 -6.544 1.00 . A A . 36 SER HB3 1 1 5 2953 1 1 36 SER HG H 6.047 -10.643 -8.919 1.00 . A A . 36 SER HG 1 1 5 2954 1 1 36 SER N N 5.317 -6.919 -7.215 1.00 . A A . 36 SER N 1 1 5 2955 1 1 36 SER O O 2.440 -8.917 -7.957 1.00 . A A . 36 SER O 1 1 5 2956 1 1 36 SER OG O 5.253 -10.418 -8.389 1.00 . A A . 36 SER OG 1 1 5 2957 1 1 37 ASN C C 0.786 -6.963 -5.917 1.00 . A A . 37 ASN C 1 1 5 2958 1 1 37 ASN CA C 1.746 -8.021 -5.392 1.00 . A A . 37 ASN CA 1 1 5 2959 1 1 37 ASN CB C 1.918 -7.936 -3.856 1.00 . A A . 37 ASN CB 1 1 5 2960 1 1 37 ASN CG C 1.743 -9.308 -3.246 1.00 . A A . 37 ASN CG 1 1 5 2961 1 1 37 ASN H H 3.728 -7.299 -5.616 1.00 . A A . 37 ASN H 1 1 5 2962 1 1 37 ASN HA H 1.342 -9.004 -5.637 1.00 . A A . 37 ASN HA 1 1 5 2963 1 1 37 ASN HB2 H 2.866 -7.482 -3.569 1.00 . A A . 37 ASN HB2 1 1 5 2964 1 1 37 ASN HB3 H 1.165 -7.290 -3.414 1.00 . A A . 37 ASN HB3 1 1 5 2965 1 1 37 ASN HD21 H -0.151 -8.858 -2.657 1.00 . A A . 37 ASN HD21 1 1 5 2966 1 1 37 ASN HD22 H 0.360 -10.497 -2.369 1.00 . A A . 37 ASN HD22 1 1 5 2967 1 1 37 ASN N N 3.025 -7.869 -6.064 1.00 . A A . 37 ASN N 1 1 5 2968 1 1 37 ASN ND2 N 0.556 -9.574 -2.731 1.00 . A A . 37 ASN ND2 1 1 5 2969 1 1 37 ASN O O 0.633 -5.936 -5.272 1.00 . A A . 37 ASN O 1 1 5 2970 1 1 37 ASN OD1 O 2.632 -10.159 -3.284 1.00 . A A . 37 ASN OD1 1 1 5 2971 1 1 38 SER C C -1.991 -5.771 -6.783 1.00 . A A . 38 SER C 1 1 5 2972 1 1 38 SER CA C -0.825 -6.264 -7.676 1.00 . A A . 38 SER CA 1 1 5 2973 1 1 38 SER CB C -1.328 -6.882 -8.969 1.00 . A A . 38 SER CB 1 1 5 2974 1 1 38 SER H H 0.307 -8.037 -7.569 1.00 . A A . 38 SER H 1 1 5 2975 1 1 38 SER HA H -0.262 -5.406 -8.014 1.00 . A A . 38 SER HA 1 1 5 2976 1 1 38 SER HB2 H -1.948 -7.724 -8.706 1.00 . A A . 38 SER HB2 1 1 5 2977 1 1 38 SER HB3 H -1.926 -6.150 -9.511 1.00 . A A . 38 SER HB3 1 1 5 2978 1 1 38 SER HG H -0.483 -8.154 -10.188 1.00 . A A . 38 SER HG 1 1 5 2979 1 1 38 SER N N 0.089 -7.209 -7.027 1.00 . A A . 38 SER N 1 1 5 2980 1 1 38 SER O O -2.773 -4.919 -7.206 1.00 . A A . 38 SER O 1 1 5 2981 1 1 38 SER OG O -0.243 -7.299 -9.782 1.00 . A A . 38 SER OG 1 1 5 2982 1 1 39 ASP C C -2.398 -4.478 -3.906 1.00 . A A . 39 ASP C 1 1 5 2983 1 1 39 ASP CA C -2.999 -5.757 -4.501 1.00 . A A . 39 ASP CA 1 1 5 2984 1 1 39 ASP CB C -3.129 -6.808 -3.391 1.00 . A A . 39 ASP CB 1 1 5 2985 1 1 39 ASP CG C -4.076 -6.420 -2.249 1.00 . A A . 39 ASP CG 1 1 5 2986 1 1 39 ASP H H -1.493 -7.017 -5.310 1.00 . A A . 39 ASP H 1 1 5 2987 1 1 39 ASP HA H -3.988 -5.540 -4.896 1.00 . A A . 39 ASP HA 1 1 5 2988 1 1 39 ASP HB2 H -3.497 -7.729 -3.831 1.00 . A A . 39 ASP HB2 1 1 5 2989 1 1 39 ASP HB3 H -2.141 -7.027 -2.986 1.00 . A A . 39 ASP HB3 1 1 5 2990 1 1 39 ASP N N -2.154 -6.306 -5.569 1.00 . A A . 39 ASP N 1 1 5 2991 1 1 39 ASP O O -3.108 -3.549 -3.540 1.00 . A A . 39 ASP O 1 1 5 2992 1 1 39 ASP OD1 O -5.099 -5.746 -2.501 1.00 . A A . 39 ASP OD1 1 1 5 2993 1 1 39 ASP OD2 O -3.832 -6.899 -1.115 1.00 . A A . 39 ASP OD2 1 1 5 2994 1 1 40 CYS C C 0.542 -2.580 -4.206 1.00 . A A . 40 CYS C 1 1 5 2995 1 1 40 CYS CA C -0.253 -3.397 -3.195 1.00 . A A . 40 CYS CA 1 1 5 2996 1 1 40 CYS CB C 0.666 -4.084 -2.176 1.00 . A A . 40 CYS CB 1 1 5 2997 1 1 40 CYS H H -0.560 -5.174 -4.265 1.00 . A A . 40 CYS H 1 1 5 2998 1 1 40 CYS HA H -0.897 -2.699 -2.663 1.00 . A A . 40 CYS HA 1 1 5 2999 1 1 40 CYS HB2 H 1.097 -4.998 -2.603 1.00 . A A . 40 CYS HB2 1 1 5 3000 1 1 40 CYS HB3 H 1.504 -3.432 -1.901 1.00 . A A . 40 CYS HB3 1 1 5 3001 1 1 40 CYS N N -1.071 -4.420 -3.829 1.00 . A A . 40 CYS N 1 1 5 3002 1 1 40 CYS O O 0.888 -1.443 -3.907 1.00 . A A . 40 CYS O 1 1 5 3003 1 1 40 CYS SG S -0.285 -4.457 -0.686 1.00 . A A . 40 CYS SG 1 1 5 3004 1 1 41 THR C C 1.077 -1.046 -6.710 1.00 . A A . 41 THR C 1 1 5 3005 1 1 41 THR CA C 1.562 -2.475 -6.454 1.00 . A A . 41 THR CA 1 1 5 3006 1 1 41 THR CB C 1.402 -3.360 -7.690 1.00 . A A . 41 THR CB 1 1 5 3007 1 1 41 THR CG2 C 1.999 -2.846 -8.984 1.00 . A A . 41 THR CG2 1 1 5 3008 1 1 41 THR H H 0.593 -4.092 -5.568 1.00 . A A . 41 THR H 1 1 5 3009 1 1 41 THR HA H 2.602 -2.446 -6.129 1.00 . A A . 41 THR HA 1 1 5 3010 1 1 41 THR HB H 0.334 -3.479 -7.850 1.00 . A A . 41 THR HB 1 1 5 3011 1 1 41 THR HG1 H 2.860 -4.666 -7.797 1.00 . A A . 41 THR HG1 1 1 5 3012 1 1 41 THR HG21 H 1.551 -1.886 -9.241 1.00 . A A . 41 THR HG21 1 1 5 3013 1 1 41 THR HG22 H 3.079 -2.736 -8.894 1.00 . A A . 41 THR HG22 1 1 5 3014 1 1 41 THR HG23 H 1.746 -3.579 -9.751 1.00 . A A . 41 THR HG23 1 1 5 3015 1 1 41 THR N N 0.806 -3.115 -5.396 1.00 . A A . 41 THR N 1 1 5 3016 1 1 41 THR O O 1.909 -0.141 -6.711 1.00 . A A . 41 THR O 1 1 5 3017 1 1 41 THR OG1 O 1.952 -4.634 -7.458 1.00 . A A . 41 THR OG1 1 1 5 3018 1 1 42 ALA C C -0.376 1.500 -6.124 1.00 . A A . 42 ALA C 1 1 5 3019 1 1 42 ALA CA C -0.754 0.502 -7.216 1.00 . A A . 42 ALA CA 1 1 5 3020 1 1 42 ALA CB C -2.267 0.465 -7.445 1.00 . A A . 42 ALA CB 1 1 5 3021 1 1 42 ALA H H -0.883 -1.598 -6.884 1.00 . A A . 42 ALA H 1 1 5 3022 1 1 42 ALA HA H -0.284 0.835 -8.142 1.00 . A A . 42 ALA HA 1 1 5 3023 1 1 42 ALA HB1 H -2.511 -0.209 -8.265 1.00 . A A . 42 ALA HB1 1 1 5 3024 1 1 42 ALA HB2 H -2.616 1.466 -7.703 1.00 . A A . 42 ALA HB2 1 1 5 3025 1 1 42 ALA HB3 H -2.781 0.137 -6.545 1.00 . A A . 42 ALA HB3 1 1 5 3026 1 1 42 ALA N N -0.231 -0.824 -6.903 1.00 . A A . 42 ALA N 1 1 5 3027 1 1 42 ALA O O 0.153 2.566 -6.443 1.00 . A A . 42 ALA O 1 1 5 3028 1 1 43 PHE C C 1.314 2.199 -3.784 1.00 . A A . 43 PHE C 1 1 5 3029 1 1 43 PHE CA C -0.191 1.949 -3.706 1.00 . A A . 43 PHE CA 1 1 5 3030 1 1 43 PHE CB C -0.642 1.281 -2.384 1.00 . A A . 43 PHE CB 1 1 5 3031 1 1 43 PHE CD1 C 1.187 2.051 -0.811 1.00 . A A . 43 PHE CD1 1 1 5 3032 1 1 43 PHE CD2 C -1.100 2.292 -0.071 1.00 . A A . 43 PHE CD2 1 1 5 3033 1 1 43 PHE CE1 C 1.662 2.554 0.393 1.00 . A A . 43 PHE CE1 1 1 5 3034 1 1 43 PHE CE2 C -0.625 2.731 1.183 1.00 . A A . 43 PHE CE2 1 1 5 3035 1 1 43 PHE CG C -0.186 1.928 -1.080 1.00 . A A . 43 PHE CG 1 1 5 3036 1 1 43 PHE CZ C 0.758 2.833 1.412 1.00 . A A . 43 PHE CZ 1 1 5 3037 1 1 43 PHE H H -1.003 0.224 -4.696 1.00 . A A . 43 PHE H 1 1 5 3038 1 1 43 PHE HA H -0.677 2.919 -3.781 1.00 . A A . 43 PHE HA 1 1 5 3039 1 1 43 PHE HB2 H -1.731 1.233 -2.390 1.00 . A A . 43 PHE HB2 1 1 5 3040 1 1 43 PHE HB3 H -0.289 0.252 -2.356 1.00 . A A . 43 PHE HB3 1 1 5 3041 1 1 43 PHE HD1 H 1.921 1.722 -1.500 1.00 . A A . 43 PHE HD1 1 1 5 3042 1 1 43 PHE HD2 H -2.163 2.177 -0.234 1.00 . A A . 43 PHE HD2 1 1 5 3043 1 1 43 PHE HE1 H 2.725 2.632 0.566 1.00 . A A . 43 PHE HE1 1 1 5 3044 1 1 43 PHE HE2 H -1.315 2.959 1.978 1.00 . A A . 43 PHE HE2 1 1 5 3045 1 1 43 PHE HZ H 1.195 3.078 2.359 1.00 . A A . 43 PHE HZ 1 1 5 3046 1 1 43 PHE N N -0.598 1.145 -4.853 1.00 . A A . 43 PHE N 1 1 5 3047 1 1 43 PHE O O 1.749 3.349 -3.696 1.00 . A A . 43 PHE O 1 1 5 3048 1 1 44 LEU C C 4.172 2.115 -4.884 1.00 . A A . 44 LEU C 1 1 5 3049 1 1 44 LEU CA C 3.585 1.299 -3.733 1.00 . A A . 44 LEU CA 1 1 5 3050 1 1 44 LEU CB C 4.259 -0.070 -3.639 1.00 . A A . 44 LEU CB 1 1 5 3051 1 1 44 LEU CD1 C 4.489 -2.283 -2.520 1.00 . A A . 44 LEU CD1 1 1 5 3052 1 1 44 LEU CD2 C 4.045 -0.262 -1.077 1.00 . A A . 44 LEU CD2 1 1 5 3053 1 1 44 LEU CG C 3.802 -0.917 -2.439 1.00 . A A . 44 LEU CG 1 1 5 3054 1 1 44 LEU H H 1.756 0.195 -3.793 1.00 . A A . 44 LEU H 1 1 5 3055 1 1 44 LEU HA H 3.787 1.854 -2.818 1.00 . A A . 44 LEU HA 1 1 5 3056 1 1 44 LEU HB2 H 4.066 -0.621 -4.562 1.00 . A A . 44 LEU HB2 1 1 5 3057 1 1 44 LEU HB3 H 5.330 0.085 -3.576 1.00 . A A . 44 LEU HB3 1 1 5 3058 1 1 44 LEU HD11 H 5.573 -2.165 -2.572 1.00 . A A . 44 LEU HD11 1 1 5 3059 1 1 44 LEU HD12 H 4.236 -2.890 -1.654 1.00 . A A . 44 LEU HD12 1 1 5 3060 1 1 44 LEU HD13 H 4.152 -2.800 -3.419 1.00 . A A . 44 LEU HD13 1 1 5 3061 1 1 44 LEU HD21 H 3.648 0.745 -0.985 1.00 . A A . 44 LEU HD21 1 1 5 3062 1 1 44 LEU HD22 H 3.516 -0.853 -0.333 1.00 . A A . 44 LEU HD22 1 1 5 3063 1 1 44 LEU HD23 H 5.104 -0.240 -0.855 1.00 . A A . 44 LEU HD23 1 1 5 3064 1 1 44 LEU HG H 2.736 -1.091 -2.493 1.00 . A A . 44 LEU HG 1 1 5 3065 1 1 44 LEU N N 2.137 1.144 -3.854 1.00 . A A . 44 LEU N 1 1 5 3066 1 1 44 LEU O O 5.086 2.911 -4.657 1.00 . A A . 44 LEU O 1 1 5 3067 1 1 45 SER C C 3.746 4.307 -6.837 1.00 . A A . 45 SER C 1 1 5 3068 1 1 45 SER CA C 3.896 2.833 -7.222 1.00 . A A . 45 SER CA 1 1 5 3069 1 1 45 SER CB C 3.005 2.402 -8.388 1.00 . A A . 45 SER CB 1 1 5 3070 1 1 45 SER H H 2.868 1.297 -6.192 1.00 . A A . 45 SER H 1 1 5 3071 1 1 45 SER HA H 4.928 2.648 -7.501 1.00 . A A . 45 SER HA 1 1 5 3072 1 1 45 SER HB2 H 2.974 1.317 -8.414 1.00 . A A . 45 SER HB2 1 1 5 3073 1 1 45 SER HB3 H 1.989 2.760 -8.243 1.00 . A A . 45 SER HB3 1 1 5 3074 1 1 45 SER HG H 2.955 2.418 -10.317 1.00 . A A . 45 SER HG 1 1 5 3075 1 1 45 SER N N 3.603 1.991 -6.080 1.00 . A A . 45 SER N 1 1 5 3076 1 1 45 SER O O 4.656 5.096 -7.096 1.00 . A A . 45 SER O 1 1 5 3077 1 1 45 SER OG O 3.506 2.854 -9.630 1.00 . A A . 45 SER OG 1 1 5 3078 1 1 46 GLN C C 3.585 6.311 -4.534 1.00 . A A . 46 GLN C 1 1 5 3079 1 1 46 GLN CA C 2.510 6.007 -5.587 1.00 . A A . 46 GLN CA 1 1 5 3080 1 1 46 GLN CB C 1.106 6.264 -5.005 1.00 . A A . 46 GLN CB 1 1 5 3081 1 1 46 GLN CD C 0.115 5.980 -7.365 1.00 . A A . 46 GLN CD 1 1 5 3082 1 1 46 GLN CG C -0.083 5.816 -5.861 1.00 . A A . 46 GLN CG 1 1 5 3083 1 1 46 GLN H H 1.969 3.957 -5.926 1.00 . A A . 46 GLN H 1 1 5 3084 1 1 46 GLN HA H 2.652 6.697 -6.417 1.00 . A A . 46 GLN HA 1 1 5 3085 1 1 46 GLN HB2 H 1.010 5.786 -4.031 1.00 . A A . 46 GLN HB2 1 1 5 3086 1 1 46 GLN HB3 H 1.009 7.332 -4.836 1.00 . A A . 46 GLN HB3 1 1 5 3087 1 1 46 GLN HE21 H -0.083 3.994 -7.637 1.00 . A A . 46 GLN HE21 1 1 5 3088 1 1 46 GLN HE22 H 0.164 4.924 -9.113 1.00 . A A . 46 GLN HE22 1 1 5 3089 1 1 46 GLN HG2 H -0.294 4.780 -5.633 1.00 . A A . 46 GLN HG2 1 1 5 3090 1 1 46 GLN HG3 H -0.954 6.384 -5.555 1.00 . A A . 46 GLN HG3 1 1 5 3091 1 1 46 GLN N N 2.666 4.665 -6.134 1.00 . A A . 46 GLN N 1 1 5 3092 1 1 46 GLN NE2 N 0.072 4.887 -8.108 1.00 . A A . 46 GLN NE2 1 1 5 3093 1 1 46 GLN O O 4.330 7.281 -4.691 1.00 . A A . 46 GLN O 1 1 5 3094 1 1 46 GLN OE1 O 0.341 7.078 -7.874 1.00 . A A . 46 GLN OE1 1 1 5 3095 1 1 47 CYS C C 5.749 5.672 -2.081 1.00 . A A . 47 CYS C 1 1 5 3096 1 1 47 CYS CA C 4.250 5.970 -2.186 1.00 . A A . 47 CYS CA 1 1 5 3097 1 1 47 CYS CB C 3.507 5.350 -0.998 1.00 . A A . 47 CYS CB 1 1 5 3098 1 1 47 CYS H H 2.988 4.750 -3.432 1.00 . A A . 47 CYS H 1 1 5 3099 1 1 47 CYS HA H 4.127 7.052 -2.123 1.00 . A A . 47 CYS HA 1 1 5 3100 1 1 47 CYS HB2 H 2.469 5.172 -1.283 1.00 . A A . 47 CYS HB2 1 1 5 3101 1 1 47 CYS HB3 H 3.961 4.393 -0.726 1.00 . A A . 47 CYS HB3 1 1 5 3102 1 1 47 CYS N N 3.630 5.537 -3.443 1.00 . A A . 47 CYS N 1 1 5 3103 1 1 47 CYS O O 6.423 6.191 -1.189 1.00 . A A . 47 CYS O 1 1 5 3104 1 1 47 CYS SG S 3.496 6.445 0.445 1.00 . A A . 47 CYS SG 1 1 5 3105 1 1 48 TYR C C 8.254 5.045 -4.435 1.00 . A A . 48 TYR C 1 1 5 3106 1 1 48 TYR CA C 7.717 4.554 -3.086 1.00 . A A . 48 TYR CA 1 1 5 3107 1 1 48 TYR CB C 7.961 3.055 -2.919 1.00 . A A . 48 TYR CB 1 1 5 3108 1 1 48 TYR CD1 C 6.742 2.136 -0.899 1.00 . A A . 48 TYR CD1 1 1 5 3109 1 1 48 TYR CD2 C 9.129 2.525 -0.739 1.00 . A A . 48 TYR CD2 1 1 5 3110 1 1 48 TYR CE1 C 6.760 1.582 0.392 1.00 . A A . 48 TYR CE1 1 1 5 3111 1 1 48 TYR CE2 C 9.143 2.007 0.566 1.00 . A A . 48 TYR CE2 1 1 5 3112 1 1 48 TYR CG C 7.936 2.594 -1.477 1.00 . A A . 48 TYR CG 1 1 5 3113 1 1 48 TYR CZ C 7.954 1.525 1.141 1.00 . A A . 48 TYR CZ 1 1 5 3114 1 1 48 TYR H H 5.667 4.385 -3.627 1.00 . A A . 48 TYR H 1 1 5 3115 1 1 48 TYR HA H 8.282 5.044 -2.292 1.00 . A A . 48 TYR HA 1 1 5 3116 1 1 48 TYR HB2 H 7.235 2.474 -3.486 1.00 . A A . 48 TYR HB2 1 1 5 3117 1 1 48 TYR HB3 H 8.931 2.823 -3.351 1.00 . A A . 48 TYR HB3 1 1 5 3118 1 1 48 TYR HD1 H 5.827 2.147 -1.472 1.00 . A A . 48 TYR HD1 1 1 5 3119 1 1 48 TYR HD2 H 10.062 2.792 -1.205 1.00 . A A . 48 TYR HD2 1 1 5 3120 1 1 48 TYR HE1 H 5.865 1.150 0.793 1.00 . A A . 48 TYR HE1 1 1 5 3121 1 1 48 TYR HE2 H 10.076 1.938 1.101 1.00 . A A . 48 TYR HE2 1 1 5 3122 1 1 48 TYR HH H 8.377 0.144 2.438 1.00 . A A . 48 TYR HH 1 1 5 3123 1 1 48 TYR N N 6.287 4.832 -2.960 1.00 . A A . 48 TYR N 1 1 5 3124 1 1 48 TYR O O 9.464 5.216 -4.592 1.00 . A A . 48 TYR O 1 1 5 3125 1 1 48 TYR OH O 7.953 1.018 2.403 1.00 . A A . 48 TYR OH 1 1 5 3126 1 1 49 GLY C C 7.658 4.109 -7.559 1.00 . A A . 49 GLY C 1 1 5 3127 1 1 49 GLY CA C 7.717 5.438 -6.808 1.00 . A A . 49 GLY CA 1 1 5 3128 1 1 49 GLY H H 6.396 5.059 -5.225 1.00 . A A . 49 GLY H 1 1 5 3129 1 1 49 GLY HA2 H 8.730 5.825 -6.876 1.00 . A A . 49 GLY HA2 1 1 5 3130 1 1 49 GLY HA3 H 7.033 6.149 -7.270 1.00 . A A . 49 GLY HA3 1 1 5 3131 1 1 49 GLY N N 7.366 5.261 -5.407 1.00 . A A . 49 GLY N 1 1 5 3132 1 1 49 GLY O O 7.804 4.085 -8.782 1.00 . A A . 49 GLY O 1 1 5 3133 1 1 50 GLY C C 9.100 1.306 -6.731 1.00 . A A . 50 GLY C 1 1 5 3134 1 1 50 GLY CA C 7.722 1.662 -7.281 1.00 . A A . 50 GLY CA 1 1 5 3135 1 1 50 GLY H H 7.261 3.124 -5.858 1.00 . A A . 50 GLY H 1 1 5 3136 1 1 50 GLY HA2 H 7.749 1.611 -8.370 1.00 . A A . 50 GLY HA2 1 1 5 3137 1 1 50 GLY HA3 H 6.968 0.970 -6.901 1.00 . A A . 50 GLY HA3 1 1 5 3138 1 1 50 GLY N N 7.411 3.008 -6.847 1.00 . A A . 50 GLY N 1 1 5 3139 1 1 50 GLY O O 10.018 2.131 -6.759 1.00 . A A . 50 GLY O 1 1 5 3140 1 1 51 CYS C C 11.327 -0.716 -7.145 1.00 . A A . 51 CYS C 1 1 5 3141 1 1 51 CYS CA C 10.497 -0.523 -5.886 1.00 . A A . 51 CYS CA 1 1 5 3142 1 1 51 CYS CB C 10.310 -1.874 -5.185 1.00 . A A . 51 CYS CB 1 1 5 3143 1 1 51 CYS H H 8.425 -0.523 -6.174 1.00 . A A . 51 CYS H 1 1 5 3144 1 1 51 CYS HA H 11.032 0.148 -5.217 1.00 . A A . 51 CYS HA 1 1 5 3145 1 1 51 CYS HB2 H 11.311 -2.187 -4.891 1.00 . A A . 51 CYS HB2 1 1 5 3146 1 1 51 CYS HB3 H 9.736 -1.717 -4.275 1.00 . A A . 51 CYS HB3 1 1 5 3147 1 1 51 CYS N N 9.220 0.091 -6.195 1.00 . A A . 51 CYS N 1 1 5 3148 1 1 51 CYS O O 12.543 -0.945 -6.974 1.00 . A A . 51 CYS O 1 1 5 3149 1 1 51 CYS OXT O 10.739 -0.770 -8.248 1.00 . A A . 51 CYS OXT 1 1 5 3150 1 1 51 CYS SG S 9.605 -3.247 -6.158 1.00 . A A . 51 CYS SG 1 1 6 3151 1 1 1 GLY C C -7.643 -5.657 -0.595 1.00 . A A . 1 GLY C 1 1 6 3152 1 1 1 GLY CA C -7.382 -6.866 -1.476 1.00 . A A . 1 GLY CA 1 1 6 3153 1 1 1 GLY H1 H -8.363 -6.050 -3.063 1.00 . A A . 1 GLY H1 1 1 6 3154 1 1 1 GLY H2 H -6.748 -5.802 -3.088 1.00 . A A . 1 GLY H2 1 1 6 3155 1 1 1 GLY H3 H -7.341 -7.279 -3.502 1.00 . A A . 1 GLY H3 1 1 6 3156 1 1 1 GLY HA2 H -6.388 -7.253 -1.271 1.00 . A A . 1 GLY HA2 1 1 6 3157 1 1 1 GLY HA3 H -8.124 -7.630 -1.260 1.00 . A A . 1 GLY HA3 1 1 6 3158 1 1 1 GLY N N -7.467 -6.487 -2.891 1.00 . A A . 1 GLY N 1 1 6 3159 1 1 1 GLY O O -8.309 -4.716 -1.015 1.00 . A A . 1 GLY O 1 1 6 3160 1 1 2 GLU C C -6.804 -3.220 0.981 1.00 . A A . 2 GLU C 1 1 6 3161 1 1 2 GLU CA C -7.370 -4.523 1.550 1.00 . A A . 2 GLU CA 1 1 6 3162 1 1 2 GLU CB C -7.025 -4.807 3.018 1.00 . A A . 2 GLU CB 1 1 6 3163 1 1 2 GLU CD C -6.102 -6.905 4.083 1.00 . A A . 2 GLU CD 1 1 6 3164 1 1 2 GLU CG C -5.772 -5.629 3.299 1.00 . A A . 2 GLU CG 1 1 6 3165 1 1 2 GLU H H -6.623 -6.451 0.981 1.00 . A A . 2 GLU H 1 1 6 3166 1 1 2 GLU HA H -8.425 -4.349 1.608 1.00 . A A . 2 GLU HA 1 1 6 3167 1 1 2 GLU HB2 H -6.959 -3.858 3.550 1.00 . A A . 2 GLU HB2 1 1 6 3168 1 1 2 GLU HB3 H -7.866 -5.351 3.439 1.00 . A A . 2 GLU HB3 1 1 6 3169 1 1 2 GLU HG2 H -5.294 -5.888 2.359 1.00 . A A . 2 GLU HG2 1 1 6 3170 1 1 2 GLU HG3 H -5.102 -5.006 3.874 1.00 . A A . 2 GLU HG3 1 1 6 3171 1 1 2 GLU N N -7.164 -5.661 0.651 1.00 . A A . 2 GLU N 1 1 6 3172 1 1 2 GLU O O -7.453 -2.182 1.110 1.00 . A A . 2 GLU O 1 1 6 3173 1 1 2 GLU OE1 O -6.684 -7.837 3.483 1.00 . A A . 2 GLU OE1 1 1 6 3174 1 1 2 GLU OE2 O -5.833 -6.996 5.300 1.00 . A A . 2 GLU OE2 1 1 6 3175 1 1 3 CYS C C -5.887 -1.495 -1.421 1.00 . A A . 3 CYS C 1 1 6 3176 1 1 3 CYS CA C -5.065 -2.059 -0.257 1.00 . A A . 3 CYS CA 1 1 6 3177 1 1 3 CYS CB C -3.625 -2.363 -0.641 1.00 . A A . 3 CYS CB 1 1 6 3178 1 1 3 CYS H H -5.259 -4.160 0.046 1.00 . A A . 3 CYS H 1 1 6 3179 1 1 3 CYS HA H -5.047 -1.315 0.541 1.00 . A A . 3 CYS HA 1 1 6 3180 1 1 3 CYS HB2 H -3.143 -2.855 0.199 1.00 . A A . 3 CYS HB2 1 1 6 3181 1 1 3 CYS HB3 H -3.619 -3.047 -1.484 1.00 . A A . 3 CYS HB3 1 1 6 3182 1 1 3 CYS N N -5.676 -3.267 0.270 1.00 . A A . 3 CYS N 1 1 6 3183 1 1 3 CYS O O -6.148 -0.292 -1.450 1.00 . A A . 3 CYS O 1 1 6 3184 1 1 3 CYS SG S -2.645 -0.910 -1.051 1.00 . A A . 3 CYS SG 1 1 6 3185 1 1 4 GLU C C -8.567 -1.373 -2.753 1.00 . A A . 4 GLU C 1 1 6 3186 1 1 4 GLU CA C -7.307 -1.967 -3.381 1.00 . A A . 4 GLU CA 1 1 6 3187 1 1 4 GLU CB C -7.721 -3.179 -4.218 1.00 . A A . 4 GLU CB 1 1 6 3188 1 1 4 GLU CD C -7.289 -4.742 -6.118 1.00 . A A . 4 GLU CD 1 1 6 3189 1 1 4 GLU CG C -6.738 -3.565 -5.316 1.00 . A A . 4 GLU CG 1 1 6 3190 1 1 4 GLU H H -6.038 -3.318 -2.303 1.00 . A A . 4 GLU H 1 1 6 3191 1 1 4 GLU HA H -6.864 -1.217 -4.036 1.00 . A A . 4 GLU HA 1 1 6 3192 1 1 4 GLU HB2 H -7.882 -4.023 -3.556 1.00 . A A . 4 GLU HB2 1 1 6 3193 1 1 4 GLU HB3 H -8.664 -2.957 -4.710 1.00 . A A . 4 GLU HB3 1 1 6 3194 1 1 4 GLU HG2 H -6.601 -2.709 -5.974 1.00 . A A . 4 GLU HG2 1 1 6 3195 1 1 4 GLU HG3 H -5.780 -3.838 -4.878 1.00 . A A . 4 GLU HG3 1 1 6 3196 1 1 4 GLU N N -6.343 -2.347 -2.346 1.00 . A A . 4 GLU N 1 1 6 3197 1 1 4 GLU O O -9.054 -0.339 -3.206 1.00 . A A . 4 GLU O 1 1 6 3198 1 1 4 GLU OE1 O -7.324 -5.876 -5.585 1.00 . A A . 4 GLU OE1 1 1 6 3199 1 1 4 GLU OE2 O -7.672 -4.583 -7.295 1.00 . A A . 4 GLU OE2 1 1 6 3200 1 1 5 GLN C C -10.260 -0.238 -0.477 1.00 . A A . 5 GLN C 1 1 6 3201 1 1 5 GLN CA C -10.371 -1.618 -1.125 1.00 . A A . 5 GLN CA 1 1 6 3202 1 1 5 GLN CB C -10.847 -2.697 -0.136 1.00 . A A . 5 GLN CB 1 1 6 3203 1 1 5 GLN CD C -13.292 -2.415 -0.727 1.00 . A A . 5 GLN CD 1 1 6 3204 1 1 5 GLN CG C -12.266 -2.461 0.397 1.00 . A A . 5 GLN CG 1 1 6 3205 1 1 5 GLN H H -8.665 -2.875 -1.390 1.00 . A A . 5 GLN H 1 1 6 3206 1 1 5 GLN HA H -11.081 -1.532 -1.946 1.00 . A A . 5 GLN HA 1 1 6 3207 1 1 5 GLN HB2 H -10.836 -3.664 -0.640 1.00 . A A . 5 GLN HB2 1 1 6 3208 1 1 5 GLN HB3 H -10.158 -2.741 0.709 1.00 . A A . 5 GLN HB3 1 1 6 3209 1 1 5 GLN HE21 H -13.018 -0.429 -1.026 1.00 . A A . 5 GLN HE21 1 1 6 3210 1 1 5 GLN HE22 H -13.997 -1.301 -2.215 1.00 . A A . 5 GLN HE22 1 1 6 3211 1 1 5 GLN HG2 H -12.526 -3.288 1.056 1.00 . A A . 5 GLN HG2 1 1 6 3212 1 1 5 GLN HG3 H -12.303 -1.541 0.981 1.00 . A A . 5 GLN HG3 1 1 6 3213 1 1 5 GLN N N -9.108 -2.023 -1.718 1.00 . A A . 5 GLN N 1 1 6 3214 1 1 5 GLN NE2 N -13.564 -1.247 -1.293 1.00 . A A . 5 GLN NE2 1 1 6 3215 1 1 5 GLN O O -11.233 0.526 -0.521 1.00 . A A . 5 GLN O 1 1 6 3216 1 1 5 GLN OE1 O -13.858 -3.432 -1.106 1.00 . A A . 5 GLN OE1 1 1 6 3217 1 1 6 CYS C C -8.735 2.381 -0.651 1.00 . A A . 6 CYS C 1 1 6 3218 1 1 6 CYS CA C -8.767 1.427 0.538 1.00 . A A . 6 CYS CA 1 1 6 3219 1 1 6 CYS CB C -7.434 1.423 1.284 1.00 . A A . 6 CYS CB 1 1 6 3220 1 1 6 CYS H H -8.377 -0.631 0.139 1.00 . A A . 6 CYS H 1 1 6 3221 1 1 6 CYS HA H -9.548 1.760 1.216 1.00 . A A . 6 CYS HA 1 1 6 3222 1 1 6 CYS HB2 H -7.510 0.695 2.088 1.00 . A A . 6 CYS HB2 1 1 6 3223 1 1 6 CYS HB3 H -6.631 1.121 0.612 1.00 . A A . 6 CYS HB3 1 1 6 3224 1 1 6 CYS N N -9.095 0.086 0.089 1.00 . A A . 6 CYS N 1 1 6 3225 1 1 6 CYS O O -9.429 3.396 -0.637 1.00 . A A . 6 CYS O 1 1 6 3226 1 1 6 CYS SG S -7.025 3.035 2.002 1.00 . A A . 6 CYS SG 1 1 6 3227 1 1 7 PHE C C -9.285 3.197 -3.431 1.00 . A A . 7 PHE C 1 1 6 3228 1 1 7 PHE CA C -7.889 2.804 -2.938 1.00 . A A . 7 PHE CA 1 1 6 3229 1 1 7 PHE CB C -7.099 2.010 -3.999 1.00 . A A . 7 PHE CB 1 1 6 3230 1 1 7 PHE CD1 C -4.766 2.738 -3.364 1.00 . A A . 7 PHE CD1 1 1 6 3231 1 1 7 PHE CD2 C -5.475 3.014 -5.677 1.00 . A A . 7 PHE CD2 1 1 6 3232 1 1 7 PHE CE1 C -3.533 3.321 -3.684 1.00 . A A . 7 PHE CE1 1 1 6 3233 1 1 7 PHE CE2 C -4.230 3.588 -5.990 1.00 . A A . 7 PHE CE2 1 1 6 3234 1 1 7 PHE CG C -5.753 2.604 -4.357 1.00 . A A . 7 PHE CG 1 1 6 3235 1 1 7 PHE CZ C -3.263 3.761 -4.988 1.00 . A A . 7 PHE CZ 1 1 6 3236 1 1 7 PHE H H -7.461 1.166 -1.648 1.00 . A A . 7 PHE H 1 1 6 3237 1 1 7 PHE HA H -7.349 3.725 -2.725 1.00 . A A . 7 PHE HA 1 1 6 3238 1 1 7 PHE HB2 H -6.917 0.998 -3.645 1.00 . A A . 7 PHE HB2 1 1 6 3239 1 1 7 PHE HB3 H -7.696 1.917 -4.904 1.00 . A A . 7 PHE HB3 1 1 6 3240 1 1 7 PHE HD1 H -4.942 2.419 -2.348 1.00 . A A . 7 PHE HD1 1 1 6 3241 1 1 7 PHE HD2 H -6.218 2.927 -6.455 1.00 . A A . 7 PHE HD2 1 1 6 3242 1 1 7 PHE HE1 H -2.797 3.447 -2.909 1.00 . A A . 7 PHE HE1 1 1 6 3243 1 1 7 PHE HE2 H -4.027 3.930 -6.991 1.00 . A A . 7 PHE HE2 1 1 6 3244 1 1 7 PHE HZ H -2.320 4.244 -5.209 1.00 . A A . 7 PHE HZ 1 1 6 3245 1 1 7 PHE N N -7.976 2.040 -1.697 1.00 . A A . 7 PHE N 1 1 6 3246 1 1 7 PHE O O -9.517 4.369 -3.717 1.00 . A A . 7 PHE O 1 1 6 3247 1 1 8 SER C C -12.379 3.455 -3.121 1.00 . A A . 8 SER C 1 1 6 3248 1 1 8 SER CA C -11.572 2.496 -3.998 1.00 . A A . 8 SER CA 1 1 6 3249 1 1 8 SER CB C -12.320 1.169 -4.149 1.00 . A A . 8 SER CB 1 1 6 3250 1 1 8 SER H H -9.950 1.286 -3.315 1.00 . A A . 8 SER H 1 1 6 3251 1 1 8 SER HA H -11.498 2.977 -4.971 1.00 . A A . 8 SER HA 1 1 6 3252 1 1 8 SER HB2 H -12.312 0.625 -3.202 1.00 . A A . 8 SER HB2 1 1 6 3253 1 1 8 SER HB3 H -13.349 1.379 -4.434 1.00 . A A . 8 SER HB3 1 1 6 3254 1 1 8 SER HG H -11.646 0.936 -5.946 1.00 . A A . 8 SER HG 1 1 6 3255 1 1 8 SER N N -10.218 2.246 -3.523 1.00 . A A . 8 SER N 1 1 6 3256 1 1 8 SER O O -13.322 4.069 -3.627 1.00 . A A . 8 SER O 1 1 6 3257 1 1 8 SER OG O -11.728 0.372 -5.155 1.00 . A A . 8 SER OG 1 1 6 3258 1 1 9 ASP C C -11.741 5.817 -0.766 1.00 . A A . 9 ASP C 1 1 6 3259 1 1 9 ASP CA C -12.656 4.599 -0.948 1.00 . A A . 9 ASP CA 1 1 6 3260 1 1 9 ASP CB C -13.077 3.928 0.366 1.00 . A A . 9 ASP CB 1 1 6 3261 1 1 9 ASP CG C -13.884 4.887 1.243 1.00 . A A . 9 ASP CG 1 1 6 3262 1 1 9 ASP H H -11.212 3.148 -1.482 1.00 . A A . 9 ASP H 1 1 6 3263 1 1 9 ASP HA H -13.571 4.975 -1.403 1.00 . A A . 9 ASP HA 1 1 6 3264 1 1 9 ASP HB2 H -13.700 3.062 0.142 1.00 . A A . 9 ASP HB2 1 1 6 3265 1 1 9 ASP HB3 H -12.190 3.585 0.901 1.00 . A A . 9 ASP HB3 1 1 6 3266 1 1 9 ASP N N -12.033 3.628 -1.847 1.00 . A A . 9 ASP N 1 1 6 3267 1 1 9 ASP O O -11.595 6.353 0.334 1.00 . A A . 9 ASP O 1 1 6 3268 1 1 9 ASP OD1 O -14.822 5.554 0.737 1.00 . A A . 9 ASP OD1 1 1 6 3269 1 1 9 ASP OD2 O -13.599 5.005 2.452 1.00 . A A . 9 ASP OD2 1 1 6 3270 1 1 10 GLY C C -8.973 7.321 -1.172 1.00 . A A . 10 GLY C 1 1 6 3271 1 1 10 GLY CA C -10.313 7.485 -1.885 1.00 . A A . 10 GLY CA 1 1 6 3272 1 1 10 GLY H H -11.165 5.724 -2.711 1.00 . A A . 10 GLY H 1 1 6 3273 1 1 10 GLY HA2 H -10.874 8.297 -1.422 1.00 . A A . 10 GLY HA2 1 1 6 3274 1 1 10 GLY HA3 H -10.117 7.752 -2.924 1.00 . A A . 10 GLY HA3 1 1 6 3275 1 1 10 GLY N N -11.110 6.264 -1.856 1.00 . A A . 10 GLY N 1 1 6 3276 1 1 10 GLY O O -8.447 8.288 -0.614 1.00 . A A . 10 GLY O 1 1 6 3277 1 1 11 GLY C C -6.034 6.355 -1.623 1.00 . A A . 11 GLY C 1 1 6 3278 1 1 11 GLY CA C -7.092 5.830 -0.658 1.00 . A A . 11 GLY CA 1 1 6 3279 1 1 11 GLY H H -8.932 5.344 -1.587 1.00 . A A . 11 GLY H 1 1 6 3280 1 1 11 GLY HA2 H -6.993 4.751 -0.602 1.00 . A A . 11 GLY HA2 1 1 6 3281 1 1 11 GLY HA3 H -6.971 6.266 0.333 1.00 . A A . 11 GLY HA3 1 1 6 3282 1 1 11 GLY N N -8.423 6.111 -1.164 1.00 . A A . 11 GLY N 1 1 6 3283 1 1 11 GLY O O -6.247 6.286 -2.838 1.00 . A A . 11 GLY O 1 1 6 3284 1 1 12 ASP C C -2.499 6.577 -1.447 1.00 . A A . 12 ASP C 1 1 6 3285 1 1 12 ASP CA C -3.771 7.293 -1.930 1.00 . A A . 12 ASP CA 1 1 6 3286 1 1 12 ASP CB C -3.570 8.819 -1.974 1.00 . A A . 12 ASP CB 1 1 6 3287 1 1 12 ASP CG C -3.856 9.573 -0.669 1.00 . A A . 12 ASP CG 1 1 6 3288 1 1 12 ASP H H -4.809 6.921 -0.106 1.00 . A A . 12 ASP H 1 1 6 3289 1 1 12 ASP HA H -3.926 6.950 -2.955 1.00 . A A . 12 ASP HA 1 1 6 3290 1 1 12 ASP HB2 H -2.567 9.043 -2.328 1.00 . A A . 12 ASP HB2 1 1 6 3291 1 1 12 ASP HB3 H -4.253 9.202 -2.733 1.00 . A A . 12 ASP HB3 1 1 6 3292 1 1 12 ASP N N -4.925 6.903 -1.111 1.00 . A A . 12 ASP N 1 1 6 3293 1 1 12 ASP O O -2.208 5.468 -1.869 1.00 . A A . 12 ASP O 1 1 6 3294 1 1 12 ASP OD1 O -3.245 9.275 0.388 1.00 . A A . 12 ASP OD1 1 1 6 3295 1 1 12 ASP OD2 O -4.602 10.575 -0.711 1.00 . A A . 12 ASP OD2 1 1 6 3296 1 1 13 CYS C C -0.405 7.104 1.465 1.00 . A A . 13 CYS C 1 1 6 3297 1 1 13 CYS CA C -0.458 6.741 -0.012 1.00 . A A . 13 CYS CA 1 1 6 3298 1 1 13 CYS CB C 0.700 7.393 -0.771 1.00 . A A . 13 CYS CB 1 1 6 3299 1 1 13 CYS H H -2.096 8.076 -0.199 1.00 . A A . 13 CYS H 1 1 6 3300 1 1 13 CYS HA H -0.374 5.666 -0.130 1.00 . A A . 13 CYS HA 1 1 6 3301 1 1 13 CYS HB2 H 0.841 6.863 -1.712 1.00 . A A . 13 CYS HB2 1 1 6 3302 1 1 13 CYS HB3 H 0.413 8.409 -1.016 1.00 . A A . 13 CYS HB3 1 1 6 3303 1 1 13 CYS N N -1.737 7.193 -0.545 1.00 . A A . 13 CYS N 1 1 6 3304 1 1 13 CYS O O -0.081 6.261 2.307 1.00 . A A . 13 CYS O 1 1 6 3305 1 1 13 CYS SG S 2.289 7.512 0.103 1.00 . A A . 13 CYS SG 1 1 6 3306 1 1 14 THR C C -2.047 7.833 3.780 1.00 . A A . 14 THR C 1 1 6 3307 1 1 14 THR CA C -0.952 8.724 3.192 1.00 . A A . 14 THR CA 1 1 6 3308 1 1 14 THR CB C -1.314 10.212 3.334 1.00 . A A . 14 THR CB 1 1 6 3309 1 1 14 THR CG2 C -1.168 10.654 4.788 1.00 . A A . 14 THR CG2 1 1 6 3310 1 1 14 THR H H -0.991 9.030 1.095 1.00 . A A . 14 THR H 1 1 6 3311 1 1 14 THR HA H -0.013 8.545 3.717 1.00 . A A . 14 THR HA 1 1 6 3312 1 1 14 THR HB H -2.344 10.372 3.016 1.00 . A A . 14 THR HB 1 1 6 3313 1 1 14 THR HG1 H -0.977 11.277 1.762 1.00 . A A . 14 THR HG1 1 1 6 3314 1 1 14 THR HG21 H -0.156 10.436 5.129 1.00 . A A . 14 THR HG21 1 1 6 3315 1 1 14 THR HG22 H -1.347 11.723 4.856 1.00 . A A . 14 THR HG22 1 1 6 3316 1 1 14 THR HG23 H -1.885 10.135 5.424 1.00 . A A . 14 THR HG23 1 1 6 3317 1 1 14 THR N N -0.762 8.347 1.805 1.00 . A A . 14 THR N 1 1 6 3318 1 1 14 THR O O -1.817 7.152 4.781 1.00 . A A . 14 THR O 1 1 6 3319 1 1 14 THR OG1 O -0.463 11.032 2.557 1.00 . A A . 14 THR OG1 1 1 6 3320 1 1 15 THR C C -4.852 5.999 3.644 1.00 . A A . 15 THR C 1 1 6 3321 1 1 15 THR CA C -4.454 7.470 3.882 1.00 . A A . 15 THR CA 1 1 6 3322 1 1 15 THR CB C -5.501 8.570 3.567 1.00 . A A . 15 THR CB 1 1 6 3323 1 1 15 THR CG2 C -6.361 8.376 2.316 1.00 . A A . 15 THR CG2 1 1 6 3324 1 1 15 THR H H -3.344 8.341 2.292 1.00 . A A . 15 THR H 1 1 6 3325 1 1 15 THR HA H -4.237 7.549 4.949 1.00 . A A . 15 THR HA 1 1 6 3326 1 1 15 THR HB H -4.943 9.491 3.387 1.00 . A A . 15 THR HB 1 1 6 3327 1 1 15 THR HG1 H -7.222 8.962 4.409 1.00 . A A . 15 THR HG1 1 1 6 3328 1 1 15 THR HG21 H -5.725 8.150 1.463 1.00 . A A . 15 THR HG21 1 1 6 3329 1 1 15 THR HG22 H -7.087 7.573 2.455 1.00 . A A . 15 THR HG22 1 1 6 3330 1 1 15 THR HG23 H -6.908 9.296 2.106 1.00 . A A . 15 THR HG23 1 1 6 3331 1 1 15 THR N N -3.235 7.826 3.164 1.00 . A A . 15 THR N 1 1 6 3332 1 1 15 THR O O -6.029 5.653 3.649 1.00 . A A . 15 THR O 1 1 6 3333 1 1 15 THR OG1 O -6.298 8.827 4.709 1.00 . A A . 15 THR OG1 1 1 6 3334 1 1 16 CYS C C -2.930 2.999 4.414 1.00 . A A . 16 CYS C 1 1 6 3335 1 1 16 CYS CA C -4.032 3.647 3.576 1.00 . A A . 16 CYS CA 1 1 6 3336 1 1 16 CYS CB C -4.011 3.080 2.145 1.00 . A A . 16 CYS CB 1 1 6 3337 1 1 16 CYS H H -2.920 5.461 3.653 1.00 . A A . 16 CYS H 1 1 6 3338 1 1 16 CYS HA H -4.983 3.385 4.053 1.00 . A A . 16 CYS HA 1 1 6 3339 1 1 16 CYS HB2 H -3.065 3.336 1.682 1.00 . A A . 16 CYS HB2 1 1 6 3340 1 1 16 CYS HB3 H -4.064 1.994 2.196 1.00 . A A . 16 CYS HB3 1 1 6 3341 1 1 16 CYS N N -3.861 5.104 3.560 1.00 . A A . 16 CYS N 1 1 6 3342 1 1 16 CYS O O -2.538 1.860 4.137 1.00 . A A . 16 CYS O 1 1 6 3343 1 1 16 CYS SG S -5.326 3.628 1.050 1.00 . A A . 16 CYS SG 1 1 6 3344 1 1 17 PHE C C -1.612 3.153 7.687 1.00 . A A . 17 PHE C 1 1 6 3345 1 1 17 PHE CA C -1.269 3.238 6.208 1.00 . A A . 17 PHE CA 1 1 6 3346 1 1 17 PHE CB C -0.023 4.109 5.999 1.00 . A A . 17 PHE CB 1 1 6 3347 1 1 17 PHE CD1 C 1.533 2.183 6.490 1.00 . A A . 17 PHE CD1 1 1 6 3348 1 1 17 PHE CD2 C 2.103 4.346 7.403 1.00 . A A . 17 PHE CD2 1 1 6 3349 1 1 17 PHE CE1 C 2.642 1.603 7.109 1.00 . A A . 17 PHE CE1 1 1 6 3350 1 1 17 PHE CE2 C 3.233 3.773 8.021 1.00 . A A . 17 PHE CE2 1 1 6 3351 1 1 17 PHE CG C 1.235 3.545 6.640 1.00 . A A . 17 PHE CG 1 1 6 3352 1 1 17 PHE CZ C 3.494 2.397 7.888 1.00 . A A . 17 PHE CZ 1 1 6 3353 1 1 17 PHE H H -2.811 4.608 5.639 1.00 . A A . 17 PHE H 1 1 6 3354 1 1 17 PHE HA H -1.034 2.229 5.886 1.00 . A A . 17 PHE HA 1 1 6 3355 1 1 17 PHE HB2 H 0.166 4.227 4.931 1.00 . A A . 17 PHE HB2 1 1 6 3356 1 1 17 PHE HB3 H -0.232 5.088 6.421 1.00 . A A . 17 PHE HB3 1 1 6 3357 1 1 17 PHE HD1 H 0.892 1.568 5.894 1.00 . A A . 17 PHE HD1 1 1 6 3358 1 1 17 PHE HD2 H 1.897 5.399 7.527 1.00 . A A . 17 PHE HD2 1 1 6 3359 1 1 17 PHE HE1 H 2.818 0.545 6.981 1.00 . A A . 17 PHE HE1 1 1 6 3360 1 1 17 PHE HE2 H 3.903 4.386 8.604 1.00 . A A . 17 PHE HE2 1 1 6 3361 1 1 17 PHE HZ H 4.334 1.933 8.385 1.00 . A A . 17 PHE HZ 1 1 6 3362 1 1 17 PHE N N -2.382 3.719 5.399 1.00 . A A . 17 PHE N 1 1 6 3363 1 1 17 PHE O O -1.161 2.214 8.345 1.00 . A A . 17 PHE O 1 1 6 3364 1 1 18 ASN C C -1.568 4.132 10.561 1.00 . A A . 18 ASN C 1 1 6 3365 1 1 18 ASN CA C -2.783 4.173 9.626 1.00 . A A . 18 ASN CA 1 1 6 3366 1 1 18 ASN CB C -3.770 3.033 9.899 1.00 . A A . 18 ASN CB 1 1 6 3367 1 1 18 ASN CG C -4.581 3.170 11.179 1.00 . A A . 18 ASN CG 1 1 6 3368 1 1 18 ASN H H -2.807 4.803 7.602 1.00 . A A . 18 ASN H 1 1 6 3369 1 1 18 ASN HA H -3.272 5.132 9.802 1.00 . A A . 18 ASN HA 1 1 6 3370 1 1 18 ASN HB2 H -4.475 2.959 9.070 1.00 . A A . 18 ASN HB2 1 1 6 3371 1 1 18 ASN HB3 H -3.180 2.116 9.951 1.00 . A A . 18 ASN HB3 1 1 6 3372 1 1 18 ASN HD21 H -5.226 1.261 10.988 1.00 . A A . 18 ASN HD21 1 1 6 3373 1 1 18 ASN HD22 H -5.893 2.101 12.342 1.00 . A A . 18 ASN HD22 1 1 6 3374 1 1 18 ASN N N -2.402 4.099 8.213 1.00 . A A . 18 ASN N 1 1 6 3375 1 1 18 ASN ND2 N -5.339 2.138 11.494 1.00 . A A . 18 ASN ND2 1 1 6 3376 1 1 18 ASN O O -1.655 3.682 11.699 1.00 . A A . 18 ASN O 1 1 6 3377 1 1 18 ASN OD1 O -4.573 4.184 11.882 1.00 . A A . 18 ASN OD1 1 1 6 3378 1 1 19 ASN C C 1.175 2.909 11.062 1.00 . A A . 19 ASN C 1 1 6 3379 1 1 19 ASN CA C 0.901 4.355 10.640 1.00 . A A . 19 ASN CA 1 1 6 3380 1 1 19 ASN CB C 1.287 5.399 11.685 1.00 . A A . 19 ASN CB 1 1 6 3381 1 1 19 ASN CG C 2.808 5.408 11.825 1.00 . A A . 19 ASN CG 1 1 6 3382 1 1 19 ASN H H -0.450 5.058 9.178 1.00 . A A . 19 ASN H 1 1 6 3383 1 1 19 ASN HA H 1.568 4.527 9.814 1.00 . A A . 19 ASN HA 1 1 6 3384 1 1 19 ASN HB2 H 0.917 6.373 11.358 1.00 . A A . 19 ASN HB2 1 1 6 3385 1 1 19 ASN HB3 H 0.832 5.155 12.645 1.00 . A A . 19 ASN HB3 1 1 6 3386 1 1 19 ASN HD21 H 3.086 6.557 10.150 1.00 . A A . 19 ASN HD21 1 1 6 3387 1 1 19 ASN HD22 H 4.529 6.036 10.974 1.00 . A A . 19 ASN HD22 1 1 6 3388 1 1 19 ASN N N -0.416 4.587 10.073 1.00 . A A . 19 ASN N 1 1 6 3389 1 1 19 ASN ND2 N 3.517 6.017 10.887 1.00 . A A . 19 ASN ND2 1 1 6 3390 1 1 19 ASN O O 1.419 2.626 12.233 1.00 . A A . 19 ASN O 1 1 6 3391 1 1 19 ASN OD1 O 3.385 4.872 12.765 1.00 . A A . 19 ASN OD1 1 1 6 3392 1 1 20 GLY C C 0.587 -0.323 10.831 1.00 . A A . 20 GLY C 1 1 6 3393 1 1 20 GLY CA C 1.637 0.633 10.267 1.00 . A A . 20 GLY CA 1 1 6 3394 1 1 20 GLY H H 0.875 2.271 9.159 1.00 . A A . 20 GLY H 1 1 6 3395 1 1 20 GLY HA2 H 2.513 0.656 10.908 1.00 . A A . 20 GLY HA2 1 1 6 3396 1 1 20 GLY HA3 H 1.969 0.256 9.306 1.00 . A A . 20 GLY HA3 1 1 6 3397 1 1 20 GLY N N 1.140 1.992 10.094 1.00 . A A . 20 GLY N 1 1 6 3398 1 1 20 GLY O O 0.924 -1.342 11.429 1.00 . A A . 20 GLY O 1 1 6 3399 1 1 21 THR C C -3.066 -0.540 10.396 1.00 . A A . 21 THR C 1 1 6 3400 1 1 21 THR CA C -1.802 -0.758 11.255 1.00 . A A . 21 THR CA 1 1 6 3401 1 1 21 THR CB C -1.860 -0.499 12.774 1.00 . A A . 21 THR CB 1 1 6 3402 1 1 21 THR CG2 C -1.974 0.975 13.064 1.00 . A A . 21 THR CG2 1 1 6 3403 1 1 21 THR H H -0.921 0.855 10.182 1.00 . A A . 21 THR H 1 1 6 3404 1 1 21 THR HA H -1.562 -1.795 11.207 1.00 . A A . 21 THR HA 1 1 6 3405 1 1 21 THR HB H -0.918 -0.830 13.198 1.00 . A A . 21 THR HB 1 1 6 3406 1 1 21 THR HG1 H -2.940 -0.819 14.350 1.00 . A A . 21 THR HG1 1 1 6 3407 1 1 21 THR HG21 H -2.848 1.350 12.547 1.00 . A A . 21 THR HG21 1 1 6 3408 1 1 21 THR HG22 H -2.031 1.147 14.133 1.00 . A A . 21 THR HG22 1 1 6 3409 1 1 21 THR HG23 H -1.074 1.442 12.684 1.00 . A A . 21 THR HG23 1 1 6 3410 1 1 21 THR N N -0.696 -0.001 10.673 1.00 . A A . 21 THR N 1 1 6 3411 1 1 21 THR O O -4.164 -0.300 10.900 1.00 . A A . 21 THR O 1 1 6 3412 1 1 21 THR OG1 O -2.875 -1.200 13.456 1.00 . A A . 21 THR OG1 1 1 6 3413 1 1 22 GLY C C -3.719 -0.968 6.790 1.00 . A A . 22 GLY C 1 1 6 3414 1 1 22 GLY CA C -3.901 -0.160 8.082 1.00 . A A . 22 GLY CA 1 1 6 3415 1 1 22 GLY H H -1.980 -0.737 8.708 1.00 . A A . 22 GLY H 1 1 6 3416 1 1 22 GLY HA2 H -3.844 0.905 7.861 1.00 . A A . 22 GLY HA2 1 1 6 3417 1 1 22 GLY HA3 H -4.887 -0.387 8.490 1.00 . A A . 22 GLY HA3 1 1 6 3418 1 1 22 GLY N N -2.883 -0.486 9.072 1.00 . A A . 22 GLY N 1 1 6 3419 1 1 22 GLY O O -2.799 -1.777 6.684 1.00 . A A . 22 GLY O 1 1 6 3420 1 1 23 PRO C C -3.900 -2.001 3.701 1.00 . A A . 23 PRO C 1 1 6 3421 1 1 23 PRO CA C -4.963 -1.699 4.760 1.00 . A A . 23 PRO CA 1 1 6 3422 1 1 23 PRO CB C -6.204 -1.086 4.111 1.00 . A A . 23 PRO CB 1 1 6 3423 1 1 23 PRO CD C -5.274 0.525 5.601 1.00 . A A . 23 PRO CD 1 1 6 3424 1 1 23 PRO CG C -6.006 0.415 4.275 1.00 . A A . 23 PRO CG 1 1 6 3425 1 1 23 PRO HA H -5.236 -2.638 5.244 1.00 . A A . 23 PRO HA 1 1 6 3426 1 1 23 PRO HB2 H -6.279 -1.347 3.061 1.00 . A A . 23 PRO HB2 1 1 6 3427 1 1 23 PRO HB3 H -7.095 -1.408 4.647 1.00 . A A . 23 PRO HB3 1 1 6 3428 1 1 23 PRO HD2 H -4.590 1.370 5.595 1.00 . A A . 23 PRO HD2 1 1 6 3429 1 1 23 PRO HD3 H -5.982 0.657 6.401 1.00 . A A . 23 PRO HD3 1 1 6 3430 1 1 23 PRO HG2 H -5.365 0.781 3.476 1.00 . A A . 23 PRO HG2 1 1 6 3431 1 1 23 PRO HG3 H -6.954 0.952 4.296 1.00 . A A . 23 PRO HG3 1 1 6 3432 1 1 23 PRO N N -4.561 -0.722 5.775 1.00 . A A . 23 PRO N 1 1 6 3433 1 1 23 PRO O O -4.049 -2.937 2.915 1.00 . A A . 23 PRO O 1 1 6 3434 1 1 24 CYS C C -0.380 -1.642 3.672 1.00 . A A . 24 CYS C 1 1 6 3435 1 1 24 CYS CA C -1.659 -1.525 2.831 1.00 . A A . 24 CYS CA 1 1 6 3436 1 1 24 CYS CB C -1.540 -0.487 1.704 1.00 . A A . 24 CYS CB 1 1 6 3437 1 1 24 CYS H H -2.823 -0.433 4.304 1.00 . A A . 24 CYS H 1 1 6 3438 1 1 24 CYS HA H -1.805 -2.495 2.354 1.00 . A A . 24 CYS HA 1 1 6 3439 1 1 24 CYS HB2 H -2.505 -0.001 1.553 1.00 . A A . 24 CYS HB2 1 1 6 3440 1 1 24 CYS HB3 H -0.832 0.275 2.003 1.00 . A A . 24 CYS HB3 1 1 6 3441 1 1 24 CYS N N -2.822 -1.222 3.665 1.00 . A A . 24 CYS N 1 1 6 3442 1 1 24 CYS O O 0.697 -1.821 3.116 1.00 . A A . 24 CYS O 1 1 6 3443 1 1 24 CYS SG S -0.988 -1.128 0.106 1.00 . A A . 24 CYS SG 1 1 6 3444 1 1 25 ALA C C 1.795 -2.339 5.742 1.00 . A A . 25 ALA C 1 1 6 3445 1 1 25 ALA CA C 0.684 -1.311 5.871 1.00 . A A . 25 ALA CA 1 1 6 3446 1 1 25 ALA CB C 0.228 -1.236 7.328 1.00 . A A . 25 ALA CB 1 1 6 3447 1 1 25 ALA H H -1.377 -1.583 5.442 1.00 . A A . 25 ALA H 1 1 6 3448 1 1 25 ALA HA H 1.120 -0.366 5.574 1.00 . A A . 25 ALA HA 1 1 6 3449 1 1 25 ALA HB1 H -0.304 -2.153 7.593 1.00 . A A . 25 ALA HB1 1 1 6 3450 1 1 25 ALA HB2 H -0.418 -0.371 7.469 1.00 . A A . 25 ALA HB2 1 1 6 3451 1 1 25 ALA HB3 H 1.104 -1.156 7.967 1.00 . A A . 25 ALA HB3 1 1 6 3452 1 1 25 ALA N N -0.463 -1.557 5.005 1.00 . A A . 25 ALA N 1 1 6 3453 1 1 25 ALA O O 2.977 -1.976 5.770 1.00 . A A . 25 ALA O 1 1 6 3454 1 1 26 ASN C C 3.132 -4.724 4.208 1.00 . A A . 26 ASN C 1 1 6 3455 1 1 26 ASN CA C 2.454 -4.656 5.577 1.00 . A A . 26 ASN CA 1 1 6 3456 1 1 26 ASN CB C 1.879 -6.005 6.045 1.00 . A A . 26 ASN CB 1 1 6 3457 1 1 26 ASN CG C 1.764 -6.049 7.570 1.00 . A A . 26 ASN CG 1 1 6 3458 1 1 26 ASN H H 0.461 -3.862 5.617 1.00 . A A . 26 ASN H 1 1 6 3459 1 1 26 ASN HA H 3.228 -4.362 6.292 1.00 . A A . 26 ASN HA 1 1 6 3460 1 1 26 ASN HB2 H 0.906 -6.187 5.588 1.00 . A A . 26 ASN HB2 1 1 6 3461 1 1 26 ASN HB3 H 2.563 -6.795 5.730 1.00 . A A . 26 ASN HB3 1 1 6 3462 1 1 26 ASN HD21 H 1.694 -8.086 7.662 1.00 . A A . 26 ASN HD21 1 1 6 3463 1 1 26 ASN HD22 H 1.776 -7.228 9.192 1.00 . A A . 26 ASN HD22 1 1 6 3464 1 1 26 ASN N N 1.440 -3.614 5.614 1.00 . A A . 26 ASN N 1 1 6 3465 1 1 26 ASN ND2 N 1.793 -7.217 8.177 1.00 . A A . 26 ASN ND2 1 1 6 3466 1 1 26 ASN O O 4.205 -5.322 4.112 1.00 . A A . 26 ASN O 1 1 6 3467 1 1 26 ASN OD1 O 1.701 -5.018 8.232 1.00 . A A . 26 ASN OD1 1 1 6 3468 1 1 27 CYS C C 4.398 -2.729 2.077 1.00 . A A . 27 CYS C 1 1 6 3469 1 1 27 CYS CA C 3.277 -3.772 1.929 1.00 . A A . 27 CYS CA 1 1 6 3470 1 1 27 CYS CB C 2.300 -3.281 0.836 1.00 . A A . 27 CYS CB 1 1 6 3471 1 1 27 CYS H H 1.745 -3.497 3.353 1.00 . A A . 27 CYS H 1 1 6 3472 1 1 27 CYS HA H 3.733 -4.700 1.592 1.00 . A A . 27 CYS HA 1 1 6 3473 1 1 27 CYS HB2 H 2.009 -2.252 1.050 1.00 . A A . 27 CYS HB2 1 1 6 3474 1 1 27 CYS HB3 H 2.858 -3.221 -0.098 1.00 . A A . 27 CYS HB3 1 1 6 3475 1 1 27 CYS N N 2.592 -4.034 3.191 1.00 . A A . 27 CYS N 1 1 6 3476 1 1 27 CYS O O 4.953 -2.337 1.059 1.00 . A A . 27 CYS O 1 1 6 3477 1 1 27 CYS SG S 0.775 -4.213 0.512 1.00 . A A . 27 CYS SG 1 1 6 3478 1 1 28 LEU C C 6.852 -1.475 4.194 1.00 . A A . 28 LEU C 1 1 6 3479 1 1 28 LEU CA C 5.588 -1.054 3.454 1.00 . A A . 28 LEU CA 1 1 6 3480 1 1 28 LEU CB C 4.924 0.102 4.232 1.00 . A A . 28 LEU CB 1 1 6 3481 1 1 28 LEU CD1 C 3.985 2.311 3.472 1.00 . A A . 28 LEU CD1 1 1 6 3482 1 1 28 LEU CD2 C 3.114 0.284 2.375 1.00 . A A . 28 LEU CD2 1 1 6 3483 1 1 28 LEU CG C 3.681 0.829 3.676 1.00 . A A . 28 LEU CG 1 1 6 3484 1 1 28 LEU H H 4.112 -2.461 4.065 1.00 . A A . 28 LEU H 1 1 6 3485 1 1 28 LEU HA H 5.892 -0.664 2.481 1.00 . A A . 28 LEU HA 1 1 6 3486 1 1 28 LEU HB2 H 4.664 -0.254 5.220 1.00 . A A . 28 LEU HB2 1 1 6 3487 1 1 28 LEU HB3 H 5.704 0.843 4.396 1.00 . A A . 28 LEU HB3 1 1 6 3488 1 1 28 LEU HD11 H 4.365 2.729 4.404 1.00 . A A . 28 LEU HD11 1 1 6 3489 1 1 28 LEU HD12 H 4.731 2.421 2.684 1.00 . A A . 28 LEU HD12 1 1 6 3490 1 1 28 LEU HD13 H 3.077 2.843 3.198 1.00 . A A . 28 LEU HD13 1 1 6 3491 1 1 28 LEU HD21 H 2.800 -0.738 2.510 1.00 . A A . 28 LEU HD21 1 1 6 3492 1 1 28 LEU HD22 H 2.207 0.819 2.132 1.00 . A A . 28 LEU HD22 1 1 6 3493 1 1 28 LEU HD23 H 3.855 0.360 1.579 1.00 . A A . 28 LEU HD23 1 1 6 3494 1 1 28 LEU HG H 2.890 0.760 4.421 1.00 . A A . 28 LEU HG 1 1 6 3495 1 1 28 LEU N N 4.691 -2.202 3.280 1.00 . A A . 28 LEU N 1 1 6 3496 1 1 28 LEU O O 7.956 -1.247 3.706 1.00 . A A . 28 LEU O 1 1 6 3497 1 1 29 ALA C C 8.858 -3.190 5.683 1.00 . A A . 29 ALA C 1 1 6 3498 1 1 29 ALA CA C 7.820 -2.271 6.315 1.00 . A A . 29 ALA CA 1 1 6 3499 1 1 29 ALA CB C 7.319 -2.860 7.633 1.00 . A A . 29 ALA CB 1 1 6 3500 1 1 29 ALA H H 5.772 -2.194 5.749 1.00 . A A . 29 ALA H 1 1 6 3501 1 1 29 ALA HA H 8.305 -1.320 6.532 1.00 . A A . 29 ALA HA 1 1 6 3502 1 1 29 ALA HB1 H 8.179 -3.172 8.222 1.00 . A A . 29 ALA HB1 1 1 6 3503 1 1 29 ALA HB2 H 6.675 -3.718 7.449 1.00 . A A . 29 ALA HB2 1 1 6 3504 1 1 29 ALA HB3 H 6.775 -2.109 8.200 1.00 . A A . 29 ALA HB3 1 1 6 3505 1 1 29 ALA N N 6.705 -2.039 5.401 1.00 . A A . 29 ALA N 1 1 6 3506 1 1 29 ALA O O 10.013 -2.810 5.508 1.00 . A A . 29 ALA O 1 1 6 3507 1 1 30 GLY C C 8.587 -5.502 3.261 1.00 . A A . 30 GLY C 1 1 6 3508 1 1 30 GLY CA C 9.240 -5.349 4.609 1.00 . A A . 30 GLY CA 1 1 6 3509 1 1 30 GLY H H 7.466 -4.638 5.485 1.00 . A A . 30 GLY H 1 1 6 3510 1 1 30 GLY HA2 H 9.242 -6.307 5.124 1.00 . A A . 30 GLY HA2 1 1 6 3511 1 1 30 GLY HA3 H 10.263 -5.004 4.497 1.00 . A A . 30 GLY HA3 1 1 6 3512 1 1 30 GLY N N 8.435 -4.402 5.342 1.00 . A A . 30 GLY N 1 1 6 3513 1 1 30 GLY O O 7.731 -6.376 3.123 1.00 . A A . 30 GLY O 1 1 6 3514 1 1 31 TYR C C 9.280 -5.185 -0.177 1.00 . A A . 31 TYR C 1 1 6 3515 1 1 31 TYR CA C 8.325 -4.767 0.957 1.00 . A A . 31 TYR CA 1 1 6 3516 1 1 31 TYR CB C 7.713 -3.371 0.758 1.00 . A A . 31 TYR CB 1 1 6 3517 1 1 31 TYR CD1 C 9.922 -2.271 0.133 1.00 . A A . 31 TYR CD1 1 1 6 3518 1 1 31 TYR CD2 C 7.842 -1.279 -0.638 1.00 . A A . 31 TYR CD2 1 1 6 3519 1 1 31 TYR CE1 C 10.641 -1.302 -0.580 1.00 . A A . 31 TYR CE1 1 1 6 3520 1 1 31 TYR CE2 C 8.543 -0.276 -1.335 1.00 . A A . 31 TYR CE2 1 1 6 3521 1 1 31 TYR CG C 8.521 -2.309 0.033 1.00 . A A . 31 TYR CG 1 1 6 3522 1 1 31 TYR CZ C 9.961 -0.299 -1.316 1.00 . A A . 31 TYR CZ 1 1 6 3523 1 1 31 TYR H H 9.619 -3.931 2.463 1.00 . A A . 31 TYR H 1 1 6 3524 1 1 31 TYR HA H 7.505 -5.466 0.959 1.00 . A A . 31 TYR HA 1 1 6 3525 1 1 31 TYR HB2 H 6.846 -3.555 0.133 1.00 . A A . 31 TYR HB2 1 1 6 3526 1 1 31 TYR HB3 H 7.356 -2.966 1.704 1.00 . A A . 31 TYR HB3 1 1 6 3527 1 1 31 TYR HD1 H 10.441 -3.071 0.647 1.00 . A A . 31 TYR HD1 1 1 6 3528 1 1 31 TYR HD2 H 6.768 -1.266 -0.566 1.00 . A A . 31 TYR HD2 1 1 6 3529 1 1 31 TYR HE1 H 11.716 -1.369 -0.570 1.00 . A A . 31 TYR HE1 1 1 6 3530 1 1 31 TYR HE2 H 7.982 0.505 -1.849 1.00 . A A . 31 TYR HE2 1 1 6 3531 1 1 31 TYR HH H 10.209 1.058 -2.734 1.00 . A A . 31 TYR HH 1 1 6 3532 1 1 31 TYR N N 8.951 -4.671 2.277 1.00 . A A . 31 TYR N 1 1 6 3533 1 1 31 TYR O O 9.140 -4.720 -1.311 1.00 . A A . 31 TYR O 1 1 6 3534 1 1 31 TYR OH O 10.689 0.628 -2.001 1.00 . A A . 31 TYR OH 1 1 6 3535 1 1 32 PRO C C 10.336 -7.495 -2.150 1.00 . A A . 32 PRO C 1 1 6 3536 1 1 32 PRO CA C 11.013 -6.637 -1.068 1.00 . A A . 32 PRO CA 1 1 6 3537 1 1 32 PRO CB C 12.114 -7.431 -0.356 1.00 . A A . 32 PRO CB 1 1 6 3538 1 1 32 PRO CD C 10.351 -7.008 1.184 1.00 . A A . 32 PRO CD 1 1 6 3539 1 1 32 PRO CG C 11.365 -8.075 0.806 1.00 . A A . 32 PRO CG 1 1 6 3540 1 1 32 PRO HA H 11.422 -5.706 -1.486 1.00 . A A . 32 PRO HA 1 1 6 3541 1 1 32 PRO HB2 H 12.583 -8.179 -0.995 1.00 . A A . 32 PRO HB2 1 1 6 3542 1 1 32 PRO HB3 H 12.869 -6.747 0.027 1.00 . A A . 32 PRO HB3 1 1 6 3543 1 1 32 PRO HD2 H 9.444 -7.461 1.575 1.00 . A A . 32 PRO HD2 1 1 6 3544 1 1 32 PRO HD3 H 10.800 -6.343 1.917 1.00 . A A . 32 PRO HD3 1 1 6 3545 1 1 32 PRO HG2 H 10.844 -8.971 0.469 1.00 . A A . 32 PRO HG2 1 1 6 3546 1 1 32 PRO HG3 H 12.029 -8.286 1.642 1.00 . A A . 32 PRO HG3 1 1 6 3547 1 1 32 PRO N N 10.073 -6.259 -0.026 1.00 . A A . 32 PRO N 1 1 6 3548 1 1 32 PRO O O 11.027 -7.959 -3.057 1.00 . A A . 32 PRO O 1 1 6 3549 1 1 33 ALA C C 6.950 -7.598 -3.389 1.00 . A A . 33 ALA C 1 1 6 3550 1 1 33 ALA CA C 8.177 -8.436 -2.986 1.00 . A A . 33 ALA CA 1 1 6 3551 1 1 33 ALA CB C 7.745 -9.789 -2.414 1.00 . A A . 33 ALA CB 1 1 6 3552 1 1 33 ALA H H 8.557 -7.411 -1.196 1.00 . A A . 33 ALA H 1 1 6 3553 1 1 33 ALA HA H 8.756 -8.617 -3.893 1.00 . A A . 33 ALA HA 1 1 6 3554 1 1 33 ALA HB1 H 7.132 -10.318 -3.144 1.00 . A A . 33 ALA HB1 1 1 6 3555 1 1 33 ALA HB2 H 8.624 -10.391 -2.194 1.00 . A A . 33 ALA HB2 1 1 6 3556 1 1 33 ALA HB3 H 7.166 -9.629 -1.502 1.00 . A A . 33 ALA HB3 1 1 6 3557 1 1 33 ALA N N 9.033 -7.780 -2.005 1.00 . A A . 33 ALA N 1 1 6 3558 1 1 33 ALA O O 6.156 -8.061 -4.210 1.00 . A A . 33 ALA O 1 1 6 3559 1 1 34 GLY C C 5.188 -5.261 -4.398 1.00 . A A . 34 GLY C 1 1 6 3560 1 1 34 GLY CA C 5.461 -5.699 -2.963 1.00 . A A . 34 GLY CA 1 1 6 3561 1 1 34 GLY H H 7.446 -5.995 -2.240 1.00 . A A . 34 GLY H 1 1 6 3562 1 1 34 GLY HA2 H 5.433 -4.836 -2.304 1.00 . A A . 34 GLY HA2 1 1 6 3563 1 1 34 GLY HA3 H 4.657 -6.369 -2.665 1.00 . A A . 34 GLY HA3 1 1 6 3564 1 1 34 GLY N N 6.727 -6.414 -2.808 1.00 . A A . 34 GLY N 1 1 6 3565 1 1 34 GLY O O 4.043 -5.341 -4.839 1.00 . A A . 34 GLY O 1 1 6 3566 1 1 35 CYS C C 5.654 -5.780 -7.432 1.00 . A A . 35 CYS C 1 1 6 3567 1 1 35 CYS CA C 6.113 -4.595 -6.584 1.00 . A A . 35 CYS CA 1 1 6 3568 1 1 35 CYS CB C 7.451 -4.094 -7.148 1.00 . A A . 35 CYS CB 1 1 6 3569 1 1 35 CYS H H 7.116 -4.732 -4.714 1.00 . A A . 35 CYS H 1 1 6 3570 1 1 35 CYS HA H 5.353 -3.823 -6.685 1.00 . A A . 35 CYS HA 1 1 6 3571 1 1 35 CYS HB2 H 8.042 -4.972 -7.408 1.00 . A A . 35 CYS HB2 1 1 6 3572 1 1 35 CYS HB3 H 7.257 -3.548 -8.073 1.00 . A A . 35 CYS HB3 1 1 6 3573 1 1 35 CYS N N 6.224 -4.897 -5.159 1.00 . A A . 35 CYS N 1 1 6 3574 1 1 35 CYS O O 5.364 -5.595 -8.615 1.00 . A A . 35 CYS O 1 1 6 3575 1 1 35 CYS SG S 8.427 -3.047 -6.041 1.00 . A A . 35 CYS SG 1 1 6 3576 1 1 36 SER C C 3.609 -8.423 -7.161 1.00 . A A . 36 SER C 1 1 6 3577 1 1 36 SER CA C 5.070 -8.160 -7.554 1.00 . A A . 36 SER CA 1 1 6 3578 1 1 36 SER CB C 6.025 -9.312 -7.227 1.00 . A A . 36 SER CB 1 1 6 3579 1 1 36 SER H H 6.005 -7.184 -5.980 1.00 . A A . 36 SER H 1 1 6 3580 1 1 36 SER HA H 5.103 -7.985 -8.626 1.00 . A A . 36 SER HA 1 1 6 3581 1 1 36 SER HB2 H 5.937 -10.048 -8.005 1.00 . A A . 36 SER HB2 1 1 6 3582 1 1 36 SER HB3 H 7.045 -8.933 -7.241 1.00 . A A . 36 SER HB3 1 1 6 3583 1 1 36 SER HG H 5.925 -9.270 -5.273 1.00 . A A . 36 SER HG 1 1 6 3584 1 1 36 SER N N 5.608 -6.998 -6.890 1.00 . A A . 36 SER N 1 1 6 3585 1 1 36 SER O O 2.901 -9.138 -7.871 1.00 . A A . 36 SER O 1 1 6 3586 1 1 36 SER OG O 5.801 -9.940 -5.980 1.00 . A A . 36 SER OG 1 1 6 3587 1 1 37 ASN C C 0.938 -6.929 -6.001 1.00 . A A . 37 ASN C 1 1 6 3588 1 1 37 ASN CA C 1.842 -8.023 -5.448 1.00 . A A . 37 ASN CA 1 1 6 3589 1 1 37 ASN CB C 1.926 -7.911 -3.906 1.00 . A A . 37 ASN CB 1 1 6 3590 1 1 37 ASN CG C 1.537 -9.200 -3.221 1.00 . A A . 37 ASN CG 1 1 6 3591 1 1 37 ASN H H 3.800 -7.208 -5.584 1.00 . A A . 37 ASN H 1 1 6 3592 1 1 37 ASN HA H 1.444 -9.004 -5.722 1.00 . A A . 37 ASN HA 1 1 6 3593 1 1 37 ASN HB2 H 2.922 -7.623 -3.583 1.00 . A A . 37 ASN HB2 1 1 6 3594 1 1 37 ASN HB3 H 1.255 -7.139 -3.535 1.00 . A A . 37 ASN HB3 1 1 6 3595 1 1 37 ASN HD21 H -0.379 -8.896 -3.711 1.00 . A A . 37 ASN HD21 1 1 6 3596 1 1 37 ASN HD22 H -0.083 -10.352 -2.776 1.00 . A A . 37 ASN HD22 1 1 6 3597 1 1 37 ASN N N 3.167 -7.857 -6.036 1.00 . A A . 37 ASN N 1 1 6 3598 1 1 37 ASN ND2 N 0.256 -9.504 -3.208 1.00 . A A . 37 ASN ND2 1 1 6 3599 1 1 37 ASN O O 1.033 -5.790 -5.540 1.00 . A A . 37 ASN O 1 1 6 3600 1 1 37 ASN OD1 O 2.374 -9.911 -2.680 1.00 . A A . 37 ASN OD1 1 1 6 3601 1 1 38 SER C C -1.565 -5.369 -6.606 1.00 . A A . 38 SER C 1 1 6 3602 1 1 38 SER CA C -0.760 -6.206 -7.624 1.00 . A A . 38 SER CA 1 1 6 3603 1 1 38 SER CB C -1.679 -6.858 -8.669 1.00 . A A . 38 SER CB 1 1 6 3604 1 1 38 SER H H 0.054 -8.166 -7.337 1.00 . A A . 38 SER H 1 1 6 3605 1 1 38 SER HA H -0.081 -5.532 -8.156 1.00 . A A . 38 SER HA 1 1 6 3606 1 1 38 SER HB2 H -1.384 -7.894 -8.837 1.00 . A A . 38 SER HB2 1 1 6 3607 1 1 38 SER HB3 H -2.710 -6.850 -8.315 1.00 . A A . 38 SER HB3 1 1 6 3608 1 1 38 SER HG H -2.494 -6.002 -10.222 1.00 . A A . 38 SER HG 1 1 6 3609 1 1 38 SER N N 0.078 -7.221 -6.978 1.00 . A A . 38 SER N 1 1 6 3610 1 1 38 SER O O -1.680 -4.157 -6.789 1.00 . A A . 38 SER O 1 1 6 3611 1 1 38 SER OG O -1.587 -6.162 -9.898 1.00 . A A . 38 SER OG 1 1 6 3612 1 1 39 ASP C C -1.993 -4.124 -3.851 1.00 . A A . 39 ASP C 1 1 6 3613 1 1 39 ASP CA C -2.819 -5.244 -4.475 1.00 . A A . 39 ASP CA 1 1 6 3614 1 1 39 ASP CB C -3.293 -6.214 -3.379 1.00 . A A . 39 ASP CB 1 1 6 3615 1 1 39 ASP CG C -4.108 -5.539 -2.258 1.00 . A A . 39 ASP CG 1 1 6 3616 1 1 39 ASP H H -1.922 -6.956 -5.389 1.00 . A A . 39 ASP H 1 1 6 3617 1 1 39 ASP HA H -3.699 -4.801 -4.939 1.00 . A A . 39 ASP HA 1 1 6 3618 1 1 39 ASP HB2 H -3.922 -6.976 -3.839 1.00 . A A . 39 ASP HB2 1 1 6 3619 1 1 39 ASP HB3 H -2.428 -6.726 -2.950 1.00 . A A . 39 ASP HB3 1 1 6 3620 1 1 39 ASP N N -2.048 -5.956 -5.504 1.00 . A A . 39 ASP N 1 1 6 3621 1 1 39 ASP O O -2.511 -3.037 -3.612 1.00 . A A . 39 ASP O 1 1 6 3622 1 1 39 ASP OD1 O -5.197 -4.990 -2.528 1.00 . A A . 39 ASP OD1 1 1 6 3623 1 1 39 ASP OD2 O -3.760 -5.717 -1.066 1.00 . A A . 39 ASP OD2 1 1 6 3624 1 1 40 CYS C C 0.676 -2.429 -4.158 1.00 . A A . 40 CYS C 1 1 6 3625 1 1 40 CYS CA C 0.214 -3.388 -3.062 1.00 . A A . 40 CYS CA 1 1 6 3626 1 1 40 CYS CB C 1.440 -4.110 -2.489 1.00 . A A . 40 CYS CB 1 1 6 3627 1 1 40 CYS H H -0.290 -5.159 -4.112 1.00 . A A . 40 CYS H 1 1 6 3628 1 1 40 CYS HA H -0.284 -2.813 -2.276 1.00 . A A . 40 CYS HA 1 1 6 3629 1 1 40 CYS HB2 H 1.951 -4.626 -3.302 1.00 . A A . 40 CYS HB2 1 1 6 3630 1 1 40 CYS HB3 H 2.128 -3.350 -2.127 1.00 . A A . 40 CYS HB3 1 1 6 3631 1 1 40 CYS N N -0.698 -4.364 -3.635 1.00 . A A . 40 CYS N 1 1 6 3632 1 1 40 CYS O O 0.784 -1.231 -3.930 1.00 . A A . 40 CYS O 1 1 6 3633 1 1 40 CYS SG S 1.178 -5.318 -1.154 1.00 . A A . 40 CYS SG 1 1 6 3634 1 1 41 THR C C 1.063 -0.914 -6.726 1.00 . A A . 41 THR C 1 1 6 3635 1 1 41 THR CA C 1.627 -2.309 -6.455 1.00 . A A . 41 THR CA 1 1 6 3636 1 1 41 THR CB C 1.493 -3.244 -7.660 1.00 . A A . 41 THR CB 1 1 6 3637 1 1 41 THR CG2 C 1.916 -2.653 -8.989 1.00 . A A . 41 THR CG2 1 1 6 3638 1 1 41 THR H H 0.795 -3.952 -5.460 1.00 . A A . 41 THR H 1 1 6 3639 1 1 41 THR HA H 2.686 -2.201 -6.211 1.00 . A A . 41 THR HA 1 1 6 3640 1 1 41 THR HB H 0.448 -3.515 -7.757 1.00 . A A . 41 THR HB 1 1 6 3641 1 1 41 THR HG1 H 2.042 -4.807 -6.618 1.00 . A A . 41 THR HG1 1 1 6 3642 1 1 41 THR HG21 H 1.405 -1.706 -9.162 1.00 . A A . 41 THR HG21 1 1 6 3643 1 1 41 THR HG22 H 2.993 -2.496 -8.992 1.00 . A A . 41 THR HG22 1 1 6 3644 1 1 41 THR HG23 H 1.621 -3.367 -9.757 1.00 . A A . 41 THR HG23 1 1 6 3645 1 1 41 THR N N 0.960 -2.961 -5.345 1.00 . A A . 41 THR N 1 1 6 3646 1 1 41 THR O O 1.853 0.025 -6.816 1.00 . A A . 41 THR O 1 1 6 3647 1 1 41 THR OG1 O 2.262 -4.418 -7.483 1.00 . A A . 41 THR OG1 1 1 6 3648 1 1 42 ALA C C -0.546 1.617 -6.216 1.00 . A A . 42 ALA C 1 1 6 3649 1 1 42 ALA CA C -0.805 0.544 -7.274 1.00 . A A . 42 ALA CA 1 1 6 3650 1 1 42 ALA CB C -2.303 0.453 -7.558 1.00 . A A . 42 ALA CB 1 1 6 3651 1 1 42 ALA H H -0.877 -1.546 -6.798 1.00 . A A . 42 ALA H 1 1 6 3652 1 1 42 ALA HA H -0.301 0.844 -8.194 1.00 . A A . 42 ALA HA 1 1 6 3653 1 1 42 ALA HB1 H -2.481 -0.208 -8.402 1.00 . A A . 42 ALA HB1 1 1 6 3654 1 1 42 ALA HB2 H -2.682 1.446 -7.802 1.00 . A A . 42 ALA HB2 1 1 6 3655 1 1 42 ALA HB3 H -2.829 0.090 -6.678 1.00 . A A . 42 ALA HB3 1 1 6 3656 1 1 42 ALA N N -0.258 -0.751 -6.878 1.00 . A A . 42 ALA N 1 1 6 3657 1 1 42 ALA O O -0.270 2.760 -6.583 1.00 . A A . 42 ALA O 1 1 6 3658 1 1 43 PHE C C 1.214 2.364 -3.828 1.00 . A A . 43 PHE C 1 1 6 3659 1 1 43 PHE CA C -0.287 2.092 -3.808 1.00 . A A . 43 PHE CA 1 1 6 3660 1 1 43 PHE CB C -0.758 1.418 -2.508 1.00 . A A . 43 PHE CB 1 1 6 3661 1 1 43 PHE CD1 C 1.062 1.775 -0.830 1.00 . A A . 43 PHE CD1 1 1 6 3662 1 1 43 PHE CD2 C -1.064 2.843 -0.394 1.00 . A A . 43 PHE CD2 1 1 6 3663 1 1 43 PHE CE1 C 1.628 2.404 0.281 1.00 . A A . 43 PHE CE1 1 1 6 3664 1 1 43 PHE CE2 C -0.525 3.390 0.788 1.00 . A A . 43 PHE CE2 1 1 6 3665 1 1 43 PHE CG C -0.257 2.038 -1.217 1.00 . A A . 43 PHE CG 1 1 6 3666 1 1 43 PHE CZ C 0.827 3.193 1.107 1.00 . A A . 43 PHE CZ 1 1 6 3667 1 1 43 PHE H H -0.801 0.269 -4.737 1.00 . A A . 43 PHE H 1 1 6 3668 1 1 43 PHE HA H -0.792 3.050 -3.907 1.00 . A A . 43 PHE HA 1 1 6 3669 1 1 43 PHE HB2 H -1.846 1.375 -2.502 1.00 . A A . 43 PHE HB2 1 1 6 3670 1 1 43 PHE HB3 H -0.405 0.392 -2.514 1.00 . A A . 43 PHE HB3 1 1 6 3671 1 1 43 PHE HD1 H 1.647 1.095 -1.414 1.00 . A A . 43 PHE HD1 1 1 6 3672 1 1 43 PHE HD2 H -2.086 3.056 -0.670 1.00 . A A . 43 PHE HD2 1 1 6 3673 1 1 43 PHE HE1 H 2.673 2.273 0.518 1.00 . A A . 43 PHE HE1 1 1 6 3674 1 1 43 PHE HE2 H -1.118 4.030 1.421 1.00 . A A . 43 PHE HE2 1 1 6 3675 1 1 43 PHE HZ H 1.283 3.633 1.980 1.00 . A A . 43 PHE HZ 1 1 6 3676 1 1 43 PHE N N -0.631 1.244 -4.937 1.00 . A A . 43 PHE N 1 1 6 3677 1 1 43 PHE O O 1.617 3.522 -3.787 1.00 . A A . 43 PHE O 1 1 6 3678 1 1 44 LEU C C 4.094 2.327 -4.885 1.00 . A A . 44 LEU C 1 1 6 3679 1 1 44 LEU CA C 3.501 1.526 -3.721 1.00 . A A . 44 LEU CA 1 1 6 3680 1 1 44 LEU CB C 4.233 0.188 -3.585 1.00 . A A . 44 LEU CB 1 1 6 3681 1 1 44 LEU CD1 C 4.606 -2.067 -2.586 1.00 . A A . 44 LEU CD1 1 1 6 3682 1 1 44 LEU CD2 C 4.001 -0.150 -1.053 1.00 . A A . 44 LEU CD2 1 1 6 3683 1 1 44 LEU CG C 3.818 -0.756 -2.445 1.00 . A A . 44 LEU CG 1 1 6 3684 1 1 44 LEU H H 1.710 0.380 -3.853 1.00 . A A . 44 LEU H 1 1 6 3685 1 1 44 LEU HA H 3.648 2.105 -2.813 1.00 . A A . 44 LEU HA 1 1 6 3686 1 1 44 LEU HB2 H 4.145 -0.368 -4.506 1.00 . A A . 44 LEU HB2 1 1 6 3687 1 1 44 LEU HB3 H 5.278 0.435 -3.494 1.00 . A A . 44 LEU HB3 1 1 6 3688 1 1 44 LEU HD11 H 5.677 -1.865 -2.576 1.00 . A A . 44 LEU HD11 1 1 6 3689 1 1 44 LEU HD12 H 4.363 -2.741 -1.766 1.00 . A A . 44 LEU HD12 1 1 6 3690 1 1 44 LEU HD13 H 4.362 -2.547 -3.539 1.00 . A A . 44 LEU HD13 1 1 6 3691 1 1 44 LEU HD21 H 3.690 0.891 -1.002 1.00 . A A . 44 LEU HD21 1 1 6 3692 1 1 44 LEU HD22 H 3.402 -0.716 -0.342 1.00 . A A . 44 LEU HD22 1 1 6 3693 1 1 44 LEU HD23 H 5.037 -0.196 -0.756 1.00 . A A . 44 LEU HD23 1 1 6 3694 1 1 44 LEU HG H 2.766 -0.998 -2.539 1.00 . A A . 44 LEU HG 1 1 6 3695 1 1 44 LEU N N 2.065 1.332 -3.876 1.00 . A A . 44 LEU N 1 1 6 3696 1 1 44 LEU O O 5.090 3.023 -4.712 1.00 . A A . 44 LEU O 1 1 6 3697 1 1 45 SER C C 3.576 4.627 -6.683 1.00 . A A . 45 SER C 1 1 6 3698 1 1 45 SER CA C 3.687 3.166 -7.176 1.00 . A A . 45 SER CA 1 1 6 3699 1 1 45 SER CB C 2.715 2.775 -8.310 1.00 . A A . 45 SER CB 1 1 6 3700 1 1 45 SER H H 2.737 1.568 -6.102 1.00 . A A . 45 SER H 1 1 6 3701 1 1 45 SER HA H 4.705 3.005 -7.530 1.00 . A A . 45 SER HA 1 1 6 3702 1 1 45 SER HB2 H 2.585 1.696 -8.340 1.00 . A A . 45 SER HB2 1 1 6 3703 1 1 45 SER HB3 H 1.727 3.194 -8.142 1.00 . A A . 45 SER HB3 1 1 6 3704 1 1 45 SER HG H 2.424 3.391 -10.131 1.00 . A A . 45 SER HG 1 1 6 3705 1 1 45 SER N N 3.461 2.271 -6.049 1.00 . A A . 45 SER N 1 1 6 3706 1 1 45 SER O O 4.579 5.344 -6.625 1.00 . A A . 45 SER O 1 1 6 3707 1 1 45 SER OG O 3.198 3.159 -9.577 1.00 . A A . 45 SER OG 1 1 6 3708 1 1 46 GLN C C 3.017 6.709 -4.446 1.00 . A A . 46 GLN C 1 1 6 3709 1 1 46 GLN CA C 2.122 6.357 -5.638 1.00 . A A . 46 GLN CA 1 1 6 3710 1 1 46 GLN CB C 0.651 6.457 -5.202 1.00 . A A . 46 GLN CB 1 1 6 3711 1 1 46 GLN CD C -1.699 7.071 -5.953 1.00 . A A . 46 GLN CD 1 1 6 3712 1 1 46 GLN CG C -0.277 6.726 -6.389 1.00 . A A . 46 GLN CG 1 1 6 3713 1 1 46 GLN H H 1.620 4.382 -6.227 1.00 . A A . 46 GLN H 1 1 6 3714 1 1 46 GLN HA H 2.312 7.108 -6.407 1.00 . A A . 46 GLN HA 1 1 6 3715 1 1 46 GLN HB2 H 0.345 5.552 -4.677 1.00 . A A . 46 GLN HB2 1 1 6 3716 1 1 46 GLN HB3 H 0.554 7.283 -4.501 1.00 . A A . 46 GLN HB3 1 1 6 3717 1 1 46 GLN HE21 H -2.429 6.224 -7.629 1.00 . A A . 46 GLN HE21 1 1 6 3718 1 1 46 GLN HE22 H -3.630 6.877 -6.527 1.00 . A A . 46 GLN HE22 1 1 6 3719 1 1 46 GLN HG2 H 0.101 7.576 -6.954 1.00 . A A . 46 GLN HG2 1 1 6 3720 1 1 46 GLN HG3 H -0.288 5.843 -7.034 1.00 . A A . 46 GLN HG3 1 1 6 3721 1 1 46 GLN N N 2.390 5.037 -6.215 1.00 . A A . 46 GLN N 1 1 6 3722 1 1 46 GLN NE2 N -2.669 6.675 -6.752 1.00 . A A . 46 GLN NE2 1 1 6 3723 1 1 46 GLN O O 3.272 7.891 -4.212 1.00 . A A . 46 GLN O 1 1 6 3724 1 1 46 GLN OE1 O -1.937 7.711 -4.931 1.00 . A A . 46 GLN OE1 1 1 6 3725 1 1 47 CYS C C 5.488 5.848 -2.239 1.00 . A A . 47 CYS C 1 1 6 3726 1 1 47 CYS CA C 3.959 5.953 -2.305 1.00 . A A . 47 CYS CA 1 1 6 3727 1 1 47 CYS CB C 3.279 4.994 -1.316 1.00 . A A . 47 CYS CB 1 1 6 3728 1 1 47 CYS H H 3.009 4.811 -3.843 1.00 . A A . 47 CYS H 1 1 6 3729 1 1 47 CYS HA H 3.707 6.968 -2.013 1.00 . A A . 47 CYS HA 1 1 6 3730 1 1 47 CYS HB2 H 2.291 4.747 -1.704 1.00 . A A . 47 CYS HB2 1 1 6 3731 1 1 47 CYS HB3 H 3.863 4.073 -1.252 1.00 . A A . 47 CYS HB3 1 1 6 3732 1 1 47 CYS N N 3.395 5.723 -3.630 1.00 . A A . 47 CYS N 1 1 6 3733 1 1 47 CYS O O 6.080 6.448 -1.343 1.00 . A A . 47 CYS O 1 1 6 3734 1 1 47 CYS SG S 2.982 5.613 0.360 1.00 . A A . 47 CYS SG 1 1 6 3735 1 1 48 TYR C C 8.210 4.981 -4.541 1.00 . A A . 48 TYR C 1 1 6 3736 1 1 48 TYR CA C 7.550 4.804 -3.170 1.00 . A A . 48 TYR CA 1 1 6 3737 1 1 48 TYR CB C 7.758 3.362 -2.725 1.00 . A A . 48 TYR CB 1 1 6 3738 1 1 48 TYR CD1 C 8.449 3.712 -0.329 1.00 . A A . 48 TYR CD1 1 1 6 3739 1 1 48 TYR CD2 C 6.538 2.275 -0.800 1.00 . A A . 48 TYR CD2 1 1 6 3740 1 1 48 TYR CE1 C 8.354 3.395 1.032 1.00 . A A . 48 TYR CE1 1 1 6 3741 1 1 48 TYR CE2 C 6.489 1.895 0.552 1.00 . A A . 48 TYR CE2 1 1 6 3742 1 1 48 TYR CG C 7.557 3.133 -1.248 1.00 . A A . 48 TYR CG 1 1 6 3743 1 1 48 TYR CZ C 7.396 2.458 1.474 1.00 . A A . 48 TYR CZ 1 1 6 3744 1 1 48 TYR H H 5.542 4.644 -3.847 1.00 . A A . 48 TYR H 1 1 6 3745 1 1 48 TYR HA H 8.076 5.415 -2.446 1.00 . A A . 48 TYR HA 1 1 6 3746 1 1 48 TYR HB2 H 7.130 2.687 -3.304 1.00 . A A . 48 TYR HB2 1 1 6 3747 1 1 48 TYR HB3 H 8.786 3.097 -2.952 1.00 . A A . 48 TYR HB3 1 1 6 3748 1 1 48 TYR HD1 H 9.212 4.404 -0.660 1.00 . A A . 48 TYR HD1 1 1 6 3749 1 1 48 TYR HD2 H 5.846 1.855 -1.511 1.00 . A A . 48 TYR HD2 1 1 6 3750 1 1 48 TYR HE1 H 9.020 3.875 1.728 1.00 . A A . 48 TYR HE1 1 1 6 3751 1 1 48 TYR HE2 H 5.779 1.157 0.885 1.00 . A A . 48 TYR HE2 1 1 6 3752 1 1 48 TYR HH H 7.846 2.721 3.337 1.00 . A A . 48 TYR HH 1 1 6 3753 1 1 48 TYR N N 6.118 5.117 -3.162 1.00 . A A . 48 TYR N 1 1 6 3754 1 1 48 TYR O O 9.433 5.126 -4.626 1.00 . A A . 48 TYR O 1 1 6 3755 1 1 48 TYR OH O 7.354 2.091 2.779 1.00 . A A . 48 TYR OH 1 1 6 3756 1 1 49 GLY C C 7.984 3.428 -7.497 1.00 . A A . 49 GLY C 1 1 6 3757 1 1 49 GLY CA C 7.926 4.866 -6.985 1.00 . A A . 49 GLY CA 1 1 6 3758 1 1 49 GLY H H 6.433 4.814 -5.485 1.00 . A A . 49 GLY H 1 1 6 3759 1 1 49 GLY HA2 H 8.915 5.320 -7.060 1.00 . A A . 49 GLY HA2 1 1 6 3760 1 1 49 GLY HA3 H 7.248 5.428 -7.624 1.00 . A A . 49 GLY HA3 1 1 6 3761 1 1 49 GLY N N 7.428 4.926 -5.617 1.00 . A A . 49 GLY N 1 1 6 3762 1 1 49 GLY O O 8.604 3.177 -8.527 1.00 . A A . 49 GLY O 1 1 6 3763 1 1 50 GLY C C 8.298 0.362 -7.680 1.00 . A A . 50 GLY C 1 1 6 3764 1 1 50 GLY CA C 7.064 1.144 -7.252 1.00 . A A . 50 GLY CA 1 1 6 3765 1 1 50 GLY H H 6.883 2.789 -5.940 1.00 . A A . 50 GLY H 1 1 6 3766 1 1 50 GLY HA2 H 6.395 1.220 -8.106 1.00 . A A . 50 GLY HA2 1 1 6 3767 1 1 50 GLY HA3 H 6.559 0.608 -6.454 1.00 . A A . 50 GLY HA3 1 1 6 3768 1 1 50 GLY N N 7.351 2.489 -6.783 1.00 . A A . 50 GLY N 1 1 6 3769 1 1 50 GLY O O 8.436 0.040 -8.861 1.00 . A A . 50 GLY O 1 1 6 3770 1 1 51 CYS C C 11.250 0.768 -7.625 1.00 . A A . 51 CYS C 1 1 6 3771 1 1 51 CYS CA C 10.542 -0.389 -6.937 1.00 . A A . 51 CYS CA 1 1 6 3772 1 1 51 CYS CB C 10.659 -1.735 -7.677 1.00 . A A . 51 CYS CB 1 1 6 3773 1 1 51 CYS H H 8.964 0.361 -5.782 1.00 . A A . 51 CYS H 1 1 6 3774 1 1 51 CYS HA H 11.017 -0.511 -5.963 1.00 . A A . 51 CYS HA 1 1 6 3775 1 1 51 CYS HB2 H 10.013 -1.743 -8.552 1.00 . A A . 51 CYS HB2 1 1 6 3776 1 1 51 CYS HB3 H 11.680 -1.821 -8.043 1.00 . A A . 51 CYS HB3 1 1 6 3777 1 1 51 CYS N N 9.160 0.019 -6.716 1.00 . A A . 51 CYS N 1 1 6 3778 1 1 51 CYS O O 11.318 1.840 -6.980 1.00 . A A . 51 CYS O 1 1 6 3779 1 1 51 CYS OXT O 11.693 0.602 -8.782 1.00 . A A . 51 CYS OXT 1 1 6 3780 1 1 51 CYS SG S 10.348 -3.205 -6.678 1.00 . A A . 51 CYS SG 1 1 7 3781 1 1 1 GLY C C -7.989 -5.835 -0.584 1.00 . A A . 1 GLY C 1 1 7 3782 1 1 1 GLY CA C -7.789 -7.157 -1.295 1.00 . A A . 1 GLY CA 1 1 7 3783 1 1 1 GLY H1 H -9.749 -7.372 -1.792 1.00 . A A . 1 GLY H1 1 1 7 3784 1 1 1 GLY H2 H -8.853 -6.659 -2.973 1.00 . A A . 1 GLY H2 1 1 7 3785 1 1 1 GLY H3 H -8.736 -8.283 -2.719 1.00 . A A . 1 GLY H3 1 1 7 3786 1 1 1 GLY HA2 H -6.827 -7.159 -1.799 1.00 . A A . 1 GLY HA2 1 1 7 3787 1 1 1 GLY HA3 H -7.805 -7.953 -0.551 1.00 . A A . 1 GLY HA3 1 1 7 3788 1 1 1 GLY N N -8.859 -7.388 -2.271 1.00 . A A . 1 GLY N 1 1 7 3789 1 1 1 GLY O O -8.624 -4.923 -1.112 1.00 . A A . 1 GLY O 1 1 7 3790 1 1 2 GLU C C -6.997 -3.336 0.954 1.00 . A A . 2 GLU C 1 1 7 3791 1 1 2 GLU CA C -7.642 -4.590 1.532 1.00 . A A . 2 GLU CA 1 1 7 3792 1 1 2 GLU CB C -6.944 -4.896 2.860 1.00 . A A . 2 GLU CB 1 1 7 3793 1 1 2 GLU CD C -8.983 -5.517 4.261 1.00 . A A . 2 GLU CD 1 1 7 3794 1 1 2 GLU CG C -7.611 -5.949 3.729 1.00 . A A . 2 GLU CG 1 1 7 3795 1 1 2 GLU H H -6.795 -6.419 0.949 1.00 . A A . 2 GLU H 1 1 7 3796 1 1 2 GLU HA H -8.703 -4.393 1.708 1.00 . A A . 2 GLU HA 1 1 7 3797 1 1 2 GLU HB2 H -5.914 -5.203 2.669 1.00 . A A . 2 GLU HB2 1 1 7 3798 1 1 2 GLU HB3 H -6.901 -3.995 3.454 1.00 . A A . 2 GLU HB3 1 1 7 3799 1 1 2 GLU HG2 H -7.684 -6.893 3.188 1.00 . A A . 2 GLU HG2 1 1 7 3800 1 1 2 GLU HG3 H -6.926 -6.057 4.561 1.00 . A A . 2 GLU HG3 1 1 7 3801 1 1 2 GLU N N -7.475 -5.729 0.638 1.00 . A A . 2 GLU N 1 1 7 3802 1 1 2 GLU O O -7.615 -2.274 0.954 1.00 . A A . 2 GLU O 1 1 7 3803 1 1 2 GLU OE1 O -9.130 -4.348 4.689 1.00 . A A . 2 GLU OE1 1 1 7 3804 1 1 2 GLU OE2 O -9.913 -6.357 4.282 1.00 . A A . 2 GLU OE2 1 1 7 3805 1 1 3 CYS C C -5.831 -1.715 -1.234 1.00 . A A . 3 CYS C 1 1 7 3806 1 1 3 CYS CA C -5.031 -2.314 -0.074 1.00 . A A . 3 CYS CA 1 1 7 3807 1 1 3 CYS CB C -3.635 -2.723 -0.534 1.00 . A A . 3 CYS CB 1 1 7 3808 1 1 3 CYS H H -5.308 -4.365 0.566 1.00 . A A . 3 CYS H 1 1 7 3809 1 1 3 CYS HA H -4.935 -1.558 0.706 1.00 . A A . 3 CYS HA 1 1 7 3810 1 1 3 CYS HB2 H -3.137 -3.307 0.239 1.00 . A A . 3 CYS HB2 1 1 7 3811 1 1 3 CYS HB3 H -3.734 -3.352 -1.415 1.00 . A A . 3 CYS HB3 1 1 7 3812 1 1 3 CYS N N -5.750 -3.454 0.486 1.00 . A A . 3 CYS N 1 1 7 3813 1 1 3 CYS O O -6.070 -0.506 -1.270 1.00 . A A . 3 CYS O 1 1 7 3814 1 1 3 CYS SG S -2.597 -1.316 -0.981 1.00 . A A . 3 CYS SG 1 1 7 3815 1 1 4 GLU C C -8.471 -1.575 -2.726 1.00 . A A . 4 GLU C 1 1 7 3816 1 1 4 GLU CA C -7.145 -2.139 -3.248 1.00 . A A . 4 GLU CA 1 1 7 3817 1 1 4 GLU CB C -7.375 -3.288 -4.238 1.00 . A A . 4 GLU CB 1 1 7 3818 1 1 4 GLU CD C -6.373 -4.591 -6.196 1.00 . A A . 4 GLU CD 1 1 7 3819 1 1 4 GLU CG C -6.113 -3.611 -5.047 1.00 . A A . 4 GLU CG 1 1 7 3820 1 1 4 GLU H H -6.023 -3.542 -2.097 1.00 . A A . 4 GLU H 1 1 7 3821 1 1 4 GLU HA H -6.638 -1.331 -3.777 1.00 . A A . 4 GLU HA 1 1 7 3822 1 1 4 GLU HB2 H -7.711 -4.175 -3.701 1.00 . A A . 4 GLU HB2 1 1 7 3823 1 1 4 GLU HB3 H -8.149 -2.989 -4.937 1.00 . A A . 4 GLU HB3 1 1 7 3824 1 1 4 GLU HG2 H -5.711 -2.683 -5.456 1.00 . A A . 4 GLU HG2 1 1 7 3825 1 1 4 GLU HG3 H -5.372 -4.034 -4.379 1.00 . A A . 4 GLU HG3 1 1 7 3826 1 1 4 GLU N N -6.292 -2.567 -2.153 1.00 . A A . 4 GLU N 1 1 7 3827 1 1 4 GLU O O -8.923 -0.567 -3.252 1.00 . A A . 4 GLU O 1 1 7 3828 1 1 4 GLU OE1 O -6.775 -5.756 -5.961 1.00 . A A . 4 GLU OE1 1 1 7 3829 1 1 4 GLU OE2 O -6.171 -4.212 -7.371 1.00 . A A . 4 GLU OE2 1 1 7 3830 1 1 5 GLN C C -10.250 -0.301 -0.552 1.00 . A A . 5 GLN C 1 1 7 3831 1 1 5 GLN CA C -10.361 -1.715 -1.133 1.00 . A A . 5 GLN CA 1 1 7 3832 1 1 5 GLN CB C -10.851 -2.701 -0.047 1.00 . A A . 5 GLN CB 1 1 7 3833 1 1 5 GLN CD C -13.308 -2.691 -0.697 1.00 . A A . 5 GLN CD 1 1 7 3834 1 1 5 GLN CG C -12.298 -2.476 0.424 1.00 . A A . 5 GLN CG 1 1 7 3835 1 1 5 GLN H H -8.610 -2.940 -1.234 1.00 . A A . 5 GLN H 1 1 7 3836 1 1 5 GLN HA H -11.084 -1.687 -1.949 1.00 . A A . 5 GLN HA 1 1 7 3837 1 1 5 GLN HB2 H -10.789 -3.719 -0.424 1.00 . A A . 5 GLN HB2 1 1 7 3838 1 1 5 GLN HB3 H -10.199 -2.629 0.821 1.00 . A A . 5 GLN HB3 1 1 7 3839 1 1 5 GLN HE21 H -13.566 -0.694 -0.985 1.00 . A A . 5 GLN HE21 1 1 7 3840 1 1 5 GLN HE22 H -14.352 -1.760 -2.157 1.00 . A A . 5 GLN HE22 1 1 7 3841 1 1 5 GLN HG2 H -12.515 -3.182 1.228 1.00 . A A . 5 GLN HG2 1 1 7 3842 1 1 5 GLN HG3 H -12.409 -1.473 0.832 1.00 . A A . 5 GLN HG3 1 1 7 3843 1 1 5 GLN N N -9.082 -2.167 -1.689 1.00 . A A . 5 GLN N 1 1 7 3844 1 1 5 GLN NE2 N -13.820 -1.629 -1.292 1.00 . A A . 5 GLN NE2 1 1 7 3845 1 1 5 GLN O O -11.222 0.452 -0.597 1.00 . A A . 5 GLN O 1 1 7 3846 1 1 5 GLN OE1 O -13.644 -3.828 -1.031 1.00 . A A . 5 GLN OE1 1 1 7 3847 1 1 6 CYS C C -8.731 2.345 -0.712 1.00 . A A . 6 CYS C 1 1 7 3848 1 1 6 CYS CA C -8.786 1.388 0.480 1.00 . A A . 6 CYS CA 1 1 7 3849 1 1 6 CYS CB C -7.463 1.352 1.250 1.00 . A A . 6 CYS CB 1 1 7 3850 1 1 6 CYS H H -8.365 -0.660 0.060 1.00 . A A . 6 CYS H 1 1 7 3851 1 1 6 CYS HA H -9.578 1.713 1.154 1.00 . A A . 6 CYS HA 1 1 7 3852 1 1 6 CYS HB2 H -7.476 0.480 1.901 1.00 . A A . 6 CYS HB2 1 1 7 3853 1 1 6 CYS HB3 H -6.634 1.240 0.552 1.00 . A A . 6 CYS HB3 1 1 7 3854 1 1 6 CYS N N -9.092 0.047 0.011 1.00 . A A . 6 CYS N 1 1 7 3855 1 1 6 CYS O O -9.424 3.360 -0.746 1.00 . A A . 6 CYS O 1 1 7 3856 1 1 6 CYS SG S -7.193 2.820 2.270 1.00 . A A . 6 CYS SG 1 1 7 3857 1 1 7 PHE C C -9.185 2.961 -3.664 1.00 . A A . 7 PHE C 1 1 7 3858 1 1 7 PHE CA C -7.838 2.768 -2.959 1.00 . A A . 7 PHE CA 1 1 7 3859 1 1 7 PHE CB C -6.808 2.114 -3.888 1.00 . A A . 7 PHE CB 1 1 7 3860 1 1 7 PHE CD1 C -5.490 4.058 -4.811 1.00 . A A . 7 PHE CD1 1 1 7 3861 1 1 7 PHE CD2 C -4.442 2.615 -3.155 1.00 . A A . 7 PHE CD2 1 1 7 3862 1 1 7 PHE CE1 C -4.335 4.857 -4.861 1.00 . A A . 7 PHE CE1 1 1 7 3863 1 1 7 PHE CE2 C -3.304 3.436 -3.184 1.00 . A A . 7 PHE CE2 1 1 7 3864 1 1 7 PHE CG C -5.538 2.924 -3.979 1.00 . A A . 7 PHE CG 1 1 7 3865 1 1 7 PHE CZ C -3.237 4.541 -4.046 1.00 . A A . 7 PHE CZ 1 1 7 3866 1 1 7 PHE H H -7.447 1.113 -1.672 1.00 . A A . 7 PHE H 1 1 7 3867 1 1 7 PHE HA H -7.476 3.764 -2.684 1.00 . A A . 7 PHE HA 1 1 7 3868 1 1 7 PHE HB2 H -6.569 1.104 -3.551 1.00 . A A . 7 PHE HB2 1 1 7 3869 1 1 7 PHE HB3 H -7.227 2.017 -4.886 1.00 . A A . 7 PHE HB3 1 1 7 3870 1 1 7 PHE HD1 H -6.356 4.347 -5.387 1.00 . A A . 7 PHE HD1 1 1 7 3871 1 1 7 PHE HD2 H -4.489 1.783 -2.464 1.00 . A A . 7 PHE HD2 1 1 7 3872 1 1 7 PHE HE1 H -4.313 5.745 -5.477 1.00 . A A . 7 PHE HE1 1 1 7 3873 1 1 7 PHE HE2 H -2.490 3.264 -2.503 1.00 . A A . 7 PHE HE2 1 1 7 3874 1 1 7 PHE HZ H -2.368 5.184 -4.034 1.00 . A A . 7 PHE HZ 1 1 7 3875 1 1 7 PHE N N -7.958 1.985 -1.738 1.00 . A A . 7 PHE N 1 1 7 3876 1 1 7 PHE O O -9.421 4.028 -4.237 1.00 . A A . 7 PHE O 1 1 7 3877 1 1 8 SER C C -12.197 3.234 -3.489 1.00 . A A . 8 SER C 1 1 7 3878 1 1 8 SER CA C -11.424 2.089 -4.164 1.00 . A A . 8 SER CA 1 1 7 3879 1 1 8 SER CB C -12.153 0.746 -4.036 1.00 . A A . 8 SER CB 1 1 7 3880 1 1 8 SER H H -9.806 1.079 -3.218 1.00 . A A . 8 SER H 1 1 7 3881 1 1 8 SER HA H -11.332 2.322 -5.225 1.00 . A A . 8 SER HA 1 1 7 3882 1 1 8 SER HB2 H -12.301 0.501 -2.985 1.00 . A A . 8 SER HB2 1 1 7 3883 1 1 8 SER HB3 H -13.122 0.833 -4.515 1.00 . A A . 8 SER HB3 1 1 7 3884 1 1 8 SER HG H -10.935 0.102 -5.414 1.00 . A A . 8 SER HG 1 1 7 3885 1 1 8 SER N N -10.080 1.971 -3.618 1.00 . A A . 8 SER N 1 1 7 3886 1 1 8 SER O O -12.941 3.950 -4.171 1.00 . A A . 8 SER O 1 1 7 3887 1 1 8 SER OG O -11.444 -0.297 -4.678 1.00 . A A . 8 SER OG 1 1 7 3888 1 1 9 ASP C C -11.667 5.847 -1.498 1.00 . A A . 9 ASP C 1 1 7 3889 1 1 9 ASP CA C -12.605 4.634 -1.509 1.00 . A A . 9 ASP CA 1 1 7 3890 1 1 9 ASP CB C -12.988 4.184 -0.100 1.00 . A A . 9 ASP CB 1 1 7 3891 1 1 9 ASP CG C -13.978 5.124 0.592 1.00 . A A . 9 ASP CG 1 1 7 3892 1 1 9 ASP H H -11.275 2.979 -1.678 1.00 . A A . 9 ASP H 1 1 7 3893 1 1 9 ASP HA H -13.521 4.915 -2.027 1.00 . A A . 9 ASP HA 1 1 7 3894 1 1 9 ASP HB2 H -13.463 3.206 -0.167 1.00 . A A . 9 ASP HB2 1 1 7 3895 1 1 9 ASP HB3 H -12.087 4.087 0.507 1.00 . A A . 9 ASP HB3 1 1 7 3896 1 1 9 ASP N N -11.975 3.504 -2.199 1.00 . A A . 9 ASP N 1 1 7 3897 1 1 9 ASP O O -11.681 6.684 -0.594 1.00 . A A . 9 ASP O 1 1 7 3898 1 1 9 ASP OD1 O -14.832 5.736 -0.091 1.00 . A A . 9 ASP OD1 1 1 7 3899 1 1 9 ASP OD2 O -13.998 5.107 1.842 1.00 . A A . 9 ASP OD2 1 1 7 3900 1 1 10 GLY C C -8.929 7.357 -1.949 1.00 . A A . 10 GLY C 1 1 7 3901 1 1 10 GLY CA C -10.109 7.183 -2.896 1.00 . A A . 10 GLY CA 1 1 7 3902 1 1 10 GLY H H -10.896 5.252 -3.253 1.00 . A A . 10 GLY H 1 1 7 3903 1 1 10 GLY HA2 H -10.728 8.075 -2.859 1.00 . A A . 10 GLY HA2 1 1 7 3904 1 1 10 GLY HA3 H -9.718 7.088 -3.906 1.00 . A A . 10 GLY HA3 1 1 7 3905 1 1 10 GLY N N -10.929 6.020 -2.599 1.00 . A A . 10 GLY N 1 1 7 3906 1 1 10 GLY O O -8.503 8.497 -1.746 1.00 . A A . 10 GLY O 1 1 7 3907 1 1 11 GLY C C -6.002 6.647 -1.437 1.00 . A A . 11 GLY C 1 1 7 3908 1 1 11 GLY CA C -7.218 6.370 -0.546 1.00 . A A . 11 GLY CA 1 1 7 3909 1 1 11 GLY H H -8.859 5.367 -1.440 1.00 . A A . 11 GLY H 1 1 7 3910 1 1 11 GLY HA2 H -7.078 5.433 -0.015 1.00 . A A . 11 GLY HA2 1 1 7 3911 1 1 11 GLY HA3 H -7.343 7.173 0.173 1.00 . A A . 11 GLY HA3 1 1 7 3912 1 1 11 GLY N N -8.437 6.281 -1.330 1.00 . A A . 11 GLY N 1 1 7 3913 1 1 11 GLY O O -6.056 6.377 -2.639 1.00 . A A . 11 GLY O 1 1 7 3914 1 1 12 ASP C C -2.576 6.503 -0.755 1.00 . A A . 12 ASP C 1 1 7 3915 1 1 12 ASP CA C -3.622 7.301 -1.549 1.00 . A A . 12 ASP CA 1 1 7 3916 1 1 12 ASP CB C -3.191 8.771 -1.782 1.00 . A A . 12 ASP CB 1 1 7 3917 1 1 12 ASP CG C -3.504 9.773 -0.665 1.00 . A A . 12 ASP CG 1 1 7 3918 1 1 12 ASP H H -4.938 7.333 0.135 1.00 . A A . 12 ASP H 1 1 7 3919 1 1 12 ASP HA H -3.689 6.824 -2.528 1.00 . A A . 12 ASP HA 1 1 7 3920 1 1 12 ASP HB2 H -2.125 8.807 -2.007 1.00 . A A . 12 ASP HB2 1 1 7 3921 1 1 12 ASP HB3 H -3.699 9.111 -2.684 1.00 . A A . 12 ASP HB3 1 1 7 3922 1 1 12 ASP N N -4.907 7.157 -0.856 1.00 . A A . 12 ASP N 1 1 7 3923 1 1 12 ASP O O -2.470 5.295 -0.900 1.00 . A A . 12 ASP O 1 1 7 3924 1 1 12 ASP OD1 O -2.739 9.799 0.334 1.00 . A A . 12 ASP OD1 1 1 7 3925 1 1 12 ASP OD2 O -4.454 10.578 -0.795 1.00 . A A . 12 ASP OD2 1 1 7 3926 1 1 13 CYS C C -0.870 6.810 2.364 1.00 . A A . 13 CYS C 1 1 7 3927 1 1 13 CYS CA C -0.702 6.581 0.869 1.00 . A A . 13 CYS CA 1 1 7 3928 1 1 13 CYS CB C 0.621 7.185 0.382 1.00 . A A . 13 CYS CB 1 1 7 3929 1 1 13 CYS H H -2.004 8.152 0.250 1.00 . A A . 13 CYS H 1 1 7 3930 1 1 13 CYS HA H -0.665 5.508 0.690 1.00 . A A . 13 CYS HA 1 1 7 3931 1 1 13 CYS HB2 H 0.573 8.269 0.408 1.00 . A A . 13 CYS HB2 1 1 7 3932 1 1 13 CYS HB3 H 1.417 6.884 1.060 1.00 . A A . 13 CYS HB3 1 1 7 3933 1 1 13 CYS N N -1.828 7.157 0.141 1.00 . A A . 13 CYS N 1 1 7 3934 1 1 13 CYS O O -0.739 5.871 3.155 1.00 . A A . 13 CYS O 1 1 7 3935 1 1 13 CYS SG S 1.088 6.680 -1.281 1.00 . A A . 13 CYS SG 1 1 7 3936 1 1 14 THR C C -2.615 7.675 4.658 1.00 . A A . 14 THR C 1 1 7 3937 1 1 14 THR CA C -1.350 8.379 4.169 1.00 . A A . 14 THR CA 1 1 7 3938 1 1 14 THR CB C -1.353 9.907 4.326 1.00 . A A . 14 THR CB 1 1 7 3939 1 1 14 THR CG2 C -1.151 10.332 5.779 1.00 . A A . 14 THR CG2 1 1 7 3940 1 1 14 THR H H -1.291 8.789 2.082 1.00 . A A . 14 THR H 1 1 7 3941 1 1 14 THR HA H -0.508 7.981 4.732 1.00 . A A . 14 THR HA 1 1 7 3942 1 1 14 THR HB H -2.295 10.308 3.951 1.00 . A A . 14 THR HB 1 1 7 3943 1 1 14 THR HG1 H 0.395 9.765 3.432 1.00 . A A . 14 THR HG1 1 1 7 3944 1 1 14 THR HG21 H -0.198 9.968 6.157 1.00 . A A . 14 THR HG21 1 1 7 3945 1 1 14 THR HG22 H -1.176 11.420 5.843 1.00 . A A . 14 THR HG22 1 1 7 3946 1 1 14 THR HG23 H -1.958 9.931 6.394 1.00 . A A . 14 THR HG23 1 1 7 3947 1 1 14 THR N N -1.179 8.044 2.763 1.00 . A A . 14 THR N 1 1 7 3948 1 1 14 THR O O -2.563 6.806 5.531 1.00 . A A . 14 THR O 1 1 7 3949 1 1 14 THR OG1 O -0.291 10.465 3.561 1.00 . A A . 14 THR OG1 1 1 7 3950 1 1 15 THR C C -5.327 5.993 4.047 1.00 . A A . 15 THR C 1 1 7 3951 1 1 15 THR CA C -5.064 7.488 4.354 1.00 . A A . 15 THR CA 1 1 7 3952 1 1 15 THR CB C -5.965 8.452 3.535 1.00 . A A . 15 THR CB 1 1 7 3953 1 1 15 THR CG2 C -5.771 8.309 2.021 1.00 . A A . 15 THR CG2 1 1 7 3954 1 1 15 THR H H -3.689 8.590 3.219 1.00 . A A . 15 THR H 1 1 7 3955 1 1 15 THR HA H -5.209 7.669 5.420 1.00 . A A . 15 THR HA 1 1 7 3956 1 1 15 THR HB H -5.691 9.472 3.801 1.00 . A A . 15 THR HB 1 1 7 3957 1 1 15 THR HG1 H -7.486 8.397 4.739 1.00 . A A . 15 THR HG1 1 1 7 3958 1 1 15 THR HG21 H -5.858 7.261 1.747 1.00 . A A . 15 THR HG21 1 1 7 3959 1 1 15 THR HG22 H -6.528 8.884 1.485 1.00 . A A . 15 THR HG22 1 1 7 3960 1 1 15 THR HG23 H -4.796 8.689 1.720 1.00 . A A . 15 THR HG23 1 1 7 3961 1 1 15 THR N N -3.727 7.911 3.968 1.00 . A A . 15 THR N 1 1 7 3962 1 1 15 THR O O -6.472 5.592 3.866 1.00 . A A . 15 THR O 1 1 7 3963 1 1 15 THR OG1 O -7.346 8.338 3.774 1.00 . A A . 15 THR OG1 1 1 7 3964 1 1 16 CYS C C -3.180 3.019 4.769 1.00 . A A . 16 CYS C 1 1 7 3965 1 1 16 CYS CA C -4.342 3.674 4.018 1.00 . A A . 16 CYS CA 1 1 7 3966 1 1 16 CYS CB C -4.203 3.279 2.537 1.00 . A A . 16 CYS CB 1 1 7 3967 1 1 16 CYS H H -3.442 5.558 4.439 1.00 . A A . 16 CYS H 1 1 7 3968 1 1 16 CYS HA H -5.275 3.267 4.426 1.00 . A A . 16 CYS HA 1 1 7 3969 1 1 16 CYS HB2 H -3.294 3.725 2.138 1.00 . A A . 16 CYS HB2 1 1 7 3970 1 1 16 CYS HB3 H -4.089 2.197 2.482 1.00 . A A . 16 CYS HB3 1 1 7 3971 1 1 16 CYS N N -4.316 5.132 4.178 1.00 . A A . 16 CYS N 1 1 7 3972 1 1 16 CYS O O -3.202 1.801 4.945 1.00 . A A . 16 CYS O 1 1 7 3973 1 1 16 CYS SG S -5.569 3.736 1.446 1.00 . A A . 16 CYS SG 1 1 7 3974 1 1 17 PHE C C -1.454 3.339 7.516 1.00 . A A . 17 PHE C 1 1 7 3975 1 1 17 PHE CA C -1.099 3.231 6.033 1.00 . A A . 17 PHE CA 1 1 7 3976 1 1 17 PHE CB C 0.225 3.938 5.701 1.00 . A A . 17 PHE CB 1 1 7 3977 1 1 17 PHE CD1 C 1.652 1.934 6.268 1.00 . A A . 17 PHE CD1 1 1 7 3978 1 1 17 PHE CD2 C 2.360 4.114 7.086 1.00 . A A . 17 PHE CD2 1 1 7 3979 1 1 17 PHE CE1 C 2.701 1.307 6.966 1.00 . A A . 17 PHE CE1 1 1 7 3980 1 1 17 PHE CE2 C 3.431 3.495 7.760 1.00 . A A . 17 PHE CE2 1 1 7 3981 1 1 17 PHE CG C 1.446 3.322 6.363 1.00 . A A . 17 PHE CG 1 1 7 3982 1 1 17 PHE CZ C 3.589 2.093 7.724 1.00 . A A . 17 PHE CZ 1 1 7 3983 1 1 17 PHE H H -2.147 4.774 5.046 1.00 . A A . 17 PHE H 1 1 7 3984 1 1 17 PHE HA H -0.991 2.174 5.790 1.00 . A A . 17 PHE HA 1 1 7 3985 1 1 17 PHE HB2 H 0.379 3.898 4.622 1.00 . A A . 17 PHE HB2 1 1 7 3986 1 1 17 PHE HB3 H 0.136 4.981 6.004 1.00 . A A . 17 PHE HB3 1 1 7 3987 1 1 17 PHE HD1 H 0.989 1.364 5.638 1.00 . A A . 17 PHE HD1 1 1 7 3988 1 1 17 PHE HD2 H 2.220 5.191 7.156 1.00 . A A . 17 PHE HD2 1 1 7 3989 1 1 17 PHE HE1 H 2.837 0.228 6.913 1.00 . A A . 17 PHE HE1 1 1 7 3990 1 1 17 PHE HE2 H 4.105 4.107 8.345 1.00 . A A . 17 PHE HE2 1 1 7 3991 1 1 17 PHE HZ H 4.377 1.618 8.296 1.00 . A A . 17 PHE HZ 1 1 7 3992 1 1 17 PHE N N -2.173 3.778 5.220 1.00 . A A . 17 PHE N 1 1 7 3993 1 1 17 PHE O O -1.175 2.410 8.275 1.00 . A A . 17 PHE O 1 1 7 3994 1 1 18 ASN C C -1.208 4.599 10.249 1.00 . A A . 18 ASN C 1 1 7 3995 1 1 18 ASN CA C -2.432 4.748 9.336 1.00 . A A . 18 ASN CA 1 1 7 3996 1 1 18 ASN CB C -3.581 3.858 9.813 1.00 . A A . 18 ASN CB 1 1 7 3997 1 1 18 ASN CG C -4.368 4.475 10.968 1.00 . A A . 18 ASN CG 1 1 7 3998 1 1 18 ASN H H -2.204 5.200 7.281 1.00 . A A . 18 ASN H 1 1 7 3999 1 1 18 ASN HA H -2.762 5.786 9.376 1.00 . A A . 18 ASN HA 1 1 7 4000 1 1 18 ASN HB2 H -4.274 3.661 8.993 1.00 . A A . 18 ASN HB2 1 1 7 4001 1 1 18 ASN HB3 H -3.111 2.926 10.121 1.00 . A A . 18 ASN HB3 1 1 7 4002 1 1 18 ASN HD21 H -2.817 4.367 12.242 1.00 . A A . 18 ASN HD21 1 1 7 4003 1 1 18 ASN HD22 H -4.317 4.987 12.938 1.00 . A A . 18 ASN HD22 1 1 7 4004 1 1 18 ASN N N -2.105 4.432 7.938 1.00 . A A . 18 ASN N 1 1 7 4005 1 1 18 ASN ND2 N -3.795 4.626 12.145 1.00 . A A . 18 ASN ND2 1 1 7 4006 1 1 18 ASN O O -1.281 4.056 11.350 1.00 . A A . 18 ASN O 1 1 7 4007 1 1 18 ASN OD1 O -5.529 4.831 10.812 1.00 . A A . 18 ASN OD1 1 1 7 4008 1 1 19 ASN C C 1.365 3.204 10.821 1.00 . A A . 19 ASN C 1 1 7 4009 1 1 19 ASN CA C 1.254 4.643 10.303 1.00 . A A . 19 ASN CA 1 1 7 4010 1 1 19 ASN CB C 1.745 5.723 11.274 1.00 . A A . 19 ASN CB 1 1 7 4011 1 1 19 ASN CG C 3.260 5.703 11.446 1.00 . A A . 19 ASN CG 1 1 7 4012 1 1 19 ASN H H -0.068 5.492 8.876 1.00 . A A . 19 ASN H 1 1 7 4013 1 1 19 ASN HA H 1.889 4.685 9.446 1.00 . A A . 19 ASN HA 1 1 7 4014 1 1 19 ASN HB2 H 1.475 6.697 10.868 1.00 . A A . 19 ASN HB2 1 1 7 4015 1 1 19 ASN HB3 H 1.262 5.598 12.243 1.00 . A A . 19 ASN HB3 1 1 7 4016 1 1 19 ASN HD21 H 3.204 7.404 12.532 1.00 . A A . 19 ASN HD21 1 1 7 4017 1 1 19 ASN HD22 H 4.812 6.768 12.203 1.00 . A A . 19 ASN HD22 1 1 7 4018 1 1 19 ASN N N -0.043 4.974 9.751 1.00 . A A . 19 ASN N 1 1 7 4019 1 1 19 ASN ND2 N 3.805 6.735 12.060 1.00 . A A . 19 ASN ND2 1 1 7 4020 1 1 19 ASN O O 1.597 2.961 12.007 1.00 . A A . 19 ASN O 1 1 7 4021 1 1 19 ASN OD1 O 3.960 4.802 10.984 1.00 . A A . 19 ASN OD1 1 1 7 4022 1 1 20 GLY C C 0.231 0.099 10.808 1.00 . A A . 20 GLY C 1 1 7 4023 1 1 20 GLY CA C 1.415 0.824 10.168 1.00 . A A . 20 GLY CA 1 1 7 4024 1 1 20 GLY H H 0.928 2.492 8.975 1.00 . A A . 20 GLY H 1 1 7 4025 1 1 20 GLY HA2 H 2.304 0.710 10.784 1.00 . A A . 20 GLY HA2 1 1 7 4026 1 1 20 GLY HA3 H 1.626 0.338 9.218 1.00 . A A . 20 GLY HA3 1 1 7 4027 1 1 20 GLY N N 1.184 2.239 9.920 1.00 . A A . 20 GLY N 1 1 7 4028 1 1 20 GLY O O 0.422 -0.972 11.373 1.00 . A A . 20 GLY O 1 1 7 4029 1 1 21 THR C C -3.299 -0.125 10.289 1.00 . A A . 21 THR C 1 1 7 4030 1 1 21 THR CA C -2.184 0.088 11.330 1.00 . A A . 21 THR CA 1 1 7 4031 1 1 21 THR CB C -2.533 1.048 12.473 1.00 . A A . 21 THR CB 1 1 7 4032 1 1 21 THR CG2 C -4.002 1.322 12.739 1.00 . A A . 21 THR CG2 1 1 7 4033 1 1 21 THR H H -1.117 1.540 10.280 1.00 . A A . 21 THR H 1 1 7 4034 1 1 21 THR HA H -1.960 -0.866 11.783 1.00 . A A . 21 THR HA 1 1 7 4035 1 1 21 THR HB H -2.125 1.993 12.176 1.00 . A A . 21 THR HB 1 1 7 4036 1 1 21 THR HG1 H -2.065 -0.261 13.807 1.00 . A A . 21 THR HG1 1 1 7 4037 1 1 21 THR HG21 H -4.451 1.678 11.813 1.00 . A A . 21 THR HG21 1 1 7 4038 1 1 21 THR HG22 H -4.497 0.416 13.072 1.00 . A A . 21 THR HG22 1 1 7 4039 1 1 21 THR HG23 H -4.101 2.096 13.497 1.00 . A A . 21 THR HG23 1 1 7 4040 1 1 21 THR N N -0.985 0.642 10.719 1.00 . A A . 21 THR N 1 1 7 4041 1 1 21 THR O O -4.274 -0.825 10.568 1.00 . A A . 21 THR O 1 1 7 4042 1 1 21 THR OG1 O -1.865 0.695 13.670 1.00 . A A . 21 THR OG1 1 1 7 4043 1 1 22 GLY C C -4.260 -0.785 7.280 1.00 . A A . 22 GLY C 1 1 7 4044 1 1 22 GLY CA C -4.203 0.513 8.082 1.00 . A A . 22 GLY CA 1 1 7 4045 1 1 22 GLY H H -2.305 0.950 8.878 1.00 . A A . 22 GLY H 1 1 7 4046 1 1 22 GLY HA2 H -3.983 1.343 7.412 1.00 . A A . 22 GLY HA2 1 1 7 4047 1 1 22 GLY HA3 H -5.172 0.684 8.555 1.00 . A A . 22 GLY HA3 1 1 7 4048 1 1 22 GLY N N -3.171 0.475 9.101 1.00 . A A . 22 GLY N 1 1 7 4049 1 1 22 GLY O O -3.622 -1.776 7.649 1.00 . A A . 22 GLY O 1 1 7 4050 1 1 23 PRO C C -3.800 -2.169 4.602 1.00 . A A . 23 PRO C 1 1 7 4051 1 1 23 PRO CA C -5.135 -1.950 5.313 1.00 . A A . 23 PRO CA 1 1 7 4052 1 1 23 PRO CB C -6.279 -1.634 4.350 1.00 . A A . 23 PRO CB 1 1 7 4053 1 1 23 PRO CD C -5.884 0.292 5.715 1.00 . A A . 23 PRO CD 1 1 7 4054 1 1 23 PRO CG C -6.363 -0.112 4.325 1.00 . A A . 23 PRO CG 1 1 7 4055 1 1 23 PRO HA H -5.386 -2.844 5.885 1.00 . A A . 23 PRO HA 1 1 7 4056 1 1 23 PRO HB2 H -6.098 -2.054 3.363 1.00 . A A . 23 PRO HB2 1 1 7 4057 1 1 23 PRO HB3 H -7.207 -2.033 4.750 1.00 . A A . 23 PRO HB3 1 1 7 4058 1 1 23 PRO HD2 H -5.355 1.237 5.667 1.00 . A A . 23 PRO HD2 1 1 7 4059 1 1 23 PRO HD3 H -6.729 0.424 6.377 1.00 . A A . 23 PRO HD3 1 1 7 4060 1 1 23 PRO HG2 H -5.685 0.287 3.571 1.00 . A A . 23 PRO HG2 1 1 7 4061 1 1 23 PRO HG3 H -7.380 0.230 4.143 1.00 . A A . 23 PRO HG3 1 1 7 4062 1 1 23 PRO N N -5.044 -0.800 6.191 1.00 . A A . 23 PRO N 1 1 7 4063 1 1 23 PRO O O -3.183 -3.227 4.753 1.00 . A A . 23 PRO O 1 1 7 4064 1 1 24 CYS C C -0.980 -0.839 4.173 1.00 . A A . 24 CYS C 1 1 7 4065 1 1 24 CYS CA C -2.054 -1.242 3.164 1.00 . A A . 24 CYS CA 1 1 7 4066 1 1 24 CYS CB C -2.027 -0.422 1.851 1.00 . A A . 24 CYS CB 1 1 7 4067 1 1 24 CYS H H -3.780 -0.273 3.908 1.00 . A A . 24 CYS H 1 1 7 4068 1 1 24 CYS HA H -1.880 -2.278 2.885 1.00 . A A . 24 CYS HA 1 1 7 4069 1 1 24 CYS HB2 H -3.034 -0.205 1.508 1.00 . A A . 24 CYS HB2 1 1 7 4070 1 1 24 CYS HB3 H -1.516 0.529 1.990 1.00 . A A . 24 CYS HB3 1 1 7 4071 1 1 24 CYS N N -3.331 -1.174 3.841 1.00 . A A . 24 CYS N 1 1 7 4072 1 1 24 CYS O O -0.415 0.248 4.064 1.00 . A A . 24 CYS O 1 1 7 4073 1 1 24 CYS SG S -1.195 -1.261 0.483 1.00 . A A . 24 CYS SG 1 1 7 4074 1 1 25 ALA C C 1.638 -2.574 5.697 1.00 . A A . 25 ALA C 1 1 7 4075 1 1 25 ALA CA C 0.508 -1.586 5.989 1.00 . A A . 25 ALA CA 1 1 7 4076 1 1 25 ALA CB C 0.026 -1.676 7.433 1.00 . A A . 25 ALA CB 1 1 7 4077 1 1 25 ALA H H -1.154 -2.605 5.123 1.00 . A A . 25 ALA H 1 1 7 4078 1 1 25 ALA HA H 0.928 -0.601 5.848 1.00 . A A . 25 ALA HA 1 1 7 4079 1 1 25 ALA HB1 H -0.387 -2.667 7.617 1.00 . A A . 25 ALA HB1 1 1 7 4080 1 1 25 ALA HB2 H -0.734 -0.914 7.616 1.00 . A A . 25 ALA HB2 1 1 7 4081 1 1 25 ALA HB3 H 0.876 -1.511 8.092 1.00 . A A . 25 ALA HB3 1 1 7 4082 1 1 25 ALA N N -0.623 -1.745 5.087 1.00 . A A . 25 ALA N 1 1 7 4083 1 1 25 ALA O O 2.799 -2.161 5.617 1.00 . A A . 25 ALA O 1 1 7 4084 1 1 26 ASN C C 3.099 -4.893 4.041 1.00 . A A . 26 ASN C 1 1 7 4085 1 1 26 ASN CA C 2.369 -4.894 5.394 1.00 . A A . 26 ASN CA 1 1 7 4086 1 1 26 ASN CB C 1.774 -6.284 5.675 1.00 . A A . 26 ASN CB 1 1 7 4087 1 1 26 ASN CG C 0.704 -6.750 4.691 1.00 . A A . 26 ASN CG 1 1 7 4088 1 1 26 ASN H H 0.363 -4.155 5.609 1.00 . A A . 26 ASN H 1 1 7 4089 1 1 26 ASN HA H 3.127 -4.670 6.154 1.00 . A A . 26 ASN HA 1 1 7 4090 1 1 26 ASN HB2 H 2.585 -7.010 5.679 1.00 . A A . 26 ASN HB2 1 1 7 4091 1 1 26 ASN HB3 H 1.332 -6.268 6.661 1.00 . A A . 26 ASN HB3 1 1 7 4092 1 1 26 ASN HD21 H 0.183 -8.284 5.906 1.00 . A A . 26 ASN HD21 1 1 7 4093 1 1 26 ASN HD22 H -0.796 -8.103 4.458 1.00 . A A . 26 ASN HD22 1 1 7 4094 1 1 26 ASN N N 1.335 -3.862 5.532 1.00 . A A . 26 ASN N 1 1 7 4095 1 1 26 ASN ND2 N -0.003 -7.814 5.031 1.00 . A A . 26 ASN ND2 1 1 7 4096 1 1 26 ASN O O 4.015 -5.697 3.843 1.00 . A A . 26 ASN O 1 1 7 4097 1 1 26 ASN OD1 O 0.504 -6.170 3.631 1.00 . A A . 26 ASN OD1 1 1 7 4098 1 1 27 CYS C C 4.519 -2.637 2.052 1.00 . A A . 27 CYS C 1 1 7 4099 1 1 27 CYS CA C 3.480 -3.757 1.877 1.00 . A A . 27 CYS CA 1 1 7 4100 1 1 27 CYS CB C 2.571 -3.606 0.661 1.00 . A A . 27 CYS CB 1 1 7 4101 1 1 27 CYS H H 1.962 -3.365 3.330 1.00 . A A . 27 CYS H 1 1 7 4102 1 1 27 CYS HA H 4.009 -4.642 1.547 1.00 . A A . 27 CYS HA 1 1 7 4103 1 1 27 CYS HB2 H 1.953 -2.722 0.696 1.00 . A A . 27 CYS HB2 1 1 7 4104 1 1 27 CYS HB3 H 3.205 -3.478 -0.211 1.00 . A A . 27 CYS HB3 1 1 7 4105 1 1 27 CYS N N 2.729 -4.007 3.113 1.00 . A A . 27 CYS N 1 1 7 4106 1 1 27 CYS O O 5.119 -2.247 1.059 1.00 . A A . 27 CYS O 1 1 7 4107 1 1 27 CYS SG S 1.585 -5.104 0.417 1.00 . A A . 27 CYS SG 1 1 7 4108 1 1 28 LEU C C 7.045 -1.625 4.113 1.00 . A A . 28 LEU C 1 1 7 4109 1 1 28 LEU CA C 5.777 -1.061 3.484 1.00 . A A . 28 LEU CA 1 1 7 4110 1 1 28 LEU CB C 5.219 -0.009 4.447 1.00 . A A . 28 LEU CB 1 1 7 4111 1 1 28 LEU CD1 C 4.837 1.893 2.816 1.00 . A A . 28 LEU CD1 1 1 7 4112 1 1 28 LEU CD2 C 3.028 0.287 3.159 1.00 . A A . 28 LEU CD2 1 1 7 4113 1 1 28 LEU CG C 4.210 0.952 3.832 1.00 . A A . 28 LEU CG 1 1 7 4114 1 1 28 LEU H H 4.054 -2.134 3.996 1.00 . A A . 28 LEU H 1 1 7 4115 1 1 28 LEU HA H 6.046 -0.585 2.539 1.00 . A A . 28 LEU HA 1 1 7 4116 1 1 28 LEU HB2 H 4.758 -0.505 5.304 1.00 . A A . 28 LEU HB2 1 1 7 4117 1 1 28 LEU HB3 H 6.048 0.579 4.837 1.00 . A A . 28 LEU HB3 1 1 7 4118 1 1 28 LEU HD11 H 5.871 2.121 3.082 1.00 . A A . 28 LEU HD11 1 1 7 4119 1 1 28 LEU HD12 H 4.805 1.387 1.858 1.00 . A A . 28 LEU HD12 1 1 7 4120 1 1 28 LEU HD13 H 4.248 2.804 2.750 1.00 . A A . 28 LEU HD13 1 1 7 4121 1 1 28 LEU HD21 H 2.659 -0.490 3.814 1.00 . A A . 28 LEU HD21 1 1 7 4122 1 1 28 LEU HD22 H 2.239 1.016 3.030 1.00 . A A . 28 LEU HD22 1 1 7 4123 1 1 28 LEU HD23 H 3.334 -0.131 2.187 1.00 . A A . 28 LEU HD23 1 1 7 4124 1 1 28 LEU HG H 3.833 1.505 4.664 1.00 . A A . 28 LEU HG 1 1 7 4125 1 1 28 LEU N N 4.757 -2.088 3.259 1.00 . A A . 28 LEU N 1 1 7 4126 1 1 28 LEU O O 8.137 -1.448 3.572 1.00 . A A . 28 LEU O 1 1 7 4127 1 1 29 ALA C C 8.929 -3.582 5.803 1.00 . A A . 29 ALA C 1 1 7 4128 1 1 29 ALA CA C 7.982 -2.464 6.251 1.00 . A A . 29 ALA CA 1 1 7 4129 1 1 29 ALA CB C 7.355 -2.828 7.598 1.00 . A A . 29 ALA CB 1 1 7 4130 1 1 29 ALA H H 5.954 -2.320 5.657 1.00 . A A . 29 ALA H 1 1 7 4131 1 1 29 ALA HA H 8.564 -1.548 6.371 1.00 . A A . 29 ALA HA 1 1 7 4132 1 1 29 ALA HB1 H 8.142 -3.020 8.328 1.00 . A A . 29 ALA HB1 1 1 7 4133 1 1 29 ALA HB2 H 6.746 -3.726 7.484 1.00 . A A . 29 ALA HB2 1 1 7 4134 1 1 29 ALA HB3 H 6.729 -2.012 7.960 1.00 . A A . 29 ALA HB3 1 1 7 4135 1 1 29 ALA N N 6.895 -2.213 5.304 1.00 . A A . 29 ALA N 1 1 7 4136 1 1 29 ALA O O 9.996 -3.775 6.389 1.00 . A A . 29 ALA O 1 1 7 4137 1 1 30 GLY C C 8.721 -5.655 2.833 1.00 . A A . 30 GLY C 1 1 7 4138 1 1 30 GLY CA C 9.320 -5.392 4.192 1.00 . A A . 30 GLY CA 1 1 7 4139 1 1 30 GLY H H 7.650 -4.126 4.349 1.00 . A A . 30 GLY H 1 1 7 4140 1 1 30 GLY HA2 H 9.240 -6.279 4.821 1.00 . A A . 30 GLY HA2 1 1 7 4141 1 1 30 GLY HA3 H 10.359 -5.087 4.098 1.00 . A A . 30 GLY HA3 1 1 7 4142 1 1 30 GLY N N 8.542 -4.329 4.776 1.00 . A A . 30 GLY N 1 1 7 4143 1 1 30 GLY O O 7.853 -6.520 2.712 1.00 . A A . 30 GLY O 1 1 7 4144 1 1 31 TYR C C 9.328 -5.054 -0.641 1.00 . A A . 31 TYR C 1 1 7 4145 1 1 31 TYR CA C 8.409 -4.842 0.565 1.00 . A A . 31 TYR CA 1 1 7 4146 1 1 31 TYR CB C 7.696 -3.483 0.519 1.00 . A A . 31 TYR CB 1 1 7 4147 1 1 31 TYR CD1 C 9.891 -2.208 0.125 1.00 . A A . 31 TYR CD1 1 1 7 4148 1 1 31 TYR CD2 C 7.790 -1.326 -0.702 1.00 . A A . 31 TYR CD2 1 1 7 4149 1 1 31 TYR CE1 C 10.578 -1.176 -0.533 1.00 . A A . 31 TYR CE1 1 1 7 4150 1 1 31 TYR CE2 C 8.458 -0.295 -1.369 1.00 . A A . 31 TYR CE2 1 1 7 4151 1 1 31 TYR CG C 8.490 -2.287 0.027 1.00 . A A . 31 TYR CG 1 1 7 4152 1 1 31 TYR CZ C 9.865 -0.234 -1.307 1.00 . A A . 31 TYR CZ 1 1 7 4153 1 1 31 TYR H H 9.858 -4.189 1.982 1.00 . A A . 31 TYR H 1 1 7 4154 1 1 31 TYR HA H 7.663 -5.621 0.522 1.00 . A A . 31 TYR HA 1 1 7 4155 1 1 31 TYR HB2 H 6.859 -3.631 -0.157 1.00 . A A . 31 TYR HB2 1 1 7 4156 1 1 31 TYR HB3 H 7.281 -3.209 1.494 1.00 . A A . 31 TYR HB3 1 1 7 4157 1 1 31 TYR HD1 H 10.444 -3.014 0.582 1.00 . A A . 31 TYR HD1 1 1 7 4158 1 1 31 TYR HD2 H 6.730 -1.457 -0.791 1.00 . A A . 31 TYR HD2 1 1 7 4159 1 1 31 TYR HE1 H 11.654 -1.150 -0.511 1.00 . A A . 31 TYR HE1 1 1 7 4160 1 1 31 TYR HE2 H 7.891 0.392 -1.995 1.00 . A A . 31 TYR HE2 1 1 7 4161 1 1 31 TYR HH H 11.422 0.276 -2.338 1.00 . A A . 31 TYR HH 1 1 7 4162 1 1 31 TYR N N 9.103 -4.845 1.842 1.00 . A A . 31 TYR N 1 1 7 4163 1 1 31 TYR O O 9.142 -4.418 -1.681 1.00 . A A . 31 TYR O 1 1 7 4164 1 1 31 TYR OH O 10.538 0.623 -2.120 1.00 . A A . 31 TYR OH 1 1 7 4165 1 1 32 PRO C C 10.430 -6.744 -2.998 1.00 . A A . 32 PRO C 1 1 7 4166 1 1 32 PRO CA C 11.131 -6.194 -1.749 1.00 . A A . 32 PRO CA 1 1 7 4167 1 1 32 PRO CB C 12.234 -7.104 -1.220 1.00 . A A . 32 PRO CB 1 1 7 4168 1 1 32 PRO CD C 10.441 -7.080 0.365 1.00 . A A . 32 PRO CD 1 1 7 4169 1 1 32 PRO CG C 11.527 -7.989 -0.194 1.00 . A A . 32 PRO CG 1 1 7 4170 1 1 32 PRO HA H 11.550 -5.207 -1.956 1.00 . A A . 32 PRO HA 1 1 7 4171 1 1 32 PRO HB2 H 12.679 -7.682 -2.018 1.00 . A A . 32 PRO HB2 1 1 7 4172 1 1 32 PRO HB3 H 13.000 -6.509 -0.721 1.00 . A A . 32 PRO HB3 1 1 7 4173 1 1 32 PRO HD2 H 9.539 -7.643 0.602 1.00 . A A . 32 PRO HD2 1 1 7 4174 1 1 32 PRO HD3 H 10.830 -6.597 1.257 1.00 . A A . 32 PRO HD3 1 1 7 4175 1 1 32 PRO HG2 H 11.078 -8.855 -0.683 1.00 . A A . 32 PRO HG2 1 1 7 4176 1 1 32 PRO HG3 H 12.207 -8.287 0.599 1.00 . A A . 32 PRO HG3 1 1 7 4177 1 1 32 PRO N N 10.183 -6.085 -0.658 1.00 . A A . 32 PRO N 1 1 7 4178 1 1 32 PRO O O 10.768 -6.373 -4.124 1.00 . A A . 32 PRO O 1 1 7 4179 1 1 33 ALA C C 7.217 -7.339 -3.935 1.00 . A A . 33 ALA C 1 1 7 4180 1 1 33 ALA CA C 8.520 -8.138 -3.786 1.00 . A A . 33 ALA CA 1 1 7 4181 1 1 33 ALA CB C 8.185 -9.559 -3.331 1.00 . A A . 33 ALA CB 1 1 7 4182 1 1 33 ALA H H 9.211 -7.817 -1.823 1.00 . A A . 33 ALA H 1 1 7 4183 1 1 33 ALA HA H 9.027 -8.183 -4.749 1.00 . A A . 33 ALA HA 1 1 7 4184 1 1 33 ALA HB1 H 7.553 -10.047 -4.076 1.00 . A A . 33 ALA HB1 1 1 7 4185 1 1 33 ALA HB2 H 9.104 -10.134 -3.208 1.00 . A A . 33 ALA HB2 1 1 7 4186 1 1 33 ALA HB3 H 7.647 -9.502 -2.382 1.00 . A A . 33 ALA HB3 1 1 7 4187 1 1 33 ALA N N 9.407 -7.573 -2.782 1.00 . A A . 33 ALA N 1 1 7 4188 1 1 33 ALA O O 6.343 -7.747 -4.698 1.00 . A A . 33 ALA O 1 1 7 4189 1 1 34 GLY C C 5.170 -5.094 -4.361 1.00 . A A . 34 GLY C 1 1 7 4190 1 1 34 GLY CA C 5.722 -5.606 -3.029 1.00 . A A . 34 GLY CA 1 1 7 4191 1 1 34 GLY H H 7.803 -5.884 -2.644 1.00 . A A . 34 GLY H 1 1 7 4192 1 1 34 GLY HA2 H 5.813 -4.768 -2.340 1.00 . A A . 34 GLY HA2 1 1 7 4193 1 1 34 GLY HA3 H 5.020 -6.333 -2.618 1.00 . A A . 34 GLY HA3 1 1 7 4194 1 1 34 GLY N N 7.030 -6.246 -3.182 1.00 . A A . 34 GLY N 1 1 7 4195 1 1 34 GLY O O 3.962 -5.049 -4.560 1.00 . A A . 34 GLY O 1 1 7 4196 1 1 35 CYS C C 5.071 -5.330 -7.504 1.00 . A A . 35 CYS C 1 1 7 4197 1 1 35 CYS CA C 5.763 -4.281 -6.640 1.00 . A A . 35 CYS CA 1 1 7 4198 1 1 35 CYS CB C 7.097 -3.944 -7.295 1.00 . A A . 35 CYS CB 1 1 7 4199 1 1 35 CYS H H 7.034 -4.831 -5.058 1.00 . A A . 35 CYS H 1 1 7 4200 1 1 35 CYS HA H 5.146 -3.384 -6.578 1.00 . A A . 35 CYS HA 1 1 7 4201 1 1 35 CYS HB2 H 7.585 -4.894 -7.543 1.00 . A A . 35 CYS HB2 1 1 7 4202 1 1 35 CYS HB3 H 6.937 -3.396 -8.225 1.00 . A A . 35 CYS HB3 1 1 7 4203 1 1 35 CYS N N 6.056 -4.760 -5.296 1.00 . A A . 35 CYS N 1 1 7 4204 1 1 35 CYS O O 4.359 -4.977 -8.445 1.00 . A A . 35 CYS O 1 1 7 4205 1 1 35 CYS SG S 8.142 -2.981 -6.178 1.00 . A A . 35 CYS SG 1 1 7 4206 1 1 36 SER C C 3.519 -8.320 -6.959 1.00 . A A . 36 SER C 1 1 7 4207 1 1 36 SER CA C 4.662 -7.752 -7.814 1.00 . A A . 36 SER CA 1 1 7 4208 1 1 36 SER CB C 5.773 -8.769 -8.054 1.00 . A A . 36 SER CB 1 1 7 4209 1 1 36 SER H H 5.891 -6.850 -6.416 1.00 . A A . 36 SER H 1 1 7 4210 1 1 36 SER HA H 4.250 -7.451 -8.773 1.00 . A A . 36 SER HA 1 1 7 4211 1 1 36 SER HB2 H 6.330 -8.911 -7.129 1.00 . A A . 36 SER HB2 1 1 7 4212 1 1 36 SER HB3 H 5.338 -9.712 -8.352 1.00 . A A . 36 SER HB3 1 1 7 4213 1 1 36 SER HG H 6.190 -8.398 -9.916 1.00 . A A . 36 SER HG 1 1 7 4214 1 1 36 SER N N 5.278 -6.607 -7.185 1.00 . A A . 36 SER N 1 1 7 4215 1 1 36 SER O O 2.864 -9.288 -7.361 1.00 . A A . 36 SER O 1 1 7 4216 1 1 36 SER OG O 6.655 -8.299 -9.065 1.00 . A A . 36 SER OG 1 1 7 4217 1 1 37 ASN C C 1.006 -6.890 -5.731 1.00 . A A . 37 ASN C 1 1 7 4218 1 1 37 ASN CA C 1.963 -7.898 -5.127 1.00 . A A . 37 ASN CA 1 1 7 4219 1 1 37 ASN CB C 2.078 -7.801 -3.596 1.00 . A A . 37 ASN CB 1 1 7 4220 1 1 37 ASN CG C 1.799 -9.169 -3.007 1.00 . A A . 37 ASN CG 1 1 7 4221 1 1 37 ASN H H 3.745 -6.878 -5.546 1.00 . A A . 37 ASN H 1 1 7 4222 1 1 37 ASN HA H 1.580 -8.881 -5.352 1.00 . A A . 37 ASN HA 1 1 7 4223 1 1 37 ASN HB2 H 3.068 -7.458 -3.299 1.00 . A A . 37 ASN HB2 1 1 7 4224 1 1 37 ASN HB3 H 1.355 -7.090 -3.191 1.00 . A A . 37 ASN HB3 1 1 7 4225 1 1 37 ASN HD21 H -0.129 -8.683 -2.538 1.00 . A A . 37 ASN HD21 1 1 7 4226 1 1 37 ASN HD22 H 0.333 -10.326 -2.232 1.00 . A A . 37 ASN HD22 1 1 7 4227 1 1 37 ASN N N 3.237 -7.720 -5.796 1.00 . A A . 37 ASN N 1 1 7 4228 1 1 37 ASN ND2 N 0.582 -9.398 -2.554 1.00 . A A . 37 ASN ND2 1 1 7 4229 1 1 37 ASN O O 0.858 -5.810 -5.173 1.00 . A A . 37 ASN O 1 1 7 4230 1 1 37 ASN OD1 O 2.647 -10.062 -2.995 1.00 . A A . 37 ASN OD1 1 1 7 4231 1 1 38 SER C C -1.609 -5.680 -6.762 1.00 . A A . 38 SER C 1 1 7 4232 1 1 38 SER CA C -0.526 -6.356 -7.620 1.00 . A A . 38 SER CA 1 1 7 4233 1 1 38 SER CB C -1.124 -7.141 -8.771 1.00 . A A . 38 SER CB 1 1 7 4234 1 1 38 SER H H 0.601 -8.104 -7.320 1.00 . A A . 38 SER H 1 1 7 4235 1 1 38 SER HA H 0.039 -5.581 -8.122 1.00 . A A . 38 SER HA 1 1 7 4236 1 1 38 SER HB2 H -1.735 -7.924 -8.347 1.00 . A A . 38 SER HB2 1 1 7 4237 1 1 38 SER HB3 H -1.733 -6.480 -9.390 1.00 . A A . 38 SER HB3 1 1 7 4238 1 1 38 SER HG H -0.462 -8.411 -10.100 1.00 . A A . 38 SER HG 1 1 7 4239 1 1 38 SER N N 0.377 -7.229 -6.862 1.00 . A A . 38 SER N 1 1 7 4240 1 1 38 SER O O -2.099 -4.617 -7.139 1.00 . A A . 38 SER O 1 1 7 4241 1 1 38 SER OG O -0.078 -7.700 -9.551 1.00 . A A . 38 SER OG 1 1 7 4242 1 1 39 ASP C C -2.231 -4.330 -4.015 1.00 . A A . 39 ASP C 1 1 7 4243 1 1 39 ASP CA C -2.835 -5.613 -4.604 1.00 . A A . 39 ASP CA 1 1 7 4244 1 1 39 ASP CB C -3.077 -6.607 -3.465 1.00 . A A . 39 ASP CB 1 1 7 4245 1 1 39 ASP CG C -4.046 -6.055 -2.418 1.00 . A A . 39 ASP CG 1 1 7 4246 1 1 39 ASP H H -1.614 -7.171 -5.416 1.00 . A A . 39 ASP H 1 1 7 4247 1 1 39 ASP HA H -3.792 -5.377 -5.067 1.00 . A A . 39 ASP HA 1 1 7 4248 1 1 39 ASP HB2 H -3.481 -7.523 -3.887 1.00 . A A . 39 ASP HB2 1 1 7 4249 1 1 39 ASP HB3 H -2.129 -6.860 -2.986 1.00 . A A . 39 ASP HB3 1 1 7 4250 1 1 39 ASP N N -1.970 -6.244 -5.608 1.00 . A A . 39 ASP N 1 1 7 4251 1 1 39 ASP O O -2.938 -3.351 -3.795 1.00 . A A . 39 ASP O 1 1 7 4252 1 1 39 ASP OD1 O -5.266 -6.009 -2.705 1.00 . A A . 39 ASP OD1 1 1 7 4253 1 1 39 ASP OD2 O -3.615 -5.761 -1.288 1.00 . A A . 39 ASP OD2 1 1 7 4254 1 1 40 CYS C C 0.627 -2.450 -4.198 1.00 . A A . 40 CYS C 1 1 7 4255 1 1 40 CYS CA C -0.103 -3.290 -3.155 1.00 . A A . 40 CYS CA 1 1 7 4256 1 1 40 CYS CB C 0.886 -3.975 -2.191 1.00 . A A . 40 CYS CB 1 1 7 4257 1 1 40 CYS H H -0.393 -5.102 -4.167 1.00 . A A . 40 CYS H 1 1 7 4258 1 1 40 CYS HA H -0.742 -2.616 -2.588 1.00 . A A . 40 CYS HA 1 1 7 4259 1 1 40 CYS HB2 H 1.340 -4.833 -2.699 1.00 . A A . 40 CYS HB2 1 1 7 4260 1 1 40 CYS HB3 H 1.719 -3.322 -1.872 1.00 . A A . 40 CYS HB3 1 1 7 4261 1 1 40 CYS N N -0.919 -4.328 -3.783 1.00 . A A . 40 CYS N 1 1 7 4262 1 1 40 CYS O O 1.114 -1.374 -3.872 1.00 . A A . 40 CYS O 1 1 7 4263 1 1 40 CYS SG S 0.025 -4.510 -0.699 1.00 . A A . 40 CYS SG 1 1 7 4264 1 1 41 THR C C 1.105 -0.845 -6.766 1.00 . A A . 41 THR C 1 1 7 4265 1 1 41 THR CA C 1.494 -2.301 -6.494 1.00 . A A . 41 THR CA 1 1 7 4266 1 1 41 THR CB C 1.334 -3.201 -7.718 1.00 . A A . 41 THR CB 1 1 7 4267 1 1 41 THR CG2 C 1.939 -2.681 -9.005 1.00 . A A . 41 THR CG2 1 1 7 4268 1 1 41 THR H H 0.412 -3.861 -5.625 1.00 . A A . 41 THR H 1 1 7 4269 1 1 41 THR HA H 2.531 -2.316 -6.157 1.00 . A A . 41 THR HA 1 1 7 4270 1 1 41 THR HB H 0.270 -3.357 -7.891 1.00 . A A . 41 THR HB 1 1 7 4271 1 1 41 THR HG1 H 2.846 -4.433 -7.806 1.00 . A A . 41 THR HG1 1 1 7 4272 1 1 41 THR HG21 H 3.003 -2.486 -8.867 1.00 . A A . 41 THR HG21 1 1 7 4273 1 1 41 THR HG22 H 1.785 -3.457 -9.758 1.00 . A A . 41 THR HG22 1 1 7 4274 1 1 41 THR HG23 H 1.427 -1.765 -9.308 1.00 . A A . 41 THR HG23 1 1 7 4275 1 1 41 THR N N 0.706 -2.908 -5.443 1.00 . A A . 41 THR N 1 1 7 4276 1 1 41 THR O O 2.004 -0.007 -6.841 1.00 . A A . 41 THR O 1 1 7 4277 1 1 41 THR OG1 O 1.943 -4.441 -7.450 1.00 . A A . 41 THR OG1 1 1 7 4278 1 1 42 ALA C C -0.215 1.769 -6.029 1.00 . A A . 42 ALA C 1 1 7 4279 1 1 42 ALA CA C -0.583 0.867 -7.202 1.00 . A A . 42 ALA CA 1 1 7 4280 1 1 42 ALA CB C -2.081 0.970 -7.508 1.00 . A A . 42 ALA CB 1 1 7 4281 1 1 42 ALA H H -0.924 -1.193 -6.806 1.00 . A A . 42 ALA H 1 1 7 4282 1 1 42 ALA HA H -0.035 1.208 -8.083 1.00 . A A . 42 ALA HA 1 1 7 4283 1 1 42 ALA HB1 H -2.310 0.427 -8.425 1.00 . A A . 42 ALA HB1 1 1 7 4284 1 1 42 ALA HB2 H -2.343 2.017 -7.649 1.00 . A A . 42 ALA HB2 1 1 7 4285 1 1 42 ALA HB3 H -2.669 0.564 -6.685 1.00 . A A . 42 ALA HB3 1 1 7 4286 1 1 42 ALA N N -0.185 -0.509 -6.909 1.00 . A A . 42 ALA N 1 1 7 4287 1 1 42 ALA O O 0.362 2.838 -6.241 1.00 . A A . 42 ALA O 1 1 7 4288 1 1 43 PHE C C 1.381 2.261 -3.637 1.00 . A A . 43 PHE C 1 1 7 4289 1 1 43 PHE CA C -0.126 2.021 -3.581 1.00 . A A . 43 PHE CA 1 1 7 4290 1 1 43 PHE CB C -0.608 1.236 -2.334 1.00 . A A . 43 PHE CB 1 1 7 4291 1 1 43 PHE CD1 C 1.161 1.442 -0.591 1.00 . A A . 43 PHE CD1 1 1 7 4292 1 1 43 PHE CD2 C -0.972 2.507 -0.137 1.00 . A A . 43 PHE CD2 1 1 7 4293 1 1 43 PHE CE1 C 1.670 1.917 0.621 1.00 . A A . 43 PHE CE1 1 1 7 4294 1 1 43 PHE CE2 C -0.478 2.939 1.108 1.00 . A A . 43 PHE CE2 1 1 7 4295 1 1 43 PHE CG C -0.138 1.768 -0.999 1.00 . A A . 43 PHE CG 1 1 7 4296 1 1 43 PHE CZ C 0.848 2.659 1.480 1.00 . A A . 43 PHE CZ 1 1 7 4297 1 1 43 PHE H H -0.993 0.441 -4.728 1.00 . A A . 43 PHE H 1 1 7 4298 1 1 43 PHE HA H -0.601 3.001 -3.575 1.00 . A A . 43 PHE HA 1 1 7 4299 1 1 43 PHE HB2 H -1.696 1.188 -2.341 1.00 . A A . 43 PHE HB2 1 1 7 4300 1 1 43 PHE HB3 H -0.244 0.213 -2.361 1.00 . A A . 43 PHE HB3 1 1 7 4301 1 1 43 PHE HD1 H 1.763 0.820 -1.230 1.00 . A A . 43 PHE HD1 1 1 7 4302 1 1 43 PHE HD2 H -1.991 2.741 -0.412 1.00 . A A . 43 PHE HD2 1 1 7 4303 1 1 43 PHE HE1 H 2.691 1.703 0.885 1.00 . A A . 43 PHE HE1 1 1 7 4304 1 1 43 PHE HE2 H -1.110 3.504 1.776 1.00 . A A . 43 PHE HE2 1 1 7 4305 1 1 43 PHE HZ H 1.249 3.005 2.417 1.00 . A A . 43 PHE HZ 1 1 7 4306 1 1 43 PHE N N -0.514 1.334 -4.803 1.00 . A A . 43 PHE N 1 1 7 4307 1 1 43 PHE O O 1.827 3.397 -3.539 1.00 . A A . 43 PHE O 1 1 7 4308 1 1 44 LEU C C 4.269 2.173 -4.831 1.00 . A A . 44 LEU C 1 1 7 4309 1 1 44 LEU CA C 3.639 1.367 -3.703 1.00 . A A . 44 LEU CA 1 1 7 4310 1 1 44 LEU CB C 4.304 -0.004 -3.610 1.00 . A A . 44 LEU CB 1 1 7 4311 1 1 44 LEU CD1 C 4.663 -2.132 -2.430 1.00 . A A . 44 LEU CD1 1 1 7 4312 1 1 44 LEU CD2 C 4.349 -0.007 -1.047 1.00 . A A . 44 LEU CD2 1 1 7 4313 1 1 44 LEU CG C 3.967 -0.773 -2.324 1.00 . A A . 44 LEU CG 1 1 7 4314 1 1 44 LEU H H 1.815 0.297 -3.953 1.00 . A A . 44 LEU H 1 1 7 4315 1 1 44 LEU HA H 3.810 1.924 -2.790 1.00 . A A . 44 LEU HA 1 1 7 4316 1 1 44 LEU HB2 H 4.015 -0.598 -4.481 1.00 . A A . 44 LEU HB2 1 1 7 4317 1 1 44 LEU HB3 H 5.381 0.143 -3.653 1.00 . A A . 44 LEU HB3 1 1 7 4318 1 1 44 LEU HD11 H 5.703 -2.016 -2.741 1.00 . A A . 44 LEU HD11 1 1 7 4319 1 1 44 LEU HD12 H 4.642 -2.651 -1.478 1.00 . A A . 44 LEU HD12 1 1 7 4320 1 1 44 LEU HD13 H 4.142 -2.733 -3.176 1.00 . A A . 44 LEU HD13 1 1 7 4321 1 1 44 LEU HD21 H 3.891 0.975 -0.996 1.00 . A A . 44 LEU HD21 1 1 7 4322 1 1 44 LEU HD22 H 3.988 -0.548 -0.177 1.00 . A A . 44 LEU HD22 1 1 7 4323 1 1 44 LEU HD23 H 5.421 0.121 -1.000 1.00 . A A . 44 LEU HD23 1 1 7 4324 1 1 44 LEU HG H 2.899 -0.952 -2.266 1.00 . A A . 44 LEU HG 1 1 7 4325 1 1 44 LEU N N 2.200 1.228 -3.833 1.00 . A A . 44 LEU N 1 1 7 4326 1 1 44 LEU O O 5.225 2.911 -4.581 1.00 . A A . 44 LEU O 1 1 7 4327 1 1 45 SER C C 3.962 4.422 -6.660 1.00 . A A . 45 SER C 1 1 7 4328 1 1 45 SER CA C 4.087 2.973 -7.137 1.00 . A A . 45 SER CA 1 1 7 4329 1 1 45 SER CB C 3.186 2.659 -8.338 1.00 . A A . 45 SER CB 1 1 7 4330 1 1 45 SER H H 2.951 1.444 -6.187 1.00 . A A . 45 SER H 1 1 7 4331 1 1 45 SER HA H 5.122 2.777 -7.406 1.00 . A A . 45 SER HA 1 1 7 4332 1 1 45 SER HB2 H 3.277 1.601 -8.565 1.00 . A A . 45 SER HB2 1 1 7 4333 1 1 45 SER HB3 H 2.143 2.850 -8.093 1.00 . A A . 45 SER HB3 1 1 7 4334 1 1 45 SER HG H 2.970 4.200 -9.503 1.00 . A A . 45 SER HG 1 1 7 4335 1 1 45 SER N N 3.723 2.090 -6.043 1.00 . A A . 45 SER N 1 1 7 4336 1 1 45 SER O O 4.876 5.224 -6.840 1.00 . A A . 45 SER O 1 1 7 4337 1 1 45 SER OG O 3.560 3.418 -9.474 1.00 . A A . 45 SER OG 1 1 7 4338 1 1 46 GLN C C 3.370 6.457 -4.282 1.00 . A A . 46 GLN C 1 1 7 4339 1 1 46 GLN CA C 2.550 6.070 -5.521 1.00 . A A . 46 GLN CA 1 1 7 4340 1 1 46 GLN CB C 1.026 6.180 -5.335 1.00 . A A . 46 GLN CB 1 1 7 4341 1 1 46 GLN CD C -1.100 6.102 -6.847 1.00 . A A . 46 GLN CD 1 1 7 4342 1 1 46 GLN CG C 0.403 6.309 -6.741 1.00 . A A . 46 GLN CG 1 1 7 4343 1 1 46 GLN H H 2.156 4.001 -5.885 1.00 . A A . 46 GLN H 1 1 7 4344 1 1 46 GLN HA H 2.839 6.770 -6.306 1.00 . A A . 46 GLN HA 1 1 7 4345 1 1 46 GLN HB2 H 0.651 5.296 -4.819 1.00 . A A . 46 GLN HB2 1 1 7 4346 1 1 46 GLN HB3 H 0.786 7.058 -4.738 1.00 . A A . 46 GLN HB3 1 1 7 4347 1 1 46 GLN HE21 H -0.898 4.116 -6.570 1.00 . A A . 46 GLN HE21 1 1 7 4348 1 1 46 GLN HE22 H -2.520 4.654 -6.985 1.00 . A A . 46 GLN HE22 1 1 7 4349 1 1 46 GLN HG2 H 0.633 7.302 -7.119 1.00 . A A . 46 GLN HG2 1 1 7 4350 1 1 46 GLN HG3 H 0.863 5.586 -7.414 1.00 . A A . 46 GLN HG3 1 1 7 4351 1 1 46 GLN N N 2.849 4.735 -6.003 1.00 . A A . 46 GLN N 1 1 7 4352 1 1 46 GLN NE2 N -1.554 4.870 -6.753 1.00 . A A . 46 GLN NE2 1 1 7 4353 1 1 46 GLN O O 3.802 7.610 -4.212 1.00 . A A . 46 GLN O 1 1 7 4354 1 1 46 GLN OE1 O -1.846 7.036 -7.137 1.00 . A A . 46 GLN OE1 1 1 7 4355 1 1 47 CYS C C 5.813 5.727 -2.069 1.00 . A A . 47 CYS C 1 1 7 4356 1 1 47 CYS CA C 4.287 5.914 -2.058 1.00 . A A . 47 CYS CA 1 1 7 4357 1 1 47 CYS CB C 3.692 5.145 -0.867 1.00 . A A . 47 CYS CB 1 1 7 4358 1 1 47 CYS H H 3.091 4.697 -3.398 1.00 . A A . 47 CYS H 1 1 7 4359 1 1 47 CYS HA H 4.097 6.973 -1.872 1.00 . A A . 47 CYS HA 1 1 7 4360 1 1 47 CYS HB2 H 4.207 4.181 -0.750 1.00 . A A . 47 CYS HB2 1 1 7 4361 1 1 47 CYS HB3 H 3.889 5.746 0.023 1.00 . A A . 47 CYS HB3 1 1 7 4362 1 1 47 CYS N N 3.620 5.560 -3.323 1.00 . A A . 47 CYS N 1 1 7 4363 1 1 47 CYS O O 6.486 6.204 -1.151 1.00 . A A . 47 CYS O 1 1 7 4364 1 1 47 CYS SG S 1.907 4.856 -0.937 1.00 . A A . 47 CYS SG 1 1 7 4365 1 1 48 TYR C C 8.343 5.058 -4.577 1.00 . A A . 48 TYR C 1 1 7 4366 1 1 48 TYR CA C 7.808 4.754 -3.181 1.00 . A A . 48 TYR CA 1 1 7 4367 1 1 48 TYR CB C 8.114 3.300 -2.842 1.00 . A A . 48 TYR CB 1 1 7 4368 1 1 48 TYR CD1 C 9.332 3.176 -0.624 1.00 . A A . 48 TYR CD1 1 1 7 4369 1 1 48 TYR CD2 C 7.040 2.388 -0.770 1.00 . A A . 48 TYR CD2 1 1 7 4370 1 1 48 TYR CE1 C 9.445 2.661 0.679 1.00 . A A . 48 TYR CE1 1 1 7 4371 1 1 48 TYR CE2 C 7.193 1.780 0.484 1.00 . A A . 48 TYR CE2 1 1 7 4372 1 1 48 TYR CG C 8.147 3.002 -1.363 1.00 . A A . 48 TYR CG 1 1 7 4373 1 1 48 TYR CZ C 8.386 1.909 1.229 1.00 . A A . 48 TYR CZ 1 1 7 4374 1 1 48 TYR H H 5.764 4.632 -3.762 1.00 . A A . 48 TYR H 1 1 7 4375 1 1 48 TYR HA H 8.375 5.318 -2.452 1.00 . A A . 48 TYR HA 1 1 7 4376 1 1 48 TYR HB2 H 7.404 2.638 -3.338 1.00 . A A . 48 TYR HB2 1 1 7 4377 1 1 48 TYR HB3 H 9.095 3.044 -3.240 1.00 . A A . 48 TYR HB3 1 1 7 4378 1 1 48 TYR HD1 H 10.194 3.636 -1.085 1.00 . A A . 48 TYR HD1 1 1 7 4379 1 1 48 TYR HD2 H 6.141 2.233 -1.351 1.00 . A A . 48 TYR HD2 1 1 7 4380 1 1 48 TYR HE1 H 10.382 2.762 1.206 1.00 . A A . 48 TYR HE1 1 1 7 4381 1 1 48 TYR HE2 H 6.416 1.127 0.807 1.00 . A A . 48 TYR HE2 1 1 7 4382 1 1 48 TYR HH H 8.421 0.353 2.401 1.00 . A A . 48 TYR HH 1 1 7 4383 1 1 48 TYR N N 6.375 5.035 -3.061 1.00 . A A . 48 TYR N 1 1 7 4384 1 1 48 TYR O O 9.484 5.508 -4.708 1.00 . A A . 48 TYR O 1 1 7 4385 1 1 48 TYR OH O 8.507 1.317 2.453 1.00 . A A . 48 TYR OH 1 1 7 4386 1 1 49 GLY C C 7.784 3.297 -7.583 1.00 . A A . 49 GLY C 1 1 7 4387 1 1 49 GLY CA C 8.014 4.687 -6.993 1.00 . A A . 49 GLY CA 1 1 7 4388 1 1 49 GLY H H 6.621 4.415 -5.452 1.00 . A A . 49 GLY H 1 1 7 4389 1 1 49 GLY HA2 H 9.075 4.929 -7.072 1.00 . A A . 49 GLY HA2 1 1 7 4390 1 1 49 GLY HA3 H 7.457 5.422 -7.575 1.00 . A A . 49 GLY HA3 1 1 7 4391 1 1 49 GLY N N 7.567 4.741 -5.610 1.00 . A A . 49 GLY N 1 1 7 4392 1 1 49 GLY O O 7.634 3.180 -8.795 1.00 . A A . 49 GLY O 1 1 7 4393 1 1 50 GLY C C 8.699 0.285 -7.726 1.00 . A A . 50 GLY C 1 1 7 4394 1 1 50 GLY CA C 7.414 0.897 -7.184 1.00 . A A . 50 GLY CA 1 1 7 4395 1 1 50 GLY H H 7.731 2.430 -5.760 1.00 . A A . 50 GLY H 1 1 7 4396 1 1 50 GLY HA2 H 6.656 0.885 -7.967 1.00 . A A . 50 GLY HA2 1 1 7 4397 1 1 50 GLY HA3 H 7.056 0.303 -6.345 1.00 . A A . 50 GLY HA3 1 1 7 4398 1 1 50 GLY N N 7.642 2.264 -6.746 1.00 . A A . 50 GLY N 1 1 7 4399 1 1 50 GLY O O 8.880 0.232 -8.941 1.00 . A A . 50 GLY O 1 1 7 4400 1 1 51 CYS C C 11.693 0.025 -7.959 1.00 . A A . 51 CYS C 1 1 7 4401 1 1 51 CYS CA C 10.815 -0.871 -7.092 1.00 . A A . 51 CYS CA 1 1 7 4402 1 1 51 CYS CB C 10.648 -2.274 -7.695 1.00 . A A . 51 CYS CB 1 1 7 4403 1 1 51 CYS H H 9.271 -0.112 -5.835 1.00 . A A . 51 CYS H 1 1 7 4404 1 1 51 CYS HA H 11.323 -0.997 -6.140 1.00 . A A . 51 CYS HA 1 1 7 4405 1 1 51 CYS HB2 H 10.049 -2.201 -8.601 1.00 . A A . 51 CYS HB2 1 1 7 4406 1 1 51 CYS HB3 H 11.642 -2.590 -7.993 1.00 . A A . 51 CYS HB3 1 1 7 4407 1 1 51 CYS N N 9.533 -0.226 -6.818 1.00 . A A . 51 CYS N 1 1 7 4408 1 1 51 CYS O O 12.002 1.139 -7.479 1.00 . A A . 51 CYS O 1 1 7 4409 1 1 51 CYS OXT O 12.132 -0.415 -9.047 1.00 . A A . 51 CYS OXT 1 1 7 4410 1 1 51 CYS SG S 10.013 -3.578 -6.625 1.00 . A A . 51 CYS SG 1 1 8 4411 1 1 1 GLY C C -8.393 -6.391 -0.366 1.00 . A A . 1 GLY C 1 1 8 4412 1 1 1 GLY CA C -8.188 -7.709 -1.083 1.00 . A A . 1 GLY CA 1 1 8 4413 1 1 1 GLY H1 H -10.087 -8.342 -0.649 1.00 . A A . 1 GLY H1 1 1 8 4414 1 1 1 GLY H2 H -9.908 -7.791 -2.180 1.00 . A A . 1 GLY H2 1 1 8 4415 1 1 1 GLY H3 H -9.320 -9.280 -1.774 1.00 . A A . 1 GLY H3 1 1 8 4416 1 1 1 GLY HA2 H -7.610 -7.555 -1.988 1.00 . A A . 1 GLY HA2 1 1 8 4417 1 1 1 GLY HA3 H -7.621 -8.356 -0.418 1.00 . A A . 1 GLY HA3 1 1 8 4418 1 1 1 GLY N N -9.468 -8.334 -1.448 1.00 . A A . 1 GLY N 1 1 8 4419 1 1 1 GLY O O -9.532 -5.988 -0.122 1.00 . A A . 1 GLY O 1 1 8 4420 1 1 2 GLU C C -6.820 -3.393 0.692 1.00 . A A . 2 GLU C 1 1 8 4421 1 1 2 GLU CA C -7.321 -4.764 1.121 1.00 . A A . 2 GLU CA 1 1 8 4422 1 1 2 GLU CB C -6.598 -5.299 2.367 1.00 . A A . 2 GLU CB 1 1 8 4423 1 1 2 GLU CD C -4.428 -6.520 3.103 1.00 . A A . 2 GLU CD 1 1 8 4424 1 1 2 GLU CG C -5.107 -5.554 2.121 1.00 . A A . 2 GLU CG 1 1 8 4425 1 1 2 GLU H H -6.383 -6.036 -0.298 1.00 . A A . 2 GLU H 1 1 8 4426 1 1 2 GLU HA H -8.344 -4.633 1.431 1.00 . A A . 2 GLU HA 1 1 8 4427 1 1 2 GLU HB2 H -6.711 -4.588 3.184 1.00 . A A . 2 GLU HB2 1 1 8 4428 1 1 2 GLU HB3 H -7.091 -6.228 2.639 1.00 . A A . 2 GLU HB3 1 1 8 4429 1 1 2 GLU HG2 H -5.048 -5.995 1.134 1.00 . A A . 2 GLU HG2 1 1 8 4430 1 1 2 GLU HG3 H -4.572 -4.602 2.113 1.00 . A A . 2 GLU HG3 1 1 8 4431 1 1 2 GLU N N -7.297 -5.751 0.044 1.00 . A A . 2 GLU N 1 1 8 4432 1 1 2 GLU O O -7.393 -2.384 1.107 1.00 . A A . 2 GLU O 1 1 8 4433 1 1 2 GLU OE1 O -5.117 -7.241 3.854 1.00 . A A . 2 GLU OE1 1 1 8 4434 1 1 2 GLU OE2 O -3.179 -6.639 3.049 1.00 . A A . 2 GLU OE2 1 1 8 4435 1 1 3 CYS C C -5.740 -1.384 -1.584 1.00 . A A . 3 CYS C 1 1 8 4436 1 1 3 CYS CA C -5.069 -2.099 -0.404 1.00 . A A . 3 CYS CA 1 1 8 4437 1 1 3 CYS CB C -3.579 -2.392 -0.598 1.00 . A A . 3 CYS CB 1 1 8 4438 1 1 3 CYS H H -5.360 -4.218 -0.459 1.00 . A A . 3 CYS H 1 1 8 4439 1 1 3 CYS HA H -5.156 -1.452 0.469 1.00 . A A . 3 CYS HA 1 1 8 4440 1 1 3 CYS HB2 H -3.180 -2.758 0.349 1.00 . A A . 3 CYS HB2 1 1 8 4441 1 1 3 CYS HB3 H -3.459 -3.187 -1.326 1.00 . A A . 3 CYS HB3 1 1 8 4442 1 1 3 CYS N N -5.762 -3.345 -0.114 1.00 . A A . 3 CYS N 1 1 8 4443 1 1 3 CYS O O -6.011 -0.183 -1.494 1.00 . A A . 3 CYS O 1 1 8 4444 1 1 3 CYS SG S -2.583 -0.982 -1.128 1.00 . A A . 3 CYS SG 1 1 8 4445 1 1 4 GLU C C -8.314 -1.096 -3.098 1.00 . A A . 4 GLU C 1 1 8 4446 1 1 4 GLU CA C -6.993 -1.587 -3.697 1.00 . A A . 4 GLU CA 1 1 8 4447 1 1 4 GLU CB C -7.318 -2.655 -4.751 1.00 . A A . 4 GLU CB 1 1 8 4448 1 1 4 GLU CD C -6.551 -4.272 -6.516 1.00 . A A . 4 GLU CD 1 1 8 4449 1 1 4 GLU CG C -6.131 -3.119 -5.604 1.00 . A A . 4 GLU CG 1 1 8 4450 1 1 4 GLU H H -5.853 -3.093 -2.659 1.00 . A A . 4 GLU H 1 1 8 4451 1 1 4 GLU HA H -6.493 -0.750 -4.185 1.00 . A A . 4 GLU HA 1 1 8 4452 1 1 4 GLU HB2 H -7.748 -3.507 -4.240 1.00 . A A . 4 GLU HB2 1 1 8 4453 1 1 4 GLU HB3 H -8.081 -2.269 -5.428 1.00 . A A . 4 GLU HB3 1 1 8 4454 1 1 4 GLU HG2 H -5.753 -2.282 -6.194 1.00 . A A . 4 GLU HG2 1 1 8 4455 1 1 4 GLU HG3 H -5.336 -3.470 -4.948 1.00 . A A . 4 GLU HG3 1 1 8 4456 1 1 4 GLU N N -6.131 -2.120 -2.633 1.00 . A A . 4 GLU N 1 1 8 4457 1 1 4 GLU O O -8.828 -0.052 -3.496 1.00 . A A . 4 GLU O 1 1 8 4458 1 1 4 GLU OE1 O -6.835 -5.363 -5.968 1.00 . A A . 4 GLU OE1 1 1 8 4459 1 1 4 GLU OE2 O -6.607 -4.098 -7.757 1.00 . A A . 4 GLU OE2 1 1 8 4460 1 1 5 GLN C C -10.067 -0.170 -0.739 1.00 . A A . 5 GLN C 1 1 8 4461 1 1 5 GLN CA C -10.107 -1.520 -1.457 1.00 . A A . 5 GLN CA 1 1 8 4462 1 1 5 GLN CB C -10.416 -2.668 -0.480 1.00 . A A . 5 GLN CB 1 1 8 4463 1 1 5 GLN CD C -12.854 -2.882 -1.042 1.00 . A A . 5 GLN CD 1 1 8 4464 1 1 5 GLN CG C -11.841 -2.676 0.072 1.00 . A A . 5 GLN CG 1 1 8 4465 1 1 5 GLN H H -8.362 -2.672 -1.858 1.00 . A A . 5 GLN H 1 1 8 4466 1 1 5 GLN HA H -10.872 -1.466 -2.233 1.00 . A A . 5 GLN HA 1 1 8 4467 1 1 5 GLN HB2 H -10.245 -3.611 -0.994 1.00 . A A . 5 GLN HB2 1 1 8 4468 1 1 5 GLN HB3 H -9.737 -2.617 0.365 1.00 . A A . 5 GLN HB3 1 1 8 4469 1 1 5 GLN HE21 H -13.424 -0.907 -1.105 1.00 . A A . 5 GLN HE21 1 1 8 4470 1 1 5 GLN HE22 H -14.082 -1.952 -2.329 1.00 . A A . 5 GLN HE22 1 1 8 4471 1 1 5 GLN HG2 H -11.935 -3.497 0.783 1.00 . A A . 5 GLN HG2 1 1 8 4472 1 1 5 GLN HG3 H -12.032 -1.747 0.603 1.00 . A A . 5 GLN HG3 1 1 8 4473 1 1 5 GLN N N -8.840 -1.819 -2.107 1.00 . A A . 5 GLN N 1 1 8 4474 1 1 5 GLN NE2 N -13.509 -1.834 -1.499 1.00 . A A . 5 GLN NE2 1 1 8 4475 1 1 5 GLN O O -11.100 0.488 -0.604 1.00 . A A . 5 GLN O 1 1 8 4476 1 1 5 GLN OE1 O -13.046 -3.999 -1.521 1.00 . A A . 5 GLN OE1 1 1 8 4477 1 1 6 CYS C C -8.610 2.638 -0.751 1.00 . A A . 6 CYS C 1 1 8 4478 1 1 6 CYS CA C -8.702 1.553 0.332 1.00 . A A . 6 CYS CA 1 1 8 4479 1 1 6 CYS CB C -7.452 1.496 1.201 1.00 . A A . 6 CYS CB 1 1 8 4480 1 1 6 CYS H H -8.076 -0.331 -0.428 1.00 . A A . 6 CYS H 1 1 8 4481 1 1 6 CYS HA H -9.557 1.768 0.976 1.00 . A A . 6 CYS HA 1 1 8 4482 1 1 6 CYS HB2 H -7.377 0.507 1.649 1.00 . A A . 6 CYS HB2 1 1 8 4483 1 1 6 CYS HB3 H -6.582 1.631 0.566 1.00 . A A . 6 CYS HB3 1 1 8 4484 1 1 6 CYS N N -8.891 0.250 -0.276 1.00 . A A . 6 CYS N 1 1 8 4485 1 1 6 CYS O O -9.148 3.729 -0.571 1.00 . A A . 6 CYS O 1 1 8 4486 1 1 6 CYS SG S -7.413 2.724 2.523 1.00 . A A . 6 CYS SG 1 1 8 4487 1 1 7 PHE C C -9.407 3.429 -3.627 1.00 . A A . 7 PHE C 1 1 8 4488 1 1 7 PHE CA C -7.991 3.209 -3.067 1.00 . A A . 7 PHE CA 1 1 8 4489 1 1 7 PHE CB C -7.023 2.671 -4.137 1.00 . A A . 7 PHE CB 1 1 8 4490 1 1 7 PHE CD1 C -5.642 4.642 -4.913 1.00 . A A . 7 PHE CD1 1 1 8 4491 1 1 7 PHE CD2 C -4.577 2.962 -3.510 1.00 . A A . 7 PHE CD2 1 1 8 4492 1 1 7 PHE CE1 C -4.461 5.404 -4.910 1.00 . A A . 7 PHE CE1 1 1 8 4493 1 1 7 PHE CE2 C -3.391 3.720 -3.534 1.00 . A A . 7 PHE CE2 1 1 8 4494 1 1 7 PHE CG C -5.712 3.427 -4.203 1.00 . A A . 7 PHE CG 1 1 8 4495 1 1 7 PHE CZ C -3.331 4.945 -4.215 1.00 . A A . 7 PHE CZ 1 1 8 4496 1 1 7 PHE H H -7.596 1.407 -2.005 1.00 . A A . 7 PHE H 1 1 8 4497 1 1 7 PHE HA H -7.628 4.187 -2.743 1.00 . A A . 7 PHE HA 1 1 8 4498 1 1 7 PHE HB2 H -6.817 1.615 -3.963 1.00 . A A . 7 PHE HB2 1 1 8 4499 1 1 7 PHE HB3 H -7.496 2.740 -5.115 1.00 . A A . 7 PHE HB3 1 1 8 4500 1 1 7 PHE HD1 H -6.512 5.026 -5.422 1.00 . A A . 7 PHE HD1 1 1 8 4501 1 1 7 PHE HD2 H -4.632 2.075 -2.885 1.00 . A A . 7 PHE HD2 1 1 8 4502 1 1 7 PHE HE1 H -4.438 6.365 -5.399 1.00 . A A . 7 PHE HE1 1 1 8 4503 1 1 7 PHE HE2 H -2.536 3.415 -2.959 1.00 . A A . 7 PHE HE2 1 1 8 4504 1 1 7 PHE HZ H -2.429 5.543 -4.172 1.00 . A A . 7 PHE HZ 1 1 8 4505 1 1 7 PHE N N -8.000 2.330 -1.900 1.00 . A A . 7 PHE N 1 1 8 4506 1 1 7 PHE O O -9.701 4.535 -4.091 1.00 . A A . 7 PHE O 1 1 8 4507 1 1 8 SER C C -12.329 3.737 -2.948 1.00 . A A . 8 SER C 1 1 8 4508 1 1 8 SER CA C -11.729 2.654 -3.849 1.00 . A A . 8 SER CA 1 1 8 4509 1 1 8 SER CB C -12.525 1.359 -3.659 1.00 . A A . 8 SER CB 1 1 8 4510 1 1 8 SER H H -10.007 1.519 -3.266 1.00 . A A . 8 SER H 1 1 8 4511 1 1 8 SER HA H -11.830 2.983 -4.885 1.00 . A A . 8 SER HA 1 1 8 4512 1 1 8 SER HB2 H -12.260 0.886 -2.716 1.00 . A A . 8 SER HB2 1 1 8 4513 1 1 8 SER HB3 H -13.585 1.613 -3.623 1.00 . A A . 8 SER HB3 1 1 8 4514 1 1 8 SER HG H -13.224 0.160 -4.983 1.00 . A A . 8 SER HG 1 1 8 4515 1 1 8 SER N N -10.311 2.444 -3.550 1.00 . A A . 8 SER N 1 1 8 4516 1 1 8 SER O O -13.143 4.539 -3.406 1.00 . A A . 8 SER O 1 1 8 4517 1 1 8 SER OG O -12.326 0.450 -4.720 1.00 . A A . 8 SER OG 1 1 8 4518 1 1 9 ASP C C -11.606 6.017 -0.676 1.00 . A A . 9 ASP C 1 1 8 4519 1 1 9 ASP CA C -12.428 4.723 -0.679 1.00 . A A . 9 ASP CA 1 1 8 4520 1 1 9 ASP CB C -12.411 4.027 0.688 1.00 . A A . 9 ASP CB 1 1 8 4521 1 1 9 ASP CG C -13.431 4.587 1.684 1.00 . A A . 9 ASP CG 1 1 8 4522 1 1 9 ASP H H -11.183 3.155 -1.383 1.00 . A A . 9 ASP H 1 1 8 4523 1 1 9 ASP HA H -13.461 4.971 -0.933 1.00 . A A . 9 ASP HA 1 1 8 4524 1 1 9 ASP HB2 H -12.654 2.980 0.535 1.00 . A A . 9 ASP HB2 1 1 8 4525 1 1 9 ASP HB3 H -11.407 4.065 1.117 1.00 . A A . 9 ASP HB3 1 1 8 4526 1 1 9 ASP N N -11.918 3.784 -1.679 1.00 . A A . 9 ASP N 1 1 8 4527 1 1 9 ASP O O -11.320 6.604 0.372 1.00 . A A . 9 ASP O 1 1 8 4528 1 1 9 ASP OD1 O -14.527 5.029 1.266 1.00 . A A . 9 ASP OD1 1 1 8 4529 1 1 9 ASP OD2 O -13.210 4.401 2.902 1.00 . A A . 9 ASP OD2 1 1 8 4530 1 1 10 GLY C C -9.067 7.744 -1.578 1.00 . A A . 10 GLY C 1 1 8 4531 1 1 10 GLY CA C -10.497 7.706 -2.108 1.00 . A A . 10 GLY CA 1 1 8 4532 1 1 10 GLY H H -11.482 5.918 -2.677 1.00 . A A . 10 GLY H 1 1 8 4533 1 1 10 GLY HA2 H -11.048 8.503 -1.616 1.00 . A A . 10 GLY HA2 1 1 8 4534 1 1 10 GLY HA3 H -10.480 7.907 -3.177 1.00 . A A . 10 GLY HA3 1 1 8 4535 1 1 10 GLY N N -11.202 6.457 -1.870 1.00 . A A . 10 GLY N 1 1 8 4536 1 1 10 GLY O O -8.464 8.821 -1.599 1.00 . A A . 10 GLY O 1 1 8 4537 1 1 11 GLY C C -6.059 6.798 -1.143 1.00 . A A . 11 GLY C 1 1 8 4538 1 1 11 GLY CA C -7.309 6.672 -0.279 1.00 . A A . 11 GLY CA 1 1 8 4539 1 1 11 GLY H H -9.049 5.771 -1.080 1.00 . A A . 11 GLY H 1 1 8 4540 1 1 11 GLY HA2 H -7.259 5.749 0.291 1.00 . A A . 11 GLY HA2 1 1 8 4541 1 1 11 GLY HA3 H -7.368 7.514 0.405 1.00 . A A . 11 GLY HA3 1 1 8 4542 1 1 11 GLY N N -8.528 6.641 -1.062 1.00 . A A . 11 GLY N 1 1 8 4543 1 1 11 GLY O O -5.913 6.048 -2.103 1.00 . A A . 11 GLY O 1 1 8 4544 1 1 12 ASP C C -2.783 7.025 -0.829 1.00 . A A . 12 ASP C 1 1 8 4545 1 1 12 ASP CA C -3.863 7.931 -1.447 1.00 . A A . 12 ASP CA 1 1 8 4546 1 1 12 ASP CB C -3.434 9.399 -1.343 1.00 . A A . 12 ASP CB 1 1 8 4547 1 1 12 ASP CG C -4.089 10.383 -2.305 1.00 . A A . 12 ASP CG 1 1 8 4548 1 1 12 ASP H H -5.409 8.342 -0.030 1.00 . A A . 12 ASP H 1 1 8 4549 1 1 12 ASP HA H -3.961 7.689 -2.503 1.00 . A A . 12 ASP HA 1 1 8 4550 1 1 12 ASP HB2 H -3.624 9.731 -0.325 1.00 . A A . 12 ASP HB2 1 1 8 4551 1 1 12 ASP HB3 H -2.358 9.456 -1.522 1.00 . A A . 12 ASP HB3 1 1 8 4552 1 1 12 ASP N N -5.149 7.707 -0.775 1.00 . A A . 12 ASP N 1 1 8 4553 1 1 12 ASP O O -2.682 5.860 -1.200 1.00 . A A . 12 ASP O 1 1 8 4554 1 1 12 ASP OD1 O -5.150 10.946 -1.950 1.00 . A A . 12 ASP OD1 1 1 8 4555 1 1 12 ASP OD2 O -3.380 10.842 -3.228 1.00 . A A . 12 ASP OD2 1 1 8 4556 1 1 13 CYS C C -0.809 6.892 2.209 1.00 . A A . 13 CYS C 1 1 8 4557 1 1 13 CYS CA C -0.822 6.841 0.685 1.00 . A A . 13 CYS CA 1 1 8 4558 1 1 13 CYS CB C 0.466 7.469 0.127 1.00 . A A . 13 CYS CB 1 1 8 4559 1 1 13 CYS H H -2.101 8.508 0.361 1.00 . A A . 13 CYS H 1 1 8 4560 1 1 13 CYS HA H -0.855 5.792 0.400 1.00 . A A . 13 CYS HA 1 1 8 4561 1 1 13 CYS HB2 H 0.429 8.550 0.270 1.00 . A A . 13 CYS HB2 1 1 8 4562 1 1 13 CYS HB3 H 1.313 7.090 0.697 1.00 . A A . 13 CYS HB3 1 1 8 4563 1 1 13 CYS N N -1.994 7.523 0.137 1.00 . A A . 13 CYS N 1 1 8 4564 1 1 13 CYS O O -0.544 5.879 2.865 1.00 . A A . 13 CYS O 1 1 8 4565 1 1 13 CYS SG S 0.794 7.141 -1.623 1.00 . A A . 13 CYS SG 1 1 8 4566 1 1 14 THR C C -2.446 7.425 4.715 1.00 . A A . 14 THR C 1 1 8 4567 1 1 14 THR CA C -1.206 8.186 4.247 1.00 . A A . 14 THR CA 1 1 8 4568 1 1 14 THR CB C -1.236 9.674 4.622 1.00 . A A . 14 THR CB 1 1 8 4569 1 1 14 THR CG2 C -1.237 9.906 6.134 1.00 . A A . 14 THR CG2 1 1 8 4570 1 1 14 THR H H -1.221 8.890 2.241 1.00 . A A . 14 THR H 1 1 8 4571 1 1 14 THR HA H -0.337 7.725 4.720 1.00 . A A . 14 THR HA 1 1 8 4572 1 1 14 THR HB H -2.130 10.130 4.198 1.00 . A A . 14 THR HB 1 1 8 4573 1 1 14 THR HG1 H 0.617 9.679 4.006 1.00 . A A . 14 THR HG1 1 1 8 4574 1 1 14 THR HG21 H -0.346 9.471 6.584 1.00 . A A . 14 THR HG21 1 1 8 4575 1 1 14 THR HG22 H -1.265 10.975 6.342 1.00 . A A . 14 THR HG22 1 1 8 4576 1 1 14 THR HG23 H -2.117 9.448 6.584 1.00 . A A . 14 THR HG23 1 1 8 4577 1 1 14 THR N N -1.082 8.052 2.804 1.00 . A A . 14 THR N 1 1 8 4578 1 1 14 THR O O -2.318 6.513 5.534 1.00 . A A . 14 THR O 1 1 8 4579 1 1 14 THR OG1 O -0.103 10.317 4.068 1.00 . A A . 14 THR OG1 1 1 8 4580 1 1 15 THR C C -5.258 5.850 4.422 1.00 . A A . 15 THR C 1 1 8 4581 1 1 15 THR CA C -4.899 7.314 4.756 1.00 . A A . 15 THR CA 1 1 8 4582 1 1 15 THR CB C -5.934 8.308 4.175 1.00 . A A . 15 THR CB 1 1 8 4583 1 1 15 THR CG2 C -6.296 8.092 2.705 1.00 . A A . 15 THR CG2 1 1 8 4584 1 1 15 THR H H -3.670 8.444 3.448 1.00 . A A . 15 THR H 1 1 8 4585 1 1 15 THR HA H -4.852 7.431 5.841 1.00 . A A . 15 THR HA 1 1 8 4586 1 1 15 THR HB H -5.468 9.290 4.194 1.00 . A A . 15 THR HB 1 1 8 4587 1 1 15 THR HG1 H -7.867 8.384 4.329 1.00 . A A . 15 THR HG1 1 1 8 4588 1 1 15 THR HG21 H -5.397 8.063 2.088 1.00 . A A . 15 THR HG21 1 1 8 4589 1 1 15 THR HG22 H -6.845 7.163 2.571 1.00 . A A . 15 THR HG22 1 1 8 4590 1 1 15 THR HG23 H -6.921 8.915 2.356 1.00 . A A . 15 THR HG23 1 1 8 4591 1 1 15 THR N N -3.627 7.730 4.163 1.00 . A A . 15 THR N 1 1 8 4592 1 1 15 THR O O -6.432 5.479 4.443 1.00 . A A . 15 THR O 1 1 8 4593 1 1 15 THR OG1 O -7.116 8.418 4.939 1.00 . A A . 15 THR OG1 1 1 8 4594 1 1 16 CYS C C -3.016 2.874 4.515 1.00 . A A . 16 CYS C 1 1 8 4595 1 1 16 CYS CA C -4.297 3.558 4.018 1.00 . A A . 16 CYS CA 1 1 8 4596 1 1 16 CYS CB C -4.451 3.378 2.502 1.00 . A A . 16 CYS CB 1 1 8 4597 1 1 16 CYS H H -3.333 5.395 4.380 1.00 . A A . 16 CYS H 1 1 8 4598 1 1 16 CYS HA H -5.152 3.092 4.519 1.00 . A A . 16 CYS HA 1 1 8 4599 1 1 16 CYS HB2 H -3.633 3.884 1.992 1.00 . A A . 16 CYS HB2 1 1 8 4600 1 1 16 CYS HB3 H -4.382 2.322 2.235 1.00 . A A . 16 CYS HB3 1 1 8 4601 1 1 16 CYS N N -4.252 4.984 4.318 1.00 . A A . 16 CYS N 1 1 8 4602 1 1 16 CYS O O -2.994 1.648 4.612 1.00 . A A . 16 CYS O 1 1 8 4603 1 1 16 CYS SG S -6.011 4.013 1.843 1.00 . A A . 16 CYS SG 1 1 8 4604 1 1 17 PHE C C -1.415 3.076 7.191 1.00 . A A . 17 PHE C 1 1 8 4605 1 1 17 PHE CA C -0.922 3.123 5.753 1.00 . A A . 17 PHE CA 1 1 8 4606 1 1 17 PHE CB C 0.351 3.978 5.668 1.00 . A A . 17 PHE CB 1 1 8 4607 1 1 17 PHE CD1 C 1.839 2.071 6.288 1.00 . A A . 17 PHE CD1 1 1 8 4608 1 1 17 PHE CD2 C 2.211 4.159 7.451 1.00 . A A . 17 PHE CD2 1 1 8 4609 1 1 17 PHE CE1 C 2.878 1.454 6.996 1.00 . A A . 17 PHE CE1 1 1 8 4610 1 1 17 PHE CE2 C 3.275 3.552 8.151 1.00 . A A . 17 PHE CE2 1 1 8 4611 1 1 17 PHE CG C 1.499 3.414 6.490 1.00 . A A . 17 PHE CG 1 1 8 4612 1 1 17 PHE CZ C 3.601 2.201 7.933 1.00 . A A . 17 PHE CZ 1 1 8 4613 1 1 17 PHE H H -1.990 4.641 4.788 1.00 . A A . 17 PHE H 1 1 8 4614 1 1 17 PHE HA H -0.701 2.106 5.436 1.00 . A A . 17 PHE HA 1 1 8 4615 1 1 17 PHE HB2 H 0.664 3.998 4.625 1.00 . A A . 17 PHE HB2 1 1 8 4616 1 1 17 PHE HB3 H 0.134 4.999 5.980 1.00 . A A . 17 PHE HB3 1 1 8 4617 1 1 17 PHE HD1 H 1.283 1.512 5.563 1.00 . A A . 17 PHE HD1 1 1 8 4618 1 1 17 PHE HD2 H 1.938 5.175 7.720 1.00 . A A . 17 PHE HD2 1 1 8 4619 1 1 17 PHE HE1 H 3.118 0.411 6.824 1.00 . A A . 17 PHE HE1 1 1 8 4620 1 1 17 PHE HE2 H 3.825 4.107 8.899 1.00 . A A . 17 PHE HE2 1 1 8 4621 1 1 17 PHE HZ H 4.380 1.712 8.500 1.00 . A A . 17 PHE HZ 1 1 8 4622 1 1 17 PHE N N -1.973 3.636 4.889 1.00 . A A . 17 PHE N 1 1 8 4623 1 1 17 PHE O O -1.216 2.060 7.857 1.00 . A A . 17 PHE O 1 1 8 4624 1 1 18 ASN C C -1.601 3.846 10.034 1.00 . A A . 18 ASN C 1 1 8 4625 1 1 18 ASN CA C -2.623 4.310 8.996 1.00 . A A . 18 ASN CA 1 1 8 4626 1 1 18 ASN CB C -3.900 3.496 9.094 1.00 . A A . 18 ASN CB 1 1 8 4627 1 1 18 ASN CG C -4.682 3.674 10.389 1.00 . A A . 18 ASN CG 1 1 8 4628 1 1 18 ASN H H -2.097 4.980 7.056 1.00 . A A . 18 ASN H 1 1 8 4629 1 1 18 ASN HA H -2.860 5.358 9.167 1.00 . A A . 18 ASN HA 1 1 8 4630 1 1 18 ASN HB2 H -4.545 3.701 8.239 1.00 . A A . 18 ASN HB2 1 1 8 4631 1 1 18 ASN HB3 H -3.524 2.484 9.062 1.00 . A A . 18 ASN HB3 1 1 8 4632 1 1 18 ASN HD21 H -6.252 2.650 9.607 1.00 . A A . 18 ASN HD21 1 1 8 4633 1 1 18 ASN HD22 H -6.417 3.167 11.281 1.00 . A A . 18 ASN HD22 1 1 8 4634 1 1 18 ASN N N -2.076 4.154 7.645 1.00 . A A . 18 ASN N 1 1 8 4635 1 1 18 ASN ND2 N -5.889 3.138 10.424 1.00 . A A . 18 ASN ND2 1 1 8 4636 1 1 18 ASN O O -1.816 2.911 10.806 1.00 . A A . 18 ASN O 1 1 8 4637 1 1 18 ASN OD1 O -4.222 4.265 11.366 1.00 . A A . 18 ASN OD1 1 1 8 4638 1 1 19 ASN C C 1.010 2.603 10.932 1.00 . A A . 19 ASN C 1 1 8 4639 1 1 19 ASN CA C 0.817 4.081 10.598 1.00 . A A . 19 ASN CA 1 1 8 4640 1 1 19 ASN CB C 1.206 5.082 11.689 1.00 . A A . 19 ASN CB 1 1 8 4641 1 1 19 ASN CG C 2.649 5.531 11.538 1.00 . A A . 19 ASN CG 1 1 8 4642 1 1 19 ASN H H -0.357 5.174 9.244 1.00 . A A . 19 ASN H 1 1 8 4643 1 1 19 ASN HA H 1.477 4.238 9.776 1.00 . A A . 19 ASN HA 1 1 8 4644 1 1 19 ASN HB2 H 0.614 5.973 11.525 1.00 . A A . 19 ASN HB2 1 1 8 4645 1 1 19 ASN HB3 H 1.010 4.691 12.685 1.00 . A A . 19 ASN HB3 1 1 8 4646 1 1 19 ASN HD21 H 3.270 4.896 13.392 1.00 . A A . 19 ASN HD21 1 1 8 4647 1 1 19 ASN HD22 H 4.443 5.740 12.394 1.00 . A A . 19 ASN HD22 1 1 8 4648 1 1 19 ASN N N -0.426 4.443 9.945 1.00 . A A . 19 ASN N 1 1 8 4649 1 1 19 ASN ND2 N 3.505 5.379 12.530 1.00 . A A . 19 ASN ND2 1 1 8 4650 1 1 19 ASN O O 1.054 2.197 12.098 1.00 . A A . 19 ASN O 1 1 8 4651 1 1 19 ASN OD1 O 2.986 6.108 10.509 1.00 . A A . 19 ASN OD1 1 1 8 4652 1 1 20 GLY C C 0.115 -0.472 10.444 1.00 . A A . 20 GLY C 1 1 8 4653 1 1 20 GLY CA C 1.304 0.359 9.942 1.00 . A A . 20 GLY CA 1 1 8 4654 1 1 20 GLY H H 0.944 2.183 8.957 1.00 . A A . 20 GLY H 1 1 8 4655 1 1 20 GLY HA2 H 2.190 0.194 10.556 1.00 . A A . 20 GLY HA2 1 1 8 4656 1 1 20 GLY HA3 H 1.557 0.024 8.939 1.00 . A A . 20 GLY HA3 1 1 8 4657 1 1 20 GLY N N 1.026 1.783 9.881 1.00 . A A . 20 GLY N 1 1 8 4658 1 1 20 GLY O O 0.205 -1.694 10.498 1.00 . A A . 20 GLY O 1 1 8 4659 1 1 21 THR C C -3.413 -0.273 10.177 1.00 . A A . 21 THR C 1 1 8 4660 1 1 21 THR CA C -2.272 -0.476 11.187 1.00 . A A . 21 THR CA 1 1 8 4661 1 1 21 THR CB C -2.620 -0.012 12.619 1.00 . A A . 21 THR CB 1 1 8 4662 1 1 21 THR CG2 C -1.627 -0.578 13.634 1.00 . A A . 21 THR CG2 1 1 8 4663 1 1 21 THR H H -1.061 1.140 10.516 1.00 . A A . 21 THR H 1 1 8 4664 1 1 21 THR HA H -2.128 -1.555 11.246 1.00 . A A . 21 THR HA 1 1 8 4665 1 1 21 THR HB H -3.613 -0.373 12.883 1.00 . A A . 21 THR HB 1 1 8 4666 1 1 21 THR HG1 H -2.543 1.829 11.928 1.00 . A A . 21 THR HG1 1 1 8 4667 1 1 21 THR HG21 H -1.542 -1.655 13.504 1.00 . A A . 21 THR HG21 1 1 8 4668 1 1 21 THR HG22 H -0.642 -0.134 13.495 1.00 . A A . 21 THR HG22 1 1 8 4669 1 1 21 THR HG23 H -1.971 -0.370 14.647 1.00 . A A . 21 THR HG23 1 1 8 4670 1 1 21 THR N N -1.033 0.150 10.710 1.00 . A A . 21 THR N 1 1 8 4671 1 1 21 THR O O -4.590 -0.317 10.531 1.00 . A A . 21 THR O 1 1 8 4672 1 1 21 THR OG1 O -2.570 1.393 12.805 1.00 . A A . 21 THR OG1 1 1 8 4673 1 1 22 GLY C C -3.849 -1.066 6.878 1.00 . A A . 22 GLY C 1 1 8 4674 1 1 22 GLY CA C -3.995 0.134 7.807 1.00 . A A . 22 GLY CA 1 1 8 4675 1 1 22 GLY H H -2.091 0.091 8.679 1.00 . A A . 22 GLY H 1 1 8 4676 1 1 22 GLY HA2 H -3.761 1.039 7.249 1.00 . A A . 22 GLY HA2 1 1 8 4677 1 1 22 GLY HA3 H -5.022 0.191 8.168 1.00 . A A . 22 GLY HA3 1 1 8 4678 1 1 22 GLY N N -3.069 0.017 8.921 1.00 . A A . 22 GLY N 1 1 8 4679 1 1 22 GLY O O -3.040 -1.960 7.153 1.00 . A A . 22 GLY O 1 1 8 4680 1 1 23 PRO C C -3.233 -2.272 4.135 1.00 . A A . 23 PRO C 1 1 8 4681 1 1 23 PRO CA C -4.589 -2.196 4.835 1.00 . A A . 23 PRO CA 1 1 8 4682 1 1 23 PRO CB C -5.736 -1.928 3.863 1.00 . A A . 23 PRO CB 1 1 8 4683 1 1 23 PRO CD C -5.562 -0.066 5.361 1.00 . A A . 23 PRO CD 1 1 8 4684 1 1 23 PRO CG C -5.976 -0.420 3.937 1.00 . A A . 23 PRO CG 1 1 8 4685 1 1 23 PRO HA H -4.771 -3.133 5.362 1.00 . A A . 23 PRO HA 1 1 8 4686 1 1 23 PRO HB2 H -5.483 -2.236 2.850 1.00 . A A . 23 PRO HB2 1 1 8 4687 1 1 23 PRO HB3 H -6.622 -2.454 4.215 1.00 . A A . 23 PRO HB3 1 1 8 4688 1 1 23 PRO HD2 H -5.130 0.930 5.391 1.00 . A A . 23 PRO HD2 1 1 8 4689 1 1 23 PRO HD3 H -6.429 -0.077 6.010 1.00 . A A . 23 PRO HD3 1 1 8 4690 1 1 23 PRO HG2 H -5.332 0.097 3.224 1.00 . A A . 23 PRO HG2 1 1 8 4691 1 1 23 PRO HG3 H -7.020 -0.171 3.760 1.00 . A A . 23 PRO HG3 1 1 8 4692 1 1 23 PRO N N -4.615 -1.092 5.776 1.00 . A A . 23 PRO N 1 1 8 4693 1 1 23 PRO O O -2.573 -3.312 4.183 1.00 . A A . 23 PRO O 1 1 8 4694 1 1 24 CYS C C -0.444 -0.766 3.864 1.00 . A A . 24 CYS C 1 1 8 4695 1 1 24 CYS CA C -1.510 -1.126 2.827 1.00 . A A . 24 CYS CA 1 1 8 4696 1 1 24 CYS CB C -1.554 -0.199 1.598 1.00 . A A . 24 CYS CB 1 1 8 4697 1 1 24 CYS H H -3.300 -0.308 3.641 1.00 . A A . 24 CYS H 1 1 8 4698 1 1 24 CYS HA H -1.281 -2.127 2.459 1.00 . A A . 24 CYS HA 1 1 8 4699 1 1 24 CYS HB2 H -2.576 0.135 1.418 1.00 . A A . 24 CYS HB2 1 1 8 4700 1 1 24 CYS HB3 H -0.953 0.694 1.767 1.00 . A A . 24 CYS HB3 1 1 8 4701 1 1 24 CYS N N -2.797 -1.179 3.502 1.00 . A A . 24 CYS N 1 1 8 4702 1 1 24 CYS O O 0.147 0.307 3.823 1.00 . A A . 24 CYS O 1 1 8 4703 1 1 24 CYS SG S -0.953 -1.009 0.093 1.00 . A A . 24 CYS SG 1 1 8 4704 1 1 25 ALA C C 1.922 -2.460 5.736 1.00 . A A . 25 ALA C 1 1 8 4705 1 1 25 ALA CA C 0.750 -1.505 5.897 1.00 . A A . 25 ALA CA 1 1 8 4706 1 1 25 ALA CB C 0.081 -1.723 7.251 1.00 . A A . 25 ALA CB 1 1 8 4707 1 1 25 ALA H H -0.820 -2.484 4.818 1.00 . A A . 25 ALA H 1 1 8 4708 1 1 25 ALA HA H 1.156 -0.499 5.874 1.00 . A A . 25 ALA HA 1 1 8 4709 1 1 25 ALA HB1 H -0.502 -2.645 7.227 1.00 . A A . 25 ALA HB1 1 1 8 4710 1 1 25 ALA HB2 H -0.554 -0.869 7.507 1.00 . A A . 25 ALA HB2 1 1 8 4711 1 1 25 ALA HB3 H 0.860 -1.830 8.004 1.00 . A A . 25 ALA HB3 1 1 8 4712 1 1 25 ALA N N -0.218 -1.669 4.821 1.00 . A A . 25 ALA N 1 1 8 4713 1 1 25 ALA O O 3.077 -2.036 5.783 1.00 . A A . 25 ALA O 1 1 8 4714 1 1 26 ASN C C 3.548 -4.524 4.183 1.00 . A A . 26 ASN C 1 1 8 4715 1 1 26 ASN CA C 2.756 -4.718 5.470 1.00 . A A . 26 ASN CA 1 1 8 4716 1 1 26 ASN CB C 2.256 -6.161 5.521 1.00 . A A . 26 ASN CB 1 1 8 4717 1 1 26 ASN CG C 1.695 -6.507 6.883 1.00 . A A . 26 ASN CG 1 1 8 4718 1 1 26 ASN H H 0.703 -4.087 5.581 1.00 . A A . 26 ASN H 1 1 8 4719 1 1 26 ASN HA H 3.428 -4.527 6.314 1.00 . A A . 26 ASN HA 1 1 8 4720 1 1 26 ASN HB2 H 1.516 -6.332 4.738 1.00 . A A . 26 ASN HB2 1 1 8 4721 1 1 26 ASN HB3 H 3.110 -6.814 5.339 1.00 . A A . 26 ASN HB3 1 1 8 4722 1 1 26 ASN HD21 H -0.272 -6.186 6.333 1.00 . A A . 26 ASN HD21 1 1 8 4723 1 1 26 ASN HD22 H 0.038 -6.544 8.018 1.00 . A A . 26 ASN HD22 1 1 8 4724 1 1 26 ASN N N 1.658 -3.757 5.559 1.00 . A A . 26 ASN N 1 1 8 4725 1 1 26 ASN ND2 N 0.396 -6.399 7.075 1.00 . A A . 26 ASN ND2 1 1 8 4726 1 1 26 ASN O O 4.758 -4.745 4.174 1.00 . A A . 26 ASN O 1 1 8 4727 1 1 26 ASN OD1 O 2.446 -6.865 7.786 1.00 . A A . 26 ASN OD1 1 1 8 4728 1 1 27 CYS C C 4.446 -2.507 1.945 1.00 . A A . 27 CYS C 1 1 8 4729 1 1 27 CYS CA C 3.464 -3.678 1.845 1.00 . A A . 27 CYS CA 1 1 8 4730 1 1 27 CYS CB C 2.361 -3.440 0.806 1.00 . A A . 27 CYS CB 1 1 8 4731 1 1 27 CYS H H 1.888 -3.894 3.249 1.00 . A A . 27 CYS H 1 1 8 4732 1 1 27 CYS HA H 4.006 -4.526 1.434 1.00 . A A . 27 CYS HA 1 1 8 4733 1 1 27 CYS HB2 H 1.763 -2.542 0.990 1.00 . A A . 27 CYS HB2 1 1 8 4734 1 1 27 CYS HB3 H 2.845 -3.257 -0.153 1.00 . A A . 27 CYS HB3 1 1 8 4735 1 1 27 CYS N N 2.879 -4.042 3.132 1.00 . A A . 27 CYS N 1 1 8 4736 1 1 27 CYS O O 4.825 -2.007 0.900 1.00 . A A . 27 CYS O 1 1 8 4737 1 1 27 CYS SG S 1.343 -4.936 0.645 1.00 . A A . 27 CYS SG 1 1 8 4738 1 1 28 LEU C C 6.950 -1.040 3.943 1.00 . A A . 28 LEU C 1 1 8 4739 1 1 28 LEU CA C 5.600 -0.781 3.292 1.00 . A A . 28 LEU CA 1 1 8 4740 1 1 28 LEU CB C 4.843 0.217 4.181 1.00 . A A . 28 LEU CB 1 1 8 4741 1 1 28 LEU CD1 C 3.771 2.322 3.355 1.00 . A A . 28 LEU CD1 1 1 8 4742 1 1 28 LEU CD2 C 2.926 0.223 2.368 1.00 . A A . 28 LEU CD2 1 1 8 4743 1 1 28 LEU CG C 3.549 0.837 3.616 1.00 . A A . 28 LEU CG 1 1 8 4744 1 1 28 LEU H H 4.438 -2.429 3.966 1.00 . A A . 28 LEU H 1 1 8 4745 1 1 28 LEU HA H 5.781 -0.323 2.319 1.00 . A A . 28 LEU HA 1 1 8 4746 1 1 28 LEU HB2 H 4.619 -0.244 5.144 1.00 . A A . 28 LEU HB2 1 1 8 4747 1 1 28 LEU HB3 H 5.535 1.020 4.437 1.00 . A A . 28 LEU HB3 1 1 8 4748 1 1 28 LEU HD11 H 4.134 2.794 4.268 1.00 . A A . 28 LEU HD11 1 1 8 4749 1 1 28 LEU HD12 H 4.498 2.434 2.550 1.00 . A A . 28 LEU HD12 1 1 8 4750 1 1 28 LEU HD13 H 2.830 2.785 3.074 1.00 . A A . 28 LEU HD13 1 1 8 4751 1 1 28 LEU HD21 H 3.640 0.249 1.548 1.00 . A A . 28 LEU HD21 1 1 8 4752 1 1 28 LEU HD22 H 2.594 -0.788 2.580 1.00 . A A . 28 LEU HD22 1 1 8 4753 1 1 28 LEU HD23 H 2.028 0.772 2.099 1.00 . A A . 28 LEU HD23 1 1 8 4754 1 1 28 LEU HG H 2.801 0.729 4.381 1.00 . A A . 28 LEU HG 1 1 8 4755 1 1 28 LEU N N 4.820 -2.009 3.132 1.00 . A A . 28 LEU N 1 1 8 4756 1 1 28 LEU O O 7.941 -0.412 3.566 1.00 . A A . 28 LEU O 1 1 8 4757 1 1 29 ALA C C 9.025 -3.145 5.166 1.00 . A A . 29 ALA C 1 1 8 4758 1 1 29 ALA CA C 8.119 -2.108 5.829 1.00 . A A . 29 ALA CA 1 1 8 4759 1 1 29 ALA CB C 7.606 -2.535 7.207 1.00 . A A . 29 ALA CB 1 1 8 4760 1 1 29 ALA H H 6.123 -2.380 5.201 1.00 . A A . 29 ALA H 1 1 8 4761 1 1 29 ALA HA H 8.684 -1.184 5.945 1.00 . A A . 29 ALA HA 1 1 8 4762 1 1 29 ALA HB1 H 8.449 -2.861 7.811 1.00 . A A . 29 ALA HB1 1 1 8 4763 1 1 29 ALA HB2 H 6.879 -3.348 7.112 1.00 . A A . 29 ALA HB2 1 1 8 4764 1 1 29 ALA HB3 H 7.135 -1.684 7.699 1.00 . A A . 29 ALA HB3 1 1 8 4765 1 1 29 ALA N N 6.969 -1.886 4.971 1.00 . A A . 29 ALA N 1 1 8 4766 1 1 29 ALA O O 9.877 -2.804 4.338 1.00 . A A . 29 ALA O 1 1 8 4767 1 1 30 GLY C C 8.676 -5.652 3.378 1.00 . A A . 30 GLY C 1 1 8 4768 1 1 30 GLY CA C 9.347 -5.533 4.730 1.00 . A A . 30 GLY CA 1 1 8 4769 1 1 30 GLY H H 8.059 -4.649 6.135 1.00 . A A . 30 GLY H 1 1 8 4770 1 1 30 GLY HA2 H 9.193 -6.452 5.296 1.00 . A A . 30 GLY HA2 1 1 8 4771 1 1 30 GLY HA3 H 10.410 -5.374 4.588 1.00 . A A . 30 GLY HA3 1 1 8 4772 1 1 30 GLY N N 8.767 -4.422 5.449 1.00 . A A . 30 GLY N 1 1 8 4773 1 1 30 GLY O O 7.946 -6.613 3.154 1.00 . A A . 30 GLY O 1 1 8 4774 1 1 31 TYR C C 9.237 -4.912 -0.003 1.00 . A A . 31 TYR C 1 1 8 4775 1 1 31 TYR CA C 8.266 -4.701 1.165 1.00 . A A . 31 TYR CA 1 1 8 4776 1 1 31 TYR CB C 7.573 -3.330 1.092 1.00 . A A . 31 TYR CB 1 1 8 4777 1 1 31 TYR CD1 C 9.742 -2.026 0.711 1.00 . A A . 31 TYR CD1 1 1 8 4778 1 1 31 TYR CD2 C 7.681 -1.270 -0.332 1.00 . A A . 31 TYR CD2 1 1 8 4779 1 1 31 TYR CE1 C 10.433 -0.966 0.093 1.00 . A A . 31 TYR CE1 1 1 8 4780 1 1 31 TYR CE2 C 8.370 -0.274 -1.033 1.00 . A A . 31 TYR CE2 1 1 8 4781 1 1 31 TYR CG C 8.354 -2.158 0.519 1.00 . A A . 31 TYR CG 1 1 8 4782 1 1 31 TYR CZ C 9.743 -0.089 -0.778 1.00 . A A . 31 TYR CZ 1 1 8 4783 1 1 31 TYR H H 9.520 -3.934 2.726 1.00 . A A . 31 TYR H 1 1 8 4784 1 1 31 TYR HA H 7.503 -5.457 1.103 1.00 . A A . 31 TYR HA 1 1 8 4785 1 1 31 TYR HB2 H 6.721 -3.463 0.439 1.00 . A A . 31 TYR HB2 1 1 8 4786 1 1 31 TYR HB3 H 7.187 -3.056 2.071 1.00 . A A . 31 TYR HB3 1 1 8 4787 1 1 31 TYR HD1 H 10.281 -2.812 1.229 1.00 . A A . 31 TYR HD1 1 1 8 4788 1 1 31 TYR HD2 H 6.632 -1.408 -0.494 1.00 . A A . 31 TYR HD2 1 1 8 4789 1 1 31 TYR HE1 H 11.502 -0.865 0.214 1.00 . A A . 31 TYR HE1 1 1 8 4790 1 1 31 TYR HE2 H 7.857 0.326 -1.782 1.00 . A A . 31 TYR HE2 1 1 8 4791 1 1 31 TYR HH H 10.101 0.754 -2.404 1.00 . A A . 31 TYR HH 1 1 8 4792 1 1 31 TYR N N 8.912 -4.700 2.469 1.00 . A A . 31 TYR N 1 1 8 4793 1 1 31 TYR O O 9.041 -4.325 -1.069 1.00 . A A . 31 TYR O 1 1 8 4794 1 1 31 TYR OH O 10.405 0.853 -1.494 1.00 . A A . 31 TYR OH 1 1 8 4795 1 1 32 PRO C C 10.434 -6.637 -2.293 1.00 . A A . 32 PRO C 1 1 8 4796 1 1 32 PRO CA C 11.093 -6.041 -1.044 1.00 . A A . 32 PRO CA 1 1 8 4797 1 1 32 PRO CB C 12.204 -6.922 -0.479 1.00 . A A . 32 PRO CB 1 1 8 4798 1 1 32 PRO CD C 10.360 -6.896 1.058 1.00 . A A . 32 PRO CD 1 1 8 4799 1 1 32 PRO CG C 11.495 -7.779 0.560 1.00 . A A . 32 PRO CG 1 1 8 4800 1 1 32 PRO HA H 11.480 -5.037 -1.249 1.00 . A A . 32 PRO HA 1 1 8 4801 1 1 32 PRO HB2 H 12.684 -7.527 -1.249 1.00 . A A . 32 PRO HB2 1 1 8 4802 1 1 32 PRO HB3 H 12.936 -6.295 0.027 1.00 . A A . 32 PRO HB3 1 1 8 4803 1 1 32 PRO HD2 H 9.455 -7.471 1.254 1.00 . A A . 32 PRO HD2 1 1 8 4804 1 1 32 PRO HD3 H 10.692 -6.381 1.951 1.00 . A A . 32 PRO HD3 1 1 8 4805 1 1 32 PRO HG2 H 11.091 -8.658 0.075 1.00 . A A . 32 PRO HG2 1 1 8 4806 1 1 32 PRO HG3 H 12.162 -8.041 1.378 1.00 . A A . 32 PRO HG3 1 1 8 4807 1 1 32 PRO N N 10.113 -5.926 0.016 1.00 . A A . 32 PRO N 1 1 8 4808 1 1 32 PRO O O 10.882 -6.363 -3.403 1.00 . A A . 32 PRO O 1 1 8 4809 1 1 33 ALA C C 7.230 -7.231 -3.432 1.00 . A A . 33 ALA C 1 1 8 4810 1 1 33 ALA CA C 8.521 -8.013 -3.151 1.00 . A A . 33 ALA CA 1 1 8 4811 1 1 33 ALA CB C 8.175 -9.428 -2.682 1.00 . A A . 33 ALA CB 1 1 8 4812 1 1 33 ALA H H 9.053 -7.530 -1.162 1.00 . A A . 33 ALA H 1 1 8 4813 1 1 33 ALA HA H 9.090 -8.077 -4.081 1.00 . A A . 33 ALA HA 1 1 8 4814 1 1 33 ALA HB1 H 7.579 -9.929 -3.445 1.00 . A A . 33 ALA HB1 1 1 8 4815 1 1 33 ALA HB2 H 9.090 -9.998 -2.520 1.00 . A A . 33 ALA HB2 1 1 8 4816 1 1 33 ALA HB3 H 7.600 -9.369 -1.755 1.00 . A A . 33 ALA HB3 1 1 8 4817 1 1 33 ALA N N 9.341 -7.384 -2.119 1.00 . A A . 33 ALA N 1 1 8 4818 1 1 33 ALA O O 6.377 -7.700 -4.184 1.00 . A A . 33 ALA O 1 1 8 4819 1 1 34 GLY C C 5.234 -5.065 -4.215 1.00 . A A . 34 GLY C 1 1 8 4820 1 1 34 GLY CA C 5.703 -5.432 -2.803 1.00 . A A . 34 GLY CA 1 1 8 4821 1 1 34 GLY H H 7.739 -5.677 -2.218 1.00 . A A . 34 GLY H 1 1 8 4822 1 1 34 GLY HA2 H 5.737 -4.534 -2.196 1.00 . A A . 34 GLY HA2 1 1 8 4823 1 1 34 GLY HA3 H 4.964 -6.097 -2.359 1.00 . A A . 34 GLY HA3 1 1 8 4824 1 1 34 GLY N N 7.001 -6.095 -2.767 1.00 . A A . 34 GLY N 1 1 8 4825 1 1 34 GLY O O 4.028 -5.069 -4.444 1.00 . A A . 34 GLY O 1 1 8 4826 1 1 35 CYS C C 5.151 -5.659 -7.291 1.00 . A A . 35 CYS C 1 1 8 4827 1 1 35 CYS CA C 5.782 -4.484 -6.545 1.00 . A A . 35 CYS CA 1 1 8 4828 1 1 35 CYS CB C 7.025 -4.076 -7.324 1.00 . A A . 35 CYS CB 1 1 8 4829 1 1 35 CYS H H 7.125 -4.820 -4.934 1.00 . A A . 35 CYS H 1 1 8 4830 1 1 35 CYS HA H 5.076 -3.653 -6.542 1.00 . A A . 35 CYS HA 1 1 8 4831 1 1 35 CYS HB2 H 7.686 -4.945 -7.377 1.00 . A A . 35 CYS HB2 1 1 8 4832 1 1 35 CYS HB3 H 6.717 -3.847 -8.343 1.00 . A A . 35 CYS HB3 1 1 8 4833 1 1 35 CYS N N 6.138 -4.799 -5.164 1.00 . A A . 35 CYS N 1 1 8 4834 1 1 35 CYS O O 4.454 -5.433 -8.286 1.00 . A A . 35 CYS O 1 1 8 4835 1 1 35 CYS SG S 7.911 -2.628 -6.697 1.00 . A A . 35 CYS SG 1 1 8 4836 1 1 36 SER C C 3.396 -8.352 -6.764 1.00 . A A . 36 SER C 1 1 8 4837 1 1 36 SER CA C 4.738 -8.056 -7.437 1.00 . A A . 36 SER CA 1 1 8 4838 1 1 36 SER CB C 5.716 -9.222 -7.327 1.00 . A A . 36 SER CB 1 1 8 4839 1 1 36 SER H H 6.004 -7.125 -6.087 1.00 . A A . 36 SER H 1 1 8 4840 1 1 36 SER HA H 4.584 -7.842 -8.493 1.00 . A A . 36 SER HA 1 1 8 4841 1 1 36 SER HB2 H 5.434 -9.964 -8.056 1.00 . A A . 36 SER HB2 1 1 8 4842 1 1 36 SER HB3 H 6.694 -8.832 -7.582 1.00 . A A . 36 SER HB3 1 1 8 4843 1 1 36 SER HG H 4.937 -10.152 -5.771 1.00 . A A . 36 SER HG 1 1 8 4844 1 1 36 SER N N 5.379 -6.903 -6.854 1.00 . A A . 36 SER N 1 1 8 4845 1 1 36 SER O O 2.637 -9.213 -7.223 1.00 . A A . 36 SER O 1 1 8 4846 1 1 36 SER OG O 5.815 -9.838 -6.054 1.00 . A A . 36 SER OG 1 1 8 4847 1 1 37 ASN C C 0.833 -7.009 -5.506 1.00 . A A . 37 ASN C 1 1 8 4848 1 1 37 ASN CA C 1.905 -7.867 -4.848 1.00 . A A . 37 ASN CA 1 1 8 4849 1 1 37 ASN CB C 2.056 -7.469 -3.358 1.00 . A A . 37 ASN CB 1 1 8 4850 1 1 37 ASN CG C 1.239 -8.407 -2.496 1.00 . A A . 37 ASN CG 1 1 8 4851 1 1 37 ASN H H 3.843 -7.049 -5.337 1.00 . A A . 37 ASN H 1 1 8 4852 1 1 37 ASN HA H 1.588 -8.908 -4.896 1.00 . A A . 37 ASN HA 1 1 8 4853 1 1 37 ASN HB2 H 3.073 -7.347 -3.019 1.00 . A A . 37 ASN HB2 1 1 8 4854 1 1 37 ASN HB3 H 1.710 -6.473 -3.175 1.00 . A A . 37 ASN HB3 1 1 8 4855 1 1 37 ASN HD21 H -0.337 -7.136 -2.443 1.00 . A A . 37 ASN HD21 1 1 8 4856 1 1 37 ASN HD22 H -0.600 -8.655 -1.639 1.00 . A A . 37 ASN HD22 1 1 8 4857 1 1 37 ASN N N 3.140 -7.725 -5.613 1.00 . A A . 37 ASN N 1 1 8 4858 1 1 37 ASN ND2 N -0.002 -8.055 -2.201 1.00 . A A . 37 ASN ND2 1 1 8 4859 1 1 37 ASN O O 0.582 -5.914 -5.028 1.00 . A A . 37 ASN O 1 1 8 4860 1 1 37 ASN OD1 O 1.706 -9.472 -2.106 1.00 . A A . 37 ASN OD1 1 1 8 4861 1 1 38 SER C C -1.835 -5.894 -6.532 1.00 . A A . 38 SER C 1 1 8 4862 1 1 38 SER CA C -0.756 -6.635 -7.357 1.00 . A A . 38 SER CA 1 1 8 4863 1 1 38 SER CB C -1.382 -7.534 -8.402 1.00 . A A . 38 SER CB 1 1 8 4864 1 1 38 SER H H 0.351 -8.389 -6.917 1.00 . A A . 38 SER H 1 1 8 4865 1 1 38 SER HA H -0.183 -5.905 -7.920 1.00 . A A . 38 SER HA 1 1 8 4866 1 1 38 SER HB2 H -1.909 -8.301 -7.867 1.00 . A A . 38 SER HB2 1 1 8 4867 1 1 38 SER HB3 H -2.077 -6.971 -9.021 1.00 . A A . 38 SER HB3 1 1 8 4868 1 1 38 SER HG H -0.741 -8.825 -9.742 1.00 . A A . 38 SER HG 1 1 8 4869 1 1 38 SER N N 0.172 -7.451 -6.569 1.00 . A A . 38 SER N 1 1 8 4870 1 1 38 SER O O -2.326 -4.856 -6.982 1.00 . A A . 38 SER O 1 1 8 4871 1 1 38 SER OG O -0.355 -8.110 -9.190 1.00 . A A . 38 SER OG 1 1 8 4872 1 1 39 ASP C C -2.419 -4.400 -3.832 1.00 . A A . 39 ASP C 1 1 8 4873 1 1 39 ASP CA C -3.031 -5.715 -4.338 1.00 . A A . 39 ASP CA 1 1 8 4874 1 1 39 ASP CB C -3.234 -6.660 -3.139 1.00 . A A . 39 ASP CB 1 1 8 4875 1 1 39 ASP CG C -4.431 -6.301 -2.250 1.00 . A A . 39 ASP CG 1 1 8 4876 1 1 39 ASP H H -1.753 -7.264 -5.081 1.00 . A A . 39 ASP H 1 1 8 4877 1 1 39 ASP HA H -3.998 -5.509 -4.800 1.00 . A A . 39 ASP HA 1 1 8 4878 1 1 39 ASP HB2 H -3.384 -7.675 -3.510 1.00 . A A . 39 ASP HB2 1 1 8 4879 1 1 39 ASP HB3 H -2.331 -6.672 -2.530 1.00 . A A . 39 ASP HB3 1 1 8 4880 1 1 39 ASP N N -2.169 -6.380 -5.328 1.00 . A A . 39 ASP N 1 1 8 4881 1 1 39 ASP O O -3.130 -3.417 -3.641 1.00 . A A . 39 ASP O 1 1 8 4882 1 1 39 ASP OD1 O -4.315 -5.512 -1.291 1.00 . A A . 39 ASP OD1 1 1 8 4883 1 1 39 ASP OD2 O -5.496 -6.941 -2.423 1.00 . A A . 39 ASP OD2 1 1 8 4884 1 1 40 CYS C C 0.484 -2.542 -4.168 1.00 . A A . 40 CYS C 1 1 8 4885 1 1 40 CYS CA C -0.278 -3.302 -3.083 1.00 . A A . 40 CYS CA 1 1 8 4886 1 1 40 CYS CB C 0.704 -3.893 -2.055 1.00 . A A . 40 CYS CB 1 1 8 4887 1 1 40 CYS H H -0.567 -5.174 -3.961 1.00 . A A . 40 CYS H 1 1 8 4888 1 1 40 CYS HA H -0.917 -2.587 -2.573 1.00 . A A . 40 CYS HA 1 1 8 4889 1 1 40 CYS HB2 H 1.281 -4.730 -2.469 1.00 . A A . 40 CYS HB2 1 1 8 4890 1 1 40 CYS HB3 H 1.442 -3.147 -1.746 1.00 . A A . 40 CYS HB3 1 1 8 4891 1 1 40 CYS N N -1.100 -4.383 -3.619 1.00 . A A . 40 CYS N 1 1 8 4892 1 1 40 CYS O O 0.849 -1.393 -3.953 1.00 . A A . 40 CYS O 1 1 8 4893 1 1 40 CYS SG S -0.175 -4.405 -0.566 1.00 . A A . 40 CYS SG 1 1 8 4894 1 1 41 THR C C 1.190 -1.215 -6.805 1.00 . A A . 41 THR C 1 1 8 4895 1 1 41 THR CA C 1.565 -2.634 -6.381 1.00 . A A . 41 THR CA 1 1 8 4896 1 1 41 THR CB C 1.470 -3.638 -7.528 1.00 . A A . 41 THR CB 1 1 8 4897 1 1 41 THR CG2 C 2.105 -3.245 -8.840 1.00 . A A . 41 THR CG2 1 1 8 4898 1 1 41 THR H H 0.496 -4.131 -5.415 1.00 . A A . 41 THR H 1 1 8 4899 1 1 41 THR HA H 2.592 -2.617 -6.012 1.00 . A A . 41 THR HA 1 1 8 4900 1 1 41 THR HB H 0.415 -3.830 -7.727 1.00 . A A . 41 THR HB 1 1 8 4901 1 1 41 THR HG1 H 2.655 -5.162 -7.834 1.00 . A A . 41 THR HG1 1 1 8 4902 1 1 41 THR HG21 H 3.164 -3.028 -8.706 1.00 . A A . 41 THR HG21 1 1 8 4903 1 1 41 THR HG22 H 1.958 -4.104 -9.485 1.00 . A A . 41 THR HG22 1 1 8 4904 1 1 41 THR HG23 H 1.591 -2.383 -9.264 1.00 . A A . 41 THR HG23 1 1 8 4905 1 1 41 THR N N 0.722 -3.148 -5.323 1.00 . A A . 41 THR N 1 1 8 4906 1 1 41 THR O O 2.088 -0.385 -6.925 1.00 . A A . 41 THR O 1 1 8 4907 1 1 41 THR OG1 O 2.076 -4.839 -7.124 1.00 . A A . 41 THR OG1 1 1 8 4908 1 1 42 ALA C C -0.278 1.460 -6.462 1.00 . A A . 42 ALA C 1 1 8 4909 1 1 42 ALA CA C -0.489 0.392 -7.534 1.00 . A A . 42 ALA CA 1 1 8 4910 1 1 42 ALA CB C -1.933 0.372 -8.037 1.00 . A A . 42 ALA CB 1 1 8 4911 1 1 42 ALA H H -0.815 -1.581 -6.779 1.00 . A A . 42 ALA H 1 1 8 4912 1 1 42 ALA HA H 0.156 0.639 -8.375 1.00 . A A . 42 ALA HA 1 1 8 4913 1 1 42 ALA HB1 H -2.057 -0.430 -8.763 1.00 . A A . 42 ALA HB1 1 1 8 4914 1 1 42 ALA HB2 H -2.631 0.239 -7.211 1.00 . A A . 42 ALA HB2 1 1 8 4915 1 1 42 ALA HB3 H -2.142 1.325 -8.525 1.00 . A A . 42 ALA HB3 1 1 8 4916 1 1 42 ALA N N -0.093 -0.920 -7.038 1.00 . A A . 42 ALA N 1 1 8 4917 1 1 42 ALA O O 0.213 2.544 -6.776 1.00 . A A . 42 ALA O 1 1 8 4918 1 1 43 PHE C C 1.302 2.216 -4.109 1.00 . A A . 43 PHE C 1 1 8 4919 1 1 43 PHE CA C -0.209 1.975 -4.062 1.00 . A A . 43 PHE CA 1 1 8 4920 1 1 43 PHE CB C -0.701 1.334 -2.750 1.00 . A A . 43 PHE CB 1 1 8 4921 1 1 43 PHE CD1 C 1.060 1.793 -1.027 1.00 . A A . 43 PHE CD1 1 1 8 4922 1 1 43 PHE CD2 C -1.148 2.687 -0.615 1.00 . A A . 43 PHE CD2 1 1 8 4923 1 1 43 PHE CE1 C 1.536 2.371 0.152 1.00 . A A . 43 PHE CE1 1 1 8 4924 1 1 43 PHE CE2 C -0.696 3.208 0.611 1.00 . A A . 43 PHE CE2 1 1 8 4925 1 1 43 PHE CG C -0.259 1.988 -1.453 1.00 . A A . 43 PHE CG 1 1 8 4926 1 1 43 PHE CZ C 0.652 3.067 0.983 1.00 . A A . 43 PHE CZ 1 1 8 4927 1 1 43 PHE H H -0.974 0.221 -5.018 1.00 . A A . 43 PHE H 1 1 8 4928 1 1 43 PHE HA H -0.691 2.944 -4.173 1.00 . A A . 43 PHE HA 1 1 8 4929 1 1 43 PHE HB2 H -1.787 1.281 -2.775 1.00 . A A . 43 PHE HB2 1 1 8 4930 1 1 43 PHE HB3 H -0.332 0.316 -2.709 1.00 . A A . 43 PHE HB3 1 1 8 4931 1 1 43 PHE HD1 H 1.699 1.177 -1.618 1.00 . A A . 43 PHE HD1 1 1 8 4932 1 1 43 PHE HD2 H -2.185 2.800 -0.886 1.00 . A A . 43 PHE HD2 1 1 8 4933 1 1 43 PHE HE1 H 2.568 2.256 0.440 1.00 . A A . 43 PHE HE1 1 1 8 4934 1 1 43 PHE HE2 H -1.389 3.719 1.260 1.00 . A A . 43 PHE HE2 1 1 8 4935 1 1 43 PHE HZ H 1.030 3.459 1.908 1.00 . A A . 43 PHE HZ 1 1 8 4936 1 1 43 PHE N N -0.587 1.144 -5.199 1.00 . A A . 43 PHE N 1 1 8 4937 1 1 43 PHE O O 1.727 3.362 -4.213 1.00 . A A . 43 PHE O 1 1 8 4938 1 1 44 LEU C C 4.207 2.086 -5.140 1.00 . A A . 44 LEU C 1 1 8 4939 1 1 44 LEU CA C 3.579 1.364 -3.944 1.00 . A A . 44 LEU CA 1 1 8 4940 1 1 44 LEU CB C 4.287 0.026 -3.728 1.00 . A A . 44 LEU CB 1 1 8 4941 1 1 44 LEU CD1 C 4.549 -2.117 -2.511 1.00 . A A . 44 LEU CD1 1 1 8 4942 1 1 44 LEU CD2 C 3.987 -0.057 -1.179 1.00 . A A . 44 LEU CD2 1 1 8 4943 1 1 44 LEU CG C 3.811 -0.783 -2.509 1.00 . A A . 44 LEU CG 1 1 8 4944 1 1 44 LEU H H 1.768 0.239 -3.858 1.00 . A A . 44 LEU H 1 1 8 4945 1 1 44 LEU HA H 3.733 1.994 -3.073 1.00 . A A . 44 LEU HA 1 1 8 4946 1 1 44 LEU HB2 H 4.178 -0.585 -4.622 1.00 . A A . 44 LEU HB2 1 1 8 4947 1 1 44 LEU HB3 H 5.345 0.236 -3.627 1.00 . A A . 44 LEU HB3 1 1 8 4948 1 1 44 LEU HD11 H 5.626 -1.964 -2.537 1.00 . A A . 44 LEU HD11 1 1 8 4949 1 1 44 LEU HD12 H 4.293 -2.696 -1.628 1.00 . A A . 44 LEU HD12 1 1 8 4950 1 1 44 LEU HD13 H 4.251 -2.677 -3.395 1.00 . A A . 44 LEU HD13 1 1 8 4951 1 1 44 LEU HD21 H 3.719 0.993 -1.222 1.00 . A A . 44 LEU HD21 1 1 8 4952 1 1 44 LEU HD22 H 3.326 -0.523 -0.451 1.00 . A A . 44 LEU HD22 1 1 8 4953 1 1 44 LEU HD23 H 5.016 -0.132 -0.853 1.00 . A A . 44 LEU HD23 1 1 8 4954 1 1 44 LEU HG H 2.756 -1.013 -2.588 1.00 . A A . 44 LEU HG 1 1 8 4955 1 1 44 LEU N N 2.137 1.171 -4.057 1.00 . A A . 44 LEU N 1 1 8 4956 1 1 44 LEU O O 5.168 2.838 -4.958 1.00 . A A . 44 LEU O 1 1 8 4957 1 1 45 SER C C 3.977 4.113 -7.306 1.00 . A A . 45 SER C 1 1 8 4958 1 1 45 SER CA C 4.063 2.605 -7.553 1.00 . A A . 45 SER CA 1 1 8 4959 1 1 45 SER CB C 3.168 2.152 -8.712 1.00 . A A . 45 SER CB 1 1 8 4960 1 1 45 SER H H 2.943 1.183 -6.411 1.00 . A A . 45 SER H 1 1 8 4961 1 1 45 SER HA H 5.088 2.350 -7.799 1.00 . A A . 45 SER HA 1 1 8 4962 1 1 45 SER HB2 H 3.082 1.070 -8.683 1.00 . A A . 45 SER HB2 1 1 8 4963 1 1 45 SER HB3 H 2.170 2.576 -8.602 1.00 . A A . 45 SER HB3 1 1 8 4964 1 1 45 SER HG H 3.482 3.446 -10.130 1.00 . A A . 45 SER HG 1 1 8 4965 1 1 45 SER N N 3.678 1.880 -6.345 1.00 . A A . 45 SER N 1 1 8 4966 1 1 45 SER O O 4.897 4.863 -7.639 1.00 . A A . 45 SER O 1 1 8 4967 1 1 45 SER OG O 3.709 2.509 -9.970 1.00 . A A . 45 SER OG 1 1 8 4968 1 1 46 GLN C C 3.725 6.166 -5.037 1.00 . A A . 46 GLN C 1 1 8 4969 1 1 46 GLN CA C 2.755 5.923 -6.206 1.00 . A A . 46 GLN CA 1 1 8 4970 1 1 46 GLN CB C 1.266 6.223 -5.934 1.00 . A A . 46 GLN CB 1 1 8 4971 1 1 46 GLN CD C -0.954 6.561 -7.161 1.00 . A A . 46 GLN CD 1 1 8 4972 1 1 46 GLN CG C 0.452 5.983 -7.221 1.00 . A A . 46 GLN CG 1 1 8 4973 1 1 46 GLN H H 2.201 3.875 -6.375 1.00 . A A . 46 GLN H 1 1 8 4974 1 1 46 GLN HA H 3.057 6.582 -7.015 1.00 . A A . 46 GLN HA 1 1 8 4975 1 1 46 GLN HB2 H 0.875 5.596 -5.136 1.00 . A A . 46 GLN HB2 1 1 8 4976 1 1 46 GLN HB3 H 1.154 7.265 -5.639 1.00 . A A . 46 GLN HB3 1 1 8 4977 1 1 46 GLN HE21 H -1.875 4.736 -7.038 1.00 . A A . 46 GLN HE21 1 1 8 4978 1 1 46 GLN HE22 H -2.919 6.138 -7.066 1.00 . A A . 46 GLN HE22 1 1 8 4979 1 1 46 GLN HG2 H 0.966 6.459 -8.057 1.00 . A A . 46 GLN HG2 1 1 8 4980 1 1 46 GLN HG3 H 0.395 4.920 -7.440 1.00 . A A . 46 GLN HG3 1 1 8 4981 1 1 46 GLN N N 2.901 4.553 -6.660 1.00 . A A . 46 GLN N 1 1 8 4982 1 1 46 GLN NE2 N -1.989 5.744 -7.083 1.00 . A A . 46 GLN NE2 1 1 8 4983 1 1 46 GLN O O 4.782 6.781 -5.227 1.00 . A A . 46 GLN O 1 1 8 4984 1 1 46 GLN OE1 O -1.122 7.771 -7.298 1.00 . A A . 46 GLN OE1 1 1 8 4985 1 1 47 CYS C C 5.499 5.795 -2.431 1.00 . A A . 47 CYS C 1 1 8 4986 1 1 47 CYS CA C 3.985 6.017 -2.571 1.00 . A A . 47 CYS CA 1 1 8 4987 1 1 47 CYS CB C 3.240 5.287 -1.441 1.00 . A A . 47 CYS CB 1 1 8 4988 1 1 47 CYS H H 2.584 5.035 -3.827 1.00 . A A . 47 CYS H 1 1 8 4989 1 1 47 CYS HA H 3.795 7.086 -2.457 1.00 . A A . 47 CYS HA 1 1 8 4990 1 1 47 CYS HB2 H 3.629 4.267 -1.341 1.00 . A A . 47 CYS HB2 1 1 8 4991 1 1 47 CYS HB3 H 3.457 5.805 -0.508 1.00 . A A . 47 CYS HB3 1 1 8 4992 1 1 47 CYS N N 3.420 5.612 -3.859 1.00 . A A . 47 CYS N 1 1 8 4993 1 1 47 CYS O O 6.134 6.446 -1.597 1.00 . A A . 47 CYS O 1 1 8 4994 1 1 47 CYS SG S 1.432 5.211 -1.633 1.00 . A A . 47 CYS SG 1 1 8 4995 1 1 48 TYR C C 8.174 4.855 -4.599 1.00 . A A . 48 TYR C 1 1 8 4996 1 1 48 TYR CA C 7.532 4.613 -3.239 1.00 . A A . 48 TYR CA 1 1 8 4997 1 1 48 TYR CB C 7.791 3.171 -2.831 1.00 . A A . 48 TYR CB 1 1 8 4998 1 1 48 TYR CD1 C 8.619 3.305 -0.449 1.00 . A A . 48 TYR CD1 1 1 8 4999 1 1 48 TYR CD2 C 6.456 2.285 -0.898 1.00 . A A . 48 TYR CD2 1 1 8 5000 1 1 48 TYR CE1 C 8.479 3.014 0.916 1.00 . A A . 48 TYR CE1 1 1 8 5001 1 1 48 TYR CE2 C 6.338 1.926 0.453 1.00 . A A . 48 TYR CE2 1 1 8 5002 1 1 48 TYR CG C 7.611 2.933 -1.354 1.00 . A A . 48 TYR CG 1 1 8 5003 1 1 48 TYR CZ C 7.343 2.314 1.365 1.00 . A A . 48 TYR CZ 1 1 8 5004 1 1 48 TYR H H 5.509 4.392 -3.876 1.00 . A A . 48 TYR H 1 1 8 5005 1 1 48 TYR HA H 8.050 5.228 -2.511 1.00 . A A . 48 TYR HA 1 1 8 5006 1 1 48 TYR HB2 H 7.151 2.498 -3.400 1.00 . A A . 48 TYR HB2 1 1 8 5007 1 1 48 TYR HB3 H 8.815 2.922 -3.099 1.00 . A A . 48 TYR HB3 1 1 8 5008 1 1 48 TYR HD1 H 9.506 3.817 -0.796 1.00 . A A . 48 TYR HD1 1 1 8 5009 1 1 48 TYR HD2 H 5.696 2.006 -1.605 1.00 . A A . 48 TYR HD2 1 1 8 5010 1 1 48 TYR HE1 H 9.250 3.303 1.614 1.00 . A A . 48 TYR HE1 1 1 8 5011 1 1 48 TYR HE2 H 5.505 1.315 0.765 1.00 . A A . 48 TYR HE2 1 1 8 5012 1 1 48 TYR HH H 7.647 1.232 2.933 1.00 . A A . 48 TYR HH 1 1 8 5013 1 1 48 TYR N N 6.095 4.901 -3.224 1.00 . A A . 48 TYR N 1 1 8 5014 1 1 48 TYR O O 9.390 5.013 -4.669 1.00 . A A . 48 TYR O 1 1 8 5015 1 1 48 TYR OH O 7.196 2.059 2.689 1.00 . A A . 48 TYR OH 1 1 8 5016 1 1 49 GLY C C 7.854 3.502 -7.674 1.00 . A A . 49 GLY C 1 1 8 5017 1 1 49 GLY CA C 7.897 4.891 -7.039 1.00 . A A . 49 GLY CA 1 1 8 5018 1 1 49 GLY H H 6.406 4.691 -5.553 1.00 . A A . 49 GLY H 1 1 8 5019 1 1 49 GLY HA2 H 8.927 5.238 -7.050 1.00 . A A . 49 GLY HA2 1 1 8 5020 1 1 49 GLY HA3 H 7.310 5.580 -7.644 1.00 . A A . 49 GLY HA3 1 1 8 5021 1 1 49 GLY N N 7.389 4.882 -5.673 1.00 . A A . 49 GLY N 1 1 8 5022 1 1 49 GLY O O 8.057 3.376 -8.877 1.00 . A A . 49 GLY O 1 1 8 5023 1 1 50 GLY C C 8.827 0.509 -7.626 1.00 . A A . 50 GLY C 1 1 8 5024 1 1 50 GLY CA C 7.445 1.092 -7.376 1.00 . A A . 50 GLY CA 1 1 8 5025 1 1 50 GLY H H 7.306 2.648 -5.933 1.00 . A A . 50 GLY H 1 1 8 5026 1 1 50 GLY HA2 H 6.878 1.069 -8.308 1.00 . A A . 50 GLY HA2 1 1 8 5027 1 1 50 GLY HA3 H 6.927 0.484 -6.635 1.00 . A A . 50 GLY HA3 1 1 8 5028 1 1 50 GLY N N 7.540 2.459 -6.894 1.00 . A A . 50 GLY N 1 1 8 5029 1 1 50 GLY O O 9.196 0.282 -8.780 1.00 . A A . 50 GLY O 1 1 8 5030 1 1 51 CYS C C 11.771 0.410 -7.536 1.00 . A A . 51 CYS C 1 1 8 5031 1 1 51 CYS CA C 10.890 -0.355 -6.553 1.00 . A A . 51 CYS CA 1 1 8 5032 1 1 51 CYS CB C 10.903 -1.900 -6.673 1.00 . A A . 51 CYS CB 1 1 8 5033 1 1 51 CYS H H 9.165 0.469 -5.628 1.00 . A A . 51 CYS H 1 1 8 5034 1 1 51 CYS HA H 11.344 -0.128 -5.600 1.00 . A A . 51 CYS HA 1 1 8 5035 1 1 51 CYS HB2 H 11.887 -2.193 -7.040 1.00 . A A . 51 CYS HB2 1 1 8 5036 1 1 51 CYS HB3 H 10.816 -2.345 -5.683 1.00 . A A . 51 CYS HB3 1 1 8 5037 1 1 51 CYS N N 9.539 0.200 -6.532 1.00 . A A . 51 CYS N 1 1 8 5038 1 1 51 CYS O O 11.866 1.644 -7.365 1.00 . A A . 51 CYS O 1 1 8 5039 1 1 51 CYS OXT O 12.447 -0.228 -8.375 1.00 . A A . 51 CYS OXT 1 1 8 5040 1 1 51 CYS SG S 9.660 -2.687 -7.741 1.00 . A A . 51 CYS SG 1 1 9 5041 1 1 1 GLY C C -7.761 -6.018 -1.307 1.00 . A A . 1 GLY C 1 1 9 5042 1 1 1 GLY CA C -7.364 -7.223 -2.150 1.00 . A A . 1 GLY CA 1 1 9 5043 1 1 1 GLY H1 H -8.288 -6.533 -3.844 1.00 . A A . 1 GLY H1 1 1 9 5044 1 1 1 GLY H2 H -6.691 -6.172 -3.765 1.00 . A A . 1 GLY H2 1 1 9 5045 1 1 1 GLY H3 H -7.168 -7.704 -4.149 1.00 . A A . 1 GLY H3 1 1 9 5046 1 1 1 GLY HA2 H -6.359 -7.540 -1.871 1.00 . A A . 1 GLY HA2 1 1 9 5047 1 1 1 GLY HA3 H -8.058 -8.032 -1.953 1.00 . A A . 1 GLY HA3 1 1 9 5048 1 1 1 GLY N N -7.381 -6.894 -3.585 1.00 . A A . 1 GLY N 1 1 9 5049 1 1 1 GLY O O -8.500 -5.147 -1.775 1.00 . A A . 1 GLY O 1 1 9 5050 1 1 2 GLU C C -6.969 -3.549 0.491 1.00 . A A . 2 GLU C 1 1 9 5051 1 1 2 GLU CA C -7.623 -4.878 0.872 1.00 . A A . 2 GLU CA 1 1 9 5052 1 1 2 GLU CB C -7.252 -5.246 2.306 1.00 . A A . 2 GLU CB 1 1 9 5053 1 1 2 GLU CD C -5.597 -7.075 2.801 1.00 . A A . 2 GLU CD 1 1 9 5054 1 1 2 GLU CG C -5.773 -5.608 2.441 1.00 . A A . 2 GLU CG 1 1 9 5055 1 1 2 GLU H H -6.732 -6.717 0.324 1.00 . A A . 2 GLU H 1 1 9 5056 1 1 2 GLU HA H -8.686 -4.723 0.884 1.00 . A A . 2 GLU HA 1 1 9 5057 1 1 2 GLU HB2 H -7.477 -4.397 2.954 1.00 . A A . 2 GLU HB2 1 1 9 5058 1 1 2 GLU HB3 H -7.873 -6.082 2.627 1.00 . A A . 2 GLU HB3 1 1 9 5059 1 1 2 GLU HG2 H -5.243 -5.415 1.514 1.00 . A A . 2 GLU HG2 1 1 9 5060 1 1 2 GLU HG3 H -5.345 -4.966 3.199 1.00 . A A . 2 GLU HG3 1 1 9 5061 1 1 2 GLU N N -7.319 -5.974 -0.046 1.00 . A A . 2 GLU N 1 1 9 5062 1 1 2 GLU O O -7.529 -2.494 0.794 1.00 . A A . 2 GLU O 1 1 9 5063 1 1 2 GLU OE1 O -6.005 -7.925 1.980 1.00 . A A . 2 GLU OE1 1 1 9 5064 1 1 2 GLU OE2 O -5.077 -7.360 3.907 1.00 . A A . 2 GLU OE2 1 1 9 5065 1 1 3 CYS C C -5.825 -1.645 -1.622 1.00 . A A . 3 CYS C 1 1 9 5066 1 1 3 CYS CA C -5.099 -2.335 -0.462 1.00 . A A . 3 CYS CA 1 1 9 5067 1 1 3 CYS CB C -3.633 -2.653 -0.741 1.00 . A A . 3 CYS CB 1 1 9 5068 1 1 3 CYS H H -5.399 -4.449 -0.471 1.00 . A A . 3 CYS H 1 1 9 5069 1 1 3 CYS HA H -5.141 -1.679 0.408 1.00 . A A . 3 CYS HA 1 1 9 5070 1 1 3 CYS HB2 H -3.210 -3.143 0.137 1.00 . A A . 3 CYS HB2 1 1 9 5071 1 1 3 CYS HB3 H -3.583 -3.355 -1.563 1.00 . A A . 3 CYS HB3 1 1 9 5072 1 1 3 CYS N N -5.798 -3.568 -0.147 1.00 . A A . 3 CYS N 1 1 9 5073 1 1 3 CYS O O -6.066 -0.436 -1.564 1.00 . A A . 3 CYS O 1 1 9 5074 1 1 3 CYS SG S -2.612 -1.221 -1.139 1.00 . A A . 3 CYS SG 1 1 9 5075 1 1 4 GLU C C -8.540 -1.511 -2.960 1.00 . A A . 4 GLU C 1 1 9 5076 1 1 4 GLU CA C -7.241 -2.006 -3.618 1.00 . A A . 4 GLU CA 1 1 9 5077 1 1 4 GLU CB C -7.544 -3.170 -4.574 1.00 . A A . 4 GLU CB 1 1 9 5078 1 1 4 GLU CD C -6.689 -4.820 -6.276 1.00 . A A . 4 GLU CD 1 1 9 5079 1 1 4 GLU CG C -6.415 -3.497 -5.559 1.00 . A A . 4 GLU CG 1 1 9 5080 1 1 4 GLU H H -5.986 -3.405 -2.620 1.00 . A A . 4 GLU H 1 1 9 5081 1 1 4 GLU HA H -6.810 -1.185 -4.193 1.00 . A A . 4 GLU HA 1 1 9 5082 1 1 4 GLU HB2 H -7.769 -4.057 -3.989 1.00 . A A . 4 GLU HB2 1 1 9 5083 1 1 4 GLU HB3 H -8.429 -2.924 -5.160 1.00 . A A . 4 GLU HB3 1 1 9 5084 1 1 4 GLU HG2 H -6.358 -2.699 -6.296 1.00 . A A . 4 GLU HG2 1 1 9 5085 1 1 4 GLU HG3 H -5.464 -3.553 -5.033 1.00 . A A . 4 GLU HG3 1 1 9 5086 1 1 4 GLU N N -6.283 -2.429 -2.605 1.00 . A A . 4 GLU N 1 1 9 5087 1 1 4 GLU O O -9.072 -0.480 -3.369 1.00 . A A . 4 GLU O 1 1 9 5088 1 1 4 GLU OE1 O -7.562 -4.859 -7.178 1.00 . A A . 4 GLU OE1 1 1 9 5089 1 1 4 GLU OE2 O -6.124 -5.874 -5.905 1.00 . A A . 4 GLU OE2 1 1 9 5090 1 1 5 GLN C C -10.186 -0.433 -0.633 1.00 . A A . 5 GLN C 1 1 9 5091 1 1 5 GLN CA C -10.304 -1.828 -1.262 1.00 . A A . 5 GLN CA 1 1 9 5092 1 1 5 GLN CB C -10.658 -2.871 -0.180 1.00 . A A . 5 GLN CB 1 1 9 5093 1 1 5 GLN CD C -12.867 -3.993 -0.674 1.00 . A A . 5 GLN CD 1 1 9 5094 1 1 5 GLN CG C -12.155 -2.940 0.167 1.00 . A A . 5 GLN CG 1 1 9 5095 1 1 5 GLN H H -8.582 -3.054 -1.658 1.00 . A A . 5 GLN H 1 1 9 5096 1 1 5 GLN HA H -11.089 -1.802 -2.015 1.00 . A A . 5 GLN HA 1 1 9 5097 1 1 5 GLN HB2 H -10.342 -3.861 -0.507 1.00 . A A . 5 GLN HB2 1 1 9 5098 1 1 5 GLN HB3 H -10.109 -2.634 0.731 1.00 . A A . 5 GLN HB3 1 1 9 5099 1 1 5 GLN HE21 H -13.373 -2.675 -2.173 1.00 . A A . 5 GLN HE21 1 1 9 5100 1 1 5 GLN HE22 H -13.750 -4.335 -2.456 1.00 . A A . 5 GLN HE22 1 1 9 5101 1 1 5 GLN HG2 H -12.254 -3.225 1.215 1.00 . A A . 5 GLN HG2 1 1 9 5102 1 1 5 GLN HG3 H -12.627 -1.966 0.034 1.00 . A A . 5 GLN HG3 1 1 9 5103 1 1 5 GLN N N -9.059 -2.205 -1.938 1.00 . A A . 5 GLN N 1 1 9 5104 1 1 5 GLN NE2 N -13.350 -3.639 -1.849 1.00 . A A . 5 GLN NE2 1 1 9 5105 1 1 5 GLN O O -11.140 0.349 -0.670 1.00 . A A . 5 GLN O 1 1 9 5106 1 1 5 GLN OE1 O -12.959 -5.157 -0.288 1.00 . A A . 5 GLN OE1 1 1 9 5107 1 1 6 CYS C C -8.547 2.239 -0.490 1.00 . A A . 6 CYS C 1 1 9 5108 1 1 6 CYS CA C -8.749 1.154 0.574 1.00 . A A . 6 CYS CA 1 1 9 5109 1 1 6 CYS CB C -7.523 1.000 1.474 1.00 . A A . 6 CYS CB 1 1 9 5110 1 1 6 CYS H H -8.318 -0.855 -0.004 1.00 . A A . 6 CYS H 1 1 9 5111 1 1 6 CYS HA H -9.605 1.429 1.189 1.00 . A A . 6 CYS HA 1 1 9 5112 1 1 6 CYS HB2 H -7.527 0.003 1.908 1.00 . A A . 6 CYS HB2 1 1 9 5113 1 1 6 CYS HB3 H -6.633 1.079 0.861 1.00 . A A . 6 CYS HB3 1 1 9 5114 1 1 6 CYS N N -9.029 -0.129 -0.046 1.00 . A A . 6 CYS N 1 1 9 5115 1 1 6 CYS O O -9.002 3.370 -0.303 1.00 . A A . 6 CYS O 1 1 9 5116 1 1 6 CYS SG S -7.421 2.205 2.820 1.00 . A A . 6 CYS SG 1 1 9 5117 1 1 7 PHE C C -9.202 3.132 -3.336 1.00 . A A . 7 PHE C 1 1 9 5118 1 1 7 PHE CA C -7.824 2.783 -2.781 1.00 . A A . 7 PHE CA 1 1 9 5119 1 1 7 PHE CB C -6.941 2.162 -3.877 1.00 . A A . 7 PHE CB 1 1 9 5120 1 1 7 PHE CD1 C -4.573 2.728 -3.206 1.00 . A A . 7 PHE CD1 1 1 9 5121 1 1 7 PHE CD2 C -5.510 3.807 -5.171 1.00 . A A . 7 PHE CD2 1 1 9 5122 1 1 7 PHE CE1 C -3.382 3.454 -3.393 1.00 . A A . 7 PHE CE1 1 1 9 5123 1 1 7 PHE CE2 C -4.308 4.511 -5.363 1.00 . A A . 7 PHE CE2 1 1 9 5124 1 1 7 PHE CG C -5.648 2.916 -4.091 1.00 . A A . 7 PHE CG 1 1 9 5125 1 1 7 PHE CZ C -3.238 4.350 -4.463 1.00 . A A . 7 PHE CZ 1 1 9 5126 1 1 7 PHE H H -7.557 0.954 -1.709 1.00 . A A . 7 PHE H 1 1 9 5127 1 1 7 PHE HA H -7.372 3.718 -2.446 1.00 . A A . 7 PHE HA 1 1 9 5128 1 1 7 PHE HB2 H -6.705 1.124 -3.635 1.00 . A A . 7 PHE HB2 1 1 9 5129 1 1 7 PHE HB3 H -7.489 2.147 -4.824 1.00 . A A . 7 PHE HB3 1 1 9 5130 1 1 7 PHE HD1 H -4.683 2.063 -2.354 1.00 . A A . 7 PHE HD1 1 1 9 5131 1 1 7 PHE HD2 H -6.334 3.970 -5.852 1.00 . A A . 7 PHE HD2 1 1 9 5132 1 1 7 PHE HE1 H -2.574 3.367 -2.686 1.00 . A A . 7 PHE HE1 1 1 9 5133 1 1 7 PHE HE2 H -4.238 5.198 -6.193 1.00 . A A . 7 PHE HE2 1 1 9 5134 1 1 7 PHE HZ H -2.318 4.925 -4.557 1.00 . A A . 7 PHE HZ 1 1 9 5135 1 1 7 PHE N N -7.928 1.895 -1.626 1.00 . A A . 7 PHE N 1 1 9 5136 1 1 7 PHE O O -9.423 4.296 -3.669 1.00 . A A . 7 PHE O 1 1 9 5137 1 1 8 SER C C -12.182 3.419 -3.002 1.00 . A A . 8 SER C 1 1 9 5138 1 1 8 SER CA C -11.488 2.359 -3.854 1.00 . A A . 8 SER CA 1 1 9 5139 1 1 8 SER CB C -12.256 1.026 -3.801 1.00 . A A . 8 SER CB 1 1 9 5140 1 1 8 SER H H -9.829 1.220 -3.148 1.00 . A A . 8 SER H 1 1 9 5141 1 1 8 SER HA H -11.456 2.721 -4.881 1.00 . A A . 8 SER HA 1 1 9 5142 1 1 8 SER HB2 H -11.595 0.213 -3.490 1.00 . A A . 8 SER HB2 1 1 9 5143 1 1 8 SER HB3 H -13.068 1.089 -3.072 1.00 . A A . 8 SER HB3 1 1 9 5144 1 1 8 SER HG H -13.745 0.907 -5.047 1.00 . A A . 8 SER HG 1 1 9 5145 1 1 8 SER N N -10.116 2.158 -3.403 1.00 . A A . 8 SER N 1 1 9 5146 1 1 8 SER O O -12.966 4.210 -3.515 1.00 . A A . 8 SER O 1 1 9 5147 1 1 8 SER OG O -12.786 0.710 -5.068 1.00 . A A . 8 SER OG 1 1 9 5148 1 1 9 ASP C C -11.495 5.774 -0.903 1.00 . A A . 9 ASP C 1 1 9 5149 1 1 9 ASP CA C -12.356 4.507 -0.794 1.00 . A A . 9 ASP CA 1 1 9 5150 1 1 9 ASP CB C -12.366 3.919 0.618 1.00 . A A . 9 ASP CB 1 1 9 5151 1 1 9 ASP CG C -13.300 4.666 1.567 1.00 . A A . 9 ASP CG 1 1 9 5152 1 1 9 ASP H H -11.176 2.827 -1.357 1.00 . A A . 9 ASP H 1 1 9 5153 1 1 9 ASP HA H -13.378 4.765 -1.070 1.00 . A A . 9 ASP HA 1 1 9 5154 1 1 9 ASP HB2 H -12.722 2.887 0.550 1.00 . A A . 9 ASP HB2 1 1 9 5155 1 1 9 ASP HB3 H -11.363 3.874 1.026 1.00 . A A . 9 ASP HB3 1 1 9 5156 1 1 9 ASP N N -11.866 3.481 -1.709 1.00 . A A . 9 ASP N 1 1 9 5157 1 1 9 ASP O O -11.142 6.399 0.096 1.00 . A A . 9 ASP O 1 1 9 5158 1 1 9 ASP OD1 O -13.039 5.814 1.987 1.00 . A A . 9 ASP OD1 1 1 9 5159 1 1 9 ASP OD2 O -14.307 4.024 1.958 1.00 . A A . 9 ASP OD2 1 1 9 5160 1 1 10 GLY C C -8.996 7.442 -1.591 1.00 . A A . 10 GLY C 1 1 9 5161 1 1 10 GLY CA C -10.268 7.303 -2.426 1.00 . A A . 10 GLY CA 1 1 9 5162 1 1 10 GLY H H -11.320 5.517 -2.888 1.00 . A A . 10 GLY H 1 1 9 5163 1 1 10 GLY HA2 H -10.888 8.180 -2.276 1.00 . A A . 10 GLY HA2 1 1 9 5164 1 1 10 GLY HA3 H -9.973 7.253 -3.477 1.00 . A A . 10 GLY HA3 1 1 9 5165 1 1 10 GLY N N -11.074 6.130 -2.119 1.00 . A A . 10 GLY N 1 1 9 5166 1 1 10 GLY O O -8.559 8.569 -1.325 1.00 . A A . 10 GLY O 1 1 9 5167 1 1 11 GLY C C -5.999 6.403 -1.142 1.00 . A A . 11 GLY C 1 1 9 5168 1 1 11 GLY CA C -7.253 6.312 -0.286 1.00 . A A . 11 GLY CA 1 1 9 5169 1 1 11 GLY H H -8.871 5.435 -1.343 1.00 . A A . 11 GLY H 1 1 9 5170 1 1 11 GLY HA2 H -7.233 5.384 0.271 1.00 . A A . 11 GLY HA2 1 1 9 5171 1 1 11 GLY HA3 H -7.304 7.148 0.399 1.00 . A A . 11 GLY HA3 1 1 9 5172 1 1 11 GLY N N -8.436 6.324 -1.126 1.00 . A A . 11 GLY N 1 1 9 5173 1 1 11 GLY O O -6.009 5.949 -2.289 1.00 . A A . 11 GLY O 1 1 9 5174 1 1 12 ASP C C -2.515 6.519 -0.755 1.00 . A A . 12 ASP C 1 1 9 5175 1 1 12 ASP CA C -3.707 7.268 -1.351 1.00 . A A . 12 ASP CA 1 1 9 5176 1 1 12 ASP CB C -3.457 8.790 -1.387 1.00 . A A . 12 ASP CB 1 1 9 5177 1 1 12 ASP CG C -3.793 9.588 -0.115 1.00 . A A . 12 ASP CG 1 1 9 5178 1 1 12 ASP H H -4.934 7.255 0.369 1.00 . A A . 12 ASP H 1 1 9 5179 1 1 12 ASP HA H -3.814 6.916 -2.382 1.00 . A A . 12 ASP HA 1 1 9 5180 1 1 12 ASP HB2 H -2.430 8.982 -1.681 1.00 . A A . 12 ASP HB2 1 1 9 5181 1 1 12 ASP HB3 H -4.099 9.169 -2.179 1.00 . A A . 12 ASP HB3 1 1 9 5182 1 1 12 ASP N N -4.912 6.946 -0.592 1.00 . A A . 12 ASP N 1 1 9 5183 1 1 12 ASP O O -2.324 5.346 -1.063 1.00 . A A . 12 ASP O 1 1 9 5184 1 1 12 ASP OD1 O -3.530 9.103 1.015 1.00 . A A . 12 ASP OD1 1 1 9 5185 1 1 12 ASP OD2 O -4.278 10.733 -0.261 1.00 . A A . 12 ASP OD2 1 1 9 5186 1 1 13 CYS C C -0.866 6.860 2.322 1.00 . A A . 13 CYS C 1 1 9 5187 1 1 13 CYS CA C -0.618 6.603 0.849 1.00 . A A . 13 CYS CA 1 1 9 5188 1 1 13 CYS CB C 0.710 7.203 0.364 1.00 . A A . 13 CYS CB 1 1 9 5189 1 1 13 CYS H H -2.077 8.069 0.432 1.00 . A A . 13 CYS H 1 1 9 5190 1 1 13 CYS HA H -0.580 5.526 0.697 1.00 . A A . 13 CYS HA 1 1 9 5191 1 1 13 CYS HB2 H 0.670 8.290 0.413 1.00 . A A . 13 CYS HB2 1 1 9 5192 1 1 13 CYS HB3 H 1.506 6.871 1.030 1.00 . A A . 13 CYS HB3 1 1 9 5193 1 1 13 CYS N N -1.752 7.152 0.133 1.00 . A A . 13 CYS N 1 1 9 5194 1 1 13 CYS O O -1.032 5.905 3.077 1.00 . A A . 13 CYS O 1 1 9 5195 1 1 13 CYS SG S 1.155 6.726 -1.321 1.00 . A A . 13 CYS SG 1 1 9 5196 1 1 14 THR C C -2.533 7.844 4.579 1.00 . A A . 14 THR C 1 1 9 5197 1 1 14 THR CA C -1.227 8.491 4.110 1.00 . A A . 14 THR CA 1 1 9 5198 1 1 14 THR CB C -1.235 10.022 4.237 1.00 . A A . 14 THR CB 1 1 9 5199 1 1 14 THR CG2 C -1.467 10.492 5.677 1.00 . A A . 14 THR CG2 1 1 9 5200 1 1 14 THR H H -0.827 8.894 2.079 1.00 . A A . 14 THR H 1 1 9 5201 1 1 14 THR HA H -0.423 8.100 4.733 1.00 . A A . 14 THR HA 1 1 9 5202 1 1 14 THR HB H -2.016 10.434 3.595 1.00 . A A . 14 THR HB 1 1 9 5203 1 1 14 THR HG1 H -0.059 11.468 3.682 1.00 . A A . 14 THR HG1 1 1 9 5204 1 1 14 THR HG21 H -0.737 10.045 6.350 1.00 . A A . 14 THR HG21 1 1 9 5205 1 1 14 THR HG22 H -1.393 11.578 5.733 1.00 . A A . 14 THR HG22 1 1 9 5206 1 1 14 THR HG23 H -2.468 10.205 6.003 1.00 . A A . 14 THR HG23 1 1 9 5207 1 1 14 THR N N -0.942 8.128 2.734 1.00 . A A . 14 THR N 1 1 9 5208 1 1 14 THR O O -2.526 7.124 5.580 1.00 . A A . 14 THR O 1 1 9 5209 1 1 14 THR OG1 O 0.025 10.502 3.803 1.00 . A A . 14 THR OG1 1 1 9 5210 1 1 15 THR C C -5.378 6.293 4.156 1.00 . A A . 15 THR C 1 1 9 5211 1 1 15 THR CA C -4.966 7.759 4.404 1.00 . A A . 15 THR CA 1 1 9 5212 1 1 15 THR CB C -5.901 8.847 3.812 1.00 . A A . 15 THR CB 1 1 9 5213 1 1 15 THR CG2 C -6.521 8.535 2.451 1.00 . A A . 15 THR CG2 1 1 9 5214 1 1 15 THR H H -3.599 8.540 2.959 1.00 . A A . 15 THR H 1 1 9 5215 1 1 15 THR HA H -4.922 7.902 5.481 1.00 . A A . 15 THR HA 1 1 9 5216 1 1 15 THR HB H -5.287 9.731 3.660 1.00 . A A . 15 THR HB 1 1 9 5217 1 1 15 THR HG1 H -6.448 9.520 5.533 1.00 . A A . 15 THR HG1 1 1 9 5218 1 1 15 THR HG21 H -5.773 8.072 1.813 1.00 . A A . 15 THR HG21 1 1 9 5219 1 1 15 THR HG22 H -7.371 7.863 2.564 1.00 . A A . 15 THR HG22 1 1 9 5220 1 1 15 THR HG23 H -6.860 9.453 1.976 1.00 . A A . 15 THR HG23 1 1 9 5221 1 1 15 THR N N -3.644 8.048 3.849 1.00 . A A . 15 THR N 1 1 9 5222 1 1 15 THR O O -6.551 5.966 4.052 1.00 . A A . 15 THR O 1 1 9 5223 1 1 15 THR OG1 O -6.904 9.253 4.716 1.00 . A A . 15 THR OG1 1 1 9 5224 1 1 16 CYS C C -3.274 3.345 4.893 1.00 . A A . 16 CYS C 1 1 9 5225 1 1 16 CYS CA C -4.499 3.934 4.192 1.00 . A A . 16 CYS CA 1 1 9 5226 1 1 16 CYS CB C -4.609 3.423 2.750 1.00 . A A . 16 CYS CB 1 1 9 5227 1 1 16 CYS H H -3.473 5.771 4.385 1.00 . A A . 16 CYS H 1 1 9 5228 1 1 16 CYS HA H -5.383 3.594 4.741 1.00 . A A . 16 CYS HA 1 1 9 5229 1 1 16 CYS HB2 H -3.873 3.939 2.133 1.00 . A A . 16 CYS HB2 1 1 9 5230 1 1 16 CYS HB3 H -4.384 2.356 2.722 1.00 . A A . 16 CYS HB3 1 1 9 5231 1 1 16 CYS N N -4.392 5.387 4.223 1.00 . A A . 16 CYS N 1 1 9 5232 1 1 16 CYS O O -3.415 2.342 5.579 1.00 . A A . 16 CYS O 1 1 9 5233 1 1 16 CYS SG S -6.255 3.668 2.029 1.00 . A A . 16 CYS SG 1 1 9 5234 1 1 17 PHE C C -1.350 3.572 7.144 1.00 . A A . 17 PHE C 1 1 9 5235 1 1 17 PHE CA C -0.978 3.497 5.663 1.00 . A A . 17 PHE CA 1 1 9 5236 1 1 17 PHE CB C 0.323 4.271 5.400 1.00 . A A . 17 PHE CB 1 1 9 5237 1 1 17 PHE CD1 C 1.791 2.314 5.971 1.00 . A A . 17 PHE CD1 1 1 9 5238 1 1 17 PHE CD2 C 2.260 4.426 7.075 1.00 . A A . 17 PHE CD2 1 1 9 5239 1 1 17 PHE CE1 C 2.819 1.699 6.700 1.00 . A A . 17 PHE CE1 1 1 9 5240 1 1 17 PHE CE2 C 3.316 3.808 7.774 1.00 . A A . 17 PHE CE2 1 1 9 5241 1 1 17 PHE CG C 1.496 3.675 6.158 1.00 . A A . 17 PHE CG 1 1 9 5242 1 1 17 PHE CZ C 3.605 2.450 7.577 1.00 . A A . 17 PHE CZ 1 1 9 5243 1 1 17 PHE H H -1.919 4.755 4.222 1.00 . A A . 17 PHE H 1 1 9 5244 1 1 17 PHE HA H -0.821 2.448 5.416 1.00 . A A . 17 PHE HA 1 1 9 5245 1 1 17 PHE HB2 H 0.554 4.228 4.336 1.00 . A A . 17 PHE HB2 1 1 9 5246 1 1 17 PHE HB3 H 0.189 5.317 5.684 1.00 . A A . 17 PHE HB3 1 1 9 5247 1 1 17 PHE HD1 H 1.232 1.750 5.241 1.00 . A A . 17 PHE HD1 1 1 9 5248 1 1 17 PHE HD2 H 2.049 5.472 7.253 1.00 . A A . 17 PHE HD2 1 1 9 5249 1 1 17 PHE HE1 H 3.050 0.654 6.571 1.00 . A A . 17 PHE HE1 1 1 9 5250 1 1 17 PHE HE2 H 3.921 4.360 8.477 1.00 . A A . 17 PHE HE2 1 1 9 5251 1 1 17 PHE HZ H 4.425 1.964 8.085 1.00 . A A . 17 PHE HZ 1 1 9 5252 1 1 17 PHE N N -2.087 3.966 4.835 1.00 . A A . 17 PHE N 1 1 9 5253 1 1 17 PHE O O -1.020 2.660 7.908 1.00 . A A . 17 PHE O 1 1 9 5254 1 1 18 ASN C C -1.553 4.651 9.980 1.00 . A A . 18 ASN C 1 1 9 5255 1 1 18 ASN CA C -2.629 4.793 8.891 1.00 . A A . 18 ASN CA 1 1 9 5256 1 1 18 ASN CB C -3.753 3.764 9.050 1.00 . A A . 18 ASN CB 1 1 9 5257 1 1 18 ASN CG C -4.795 4.101 10.107 1.00 . A A . 18 ASN CG 1 1 9 5258 1 1 18 ASN H H -2.282 5.355 6.860 1.00 . A A . 18 ASN H 1 1 9 5259 1 1 18 ASN HA H -3.053 5.794 8.970 1.00 . A A . 18 ASN HA 1 1 9 5260 1 1 18 ASN HB2 H -4.277 3.639 8.101 1.00 . A A . 18 ASN HB2 1 1 9 5261 1 1 18 ASN HB3 H -3.279 2.817 9.295 1.00 . A A . 18 ASN HB3 1 1 9 5262 1 1 18 ASN HD21 H -3.575 3.540 11.558 1.00 . A A . 18 ASN HD21 1 1 9 5263 1 1 18 ASN HD22 H -5.284 3.266 11.808 1.00 . A A . 18 ASN HD22 1 1 9 5264 1 1 18 ASN N N -2.063 4.639 7.546 1.00 . A A . 18 ASN N 1 1 9 5265 1 1 18 ASN ND2 N -4.535 3.809 11.369 1.00 . A A . 18 ASN ND2 1 1 9 5266 1 1 18 ASN O O -1.811 4.192 11.094 1.00 . A A . 18 ASN O 1 1 9 5267 1 1 18 ASN OD1 O -5.876 4.587 9.796 1.00 . A A . 18 ASN OD1 1 1 9 5268 1 1 19 ASN C C 1.082 3.272 10.793 1.00 . A A . 19 ASN C 1 1 9 5269 1 1 19 ASN CA C 0.911 4.719 10.334 1.00 . A A . 19 ASN CA 1 1 9 5270 1 1 19 ASN CB C 1.275 5.769 11.378 1.00 . A A . 19 ASN CB 1 1 9 5271 1 1 19 ASN CG C 2.784 5.751 11.602 1.00 . A A . 19 ASN CG 1 1 9 5272 1 1 19 ASN H H -0.224 5.381 8.695 1.00 . A A . 19 ASN H 1 1 9 5273 1 1 19 ASN HA H 1.648 4.836 9.554 1.00 . A A . 19 ASN HA 1 1 9 5274 1 1 19 ASN HB2 H 1.000 6.742 10.984 1.00 . A A . 19 ASN HB2 1 1 9 5275 1 1 19 ASN HB3 H 0.731 5.589 12.303 1.00 . A A . 19 ASN HB3 1 1 9 5276 1 1 19 ASN HD21 H 2.680 5.462 13.638 1.00 . A A . 19 ASN HD21 1 1 9 5277 1 1 19 ASN HD22 H 4.271 5.524 12.943 1.00 . A A . 19 ASN HD22 1 1 9 5278 1 1 19 ASN N N -0.322 5.010 9.626 1.00 . A A . 19 ASN N 1 1 9 5279 1 1 19 ASN ND2 N 3.262 5.553 12.814 1.00 . A A . 19 ASN ND2 1 1 9 5280 1 1 19 ASN O O 1.100 2.981 11.990 1.00 . A A . 19 ASN O 1 1 9 5281 1 1 19 ASN OD1 O 3.543 5.913 10.644 1.00 . A A . 19 ASN OD1 1 1 9 5282 1 1 20 GLY C C 0.700 -0.024 10.520 1.00 . A A . 20 GLY C 1 1 9 5283 1 1 20 GLY CA C 1.704 1.021 10.028 1.00 . A A . 20 GLY CA 1 1 9 5284 1 1 20 GLY H H 0.993 2.643 8.877 1.00 . A A . 20 GLY H 1 1 9 5285 1 1 20 GLY HA2 H 2.549 1.092 10.714 1.00 . A A . 20 GLY HA2 1 1 9 5286 1 1 20 GLY HA3 H 2.100 0.680 9.074 1.00 . A A . 20 GLY HA3 1 1 9 5287 1 1 20 GLY N N 1.134 2.349 9.834 1.00 . A A . 20 GLY N 1 1 9 5288 1 1 20 GLY O O 1.057 -1.203 10.632 1.00 . A A . 20 GLY O 1 1 9 5289 1 1 21 THR C C -2.801 -0.591 10.236 1.00 . A A . 21 THR C 1 1 9 5290 1 1 21 THR CA C -1.630 -0.475 11.237 1.00 . A A . 21 THR CA 1 1 9 5291 1 1 21 THR CB C -1.945 0.013 12.666 1.00 . A A . 21 THR CB 1 1 9 5292 1 1 21 THR CG2 C -3.414 0.071 13.072 1.00 . A A . 21 THR CG2 1 1 9 5293 1 1 21 THR H H -0.769 1.356 10.687 1.00 . A A . 21 THR H 1 1 9 5294 1 1 21 THR HA H -1.256 -1.480 11.353 1.00 . A A . 21 THR HA 1 1 9 5295 1 1 21 THR HB H -1.557 1.020 12.755 1.00 . A A . 21 THR HB 1 1 9 5296 1 1 21 THR HG1 H -0.553 -0.247 14.027 1.00 . A A . 21 THR HG1 1 1 9 5297 1 1 21 THR HG21 H -3.938 0.739 12.389 1.00 . A A . 21 THR HG21 1 1 9 5298 1 1 21 THR HG22 H -3.858 -0.923 13.028 1.00 . A A . 21 THR HG22 1 1 9 5299 1 1 21 THR HG23 H -3.500 0.459 14.087 1.00 . A A . 21 THR HG23 1 1 9 5300 1 1 21 THR N N -0.558 0.370 10.732 1.00 . A A . 21 THR N 1 1 9 5301 1 1 21 THR O O -3.689 -1.418 10.439 1.00 . A A . 21 THR O 1 1 9 5302 1 1 21 THR OG1 O -1.243 -0.792 13.594 1.00 . A A . 21 THR OG1 1 1 9 5303 1 1 22 GLY C C -3.728 -1.137 7.196 1.00 . A A . 22 GLY C 1 1 9 5304 1 1 22 GLY CA C -3.834 0.102 8.100 1.00 . A A . 22 GLY CA 1 1 9 5305 1 1 22 GLY H H -2.007 0.768 8.926 1.00 . A A . 22 GLY H 1 1 9 5306 1 1 22 GLY HA2 H -3.772 0.999 7.496 1.00 . A A . 22 GLY HA2 1 1 9 5307 1 1 22 GLY HA3 H -4.810 0.086 8.583 1.00 . A A . 22 GLY HA3 1 1 9 5308 1 1 22 GLY N N -2.792 0.163 9.127 1.00 . A A . 22 GLY N 1 1 9 5309 1 1 22 GLY O O -2.914 -2.023 7.473 1.00 . A A . 22 GLY O 1 1 9 5310 1 1 23 PRO C C -3.293 -2.518 4.442 1.00 . A A . 23 PRO C 1 1 9 5311 1 1 23 PRO CA C -4.583 -2.411 5.264 1.00 . A A . 23 PRO CA 1 1 9 5312 1 1 23 PRO CB C -5.845 -2.259 4.404 1.00 . A A . 23 PRO CB 1 1 9 5313 1 1 23 PRO CD C -5.378 -0.173 5.570 1.00 . A A . 23 PRO CD 1 1 9 5314 1 1 23 PRO CG C -6.145 -0.760 4.387 1.00 . A A . 23 PRO CG 1 1 9 5315 1 1 23 PRO HA H -4.673 -3.307 5.880 1.00 . A A . 23 PRO HA 1 1 9 5316 1 1 23 PRO HB2 H -5.700 -2.639 3.391 1.00 . A A . 23 PRO HB2 1 1 9 5317 1 1 23 PRO HB3 H -6.667 -2.785 4.892 1.00 . A A . 23 PRO HB3 1 1 9 5318 1 1 23 PRO HD2 H -4.741 0.599 5.164 1.00 . A A . 23 PRO HD2 1 1 9 5319 1 1 23 PRO HD3 H -6.045 0.269 6.308 1.00 . A A . 23 PRO HD3 1 1 9 5320 1 1 23 PRO HG2 H -5.756 -0.309 3.473 1.00 . A A . 23 PRO HG2 1 1 9 5321 1 1 23 PRO HG3 H -7.218 -0.575 4.475 1.00 . A A . 23 PRO HG3 1 1 9 5322 1 1 23 PRO N N -4.545 -1.235 6.125 1.00 . A A . 23 PRO N 1 1 9 5323 1 1 23 PRO O O -2.568 -3.512 4.551 1.00 . A A . 23 PRO O 1 1 9 5324 1 1 24 CYS C C -0.675 -0.817 3.969 1.00 . A A . 24 CYS C 1 1 9 5325 1 1 24 CYS CA C -1.688 -1.374 2.964 1.00 . A A . 24 CYS CA 1 1 9 5326 1 1 24 CYS CB C -1.815 -0.529 1.679 1.00 . A A . 24 CYS CB 1 1 9 5327 1 1 24 CYS H H -3.578 -0.686 3.624 1.00 . A A . 24 CYS H 1 1 9 5328 1 1 24 CYS HA H -1.365 -2.373 2.669 1.00 . A A . 24 CYS HA 1 1 9 5329 1 1 24 CYS HB2 H -2.862 -0.349 1.458 1.00 . A A . 24 CYS HB2 1 1 9 5330 1 1 24 CYS HB3 H -1.337 0.445 1.790 1.00 . A A . 24 CYS HB3 1 1 9 5331 1 1 24 CYS N N -2.972 -1.494 3.642 1.00 . A A . 24 CYS N 1 1 9 5332 1 1 24 CYS O O -0.309 0.355 3.908 1.00 . A A . 24 CYS O 1 1 9 5333 1 1 24 CYS SG S -1.096 -1.296 0.216 1.00 . A A . 24 CYS SG 1 1 9 5334 1 1 25 ALA C C 1.979 -2.182 5.850 1.00 . A A . 25 ALA C 1 1 9 5335 1 1 25 ALA CA C 0.767 -1.270 5.913 1.00 . A A . 25 ALA CA 1 1 9 5336 1 1 25 ALA CB C 0.174 -1.224 7.316 1.00 . A A . 25 ALA CB 1 1 9 5337 1 1 25 ALA H H -0.686 -2.556 4.972 1.00 . A A . 25 ALA H 1 1 9 5338 1 1 25 ALA HA H 1.122 -0.272 5.687 1.00 . A A . 25 ALA HA 1 1 9 5339 1 1 25 ALA HB1 H 0.983 -0.983 8.000 1.00 . A A . 25 ALA HB1 1 1 9 5340 1 1 25 ALA HB2 H -0.252 -2.191 7.585 1.00 . A A . 25 ALA HB2 1 1 9 5341 1 1 25 ALA HB3 H -0.591 -0.450 7.367 1.00 . A A . 25 ALA HB3 1 1 9 5342 1 1 25 ALA N N -0.241 -1.646 4.924 1.00 . A A . 25 ALA N 1 1 9 5343 1 1 25 ALA O O 3.105 -1.719 5.695 1.00 . A A . 25 ALA O 1 1 9 5344 1 1 26 ASN C C 3.461 -4.382 4.357 1.00 . A A . 26 ASN C 1 1 9 5345 1 1 26 ASN CA C 2.833 -4.468 5.758 1.00 . A A . 26 ASN CA 1 1 9 5346 1 1 26 ASN CB C 2.299 -5.870 6.052 1.00 . A A . 26 ASN CB 1 1 9 5347 1 1 26 ASN CG C 1.085 -6.202 5.201 1.00 . A A . 26 ASN CG 1 1 9 5348 1 1 26 ASN H H 0.817 -3.825 6.062 1.00 . A A . 26 ASN H 1 1 9 5349 1 1 26 ASN HA H 3.625 -4.245 6.477 1.00 . A A . 26 ASN HA 1 1 9 5350 1 1 26 ASN HB2 H 3.083 -6.597 5.845 1.00 . A A . 26 ASN HB2 1 1 9 5351 1 1 26 ASN HB3 H 2.056 -5.946 7.113 1.00 . A A . 26 ASN HB3 1 1 9 5352 1 1 26 ASN HD21 H -0.202 -5.846 6.743 1.00 . A A . 26 ASN HD21 1 1 9 5353 1 1 26 ASN HD22 H -0.946 -6.271 5.215 1.00 . A A . 26 ASN HD22 1 1 9 5354 1 1 26 ASN N N 1.761 -3.491 5.932 1.00 . A A . 26 ASN N 1 1 9 5355 1 1 26 ASN ND2 N -0.107 -6.061 5.761 1.00 . A A . 26 ASN ND2 1 1 9 5356 1 1 26 ASN O O 4.644 -4.689 4.224 1.00 . A A . 26 ASN O 1 1 9 5357 1 1 26 ASN OD1 O 1.210 -6.554 4.033 1.00 . A A . 26 ASN OD1 1 1 9 5358 1 1 27 CYS C C 4.317 -2.437 2.057 1.00 . A A . 27 CYS C 1 1 9 5359 1 1 27 CYS CA C 3.271 -3.558 2.031 1.00 . A A . 27 CYS CA 1 1 9 5360 1 1 27 CYS CB C 2.164 -3.313 0.992 1.00 . A A . 27 CYS CB 1 1 9 5361 1 1 27 CYS H H 1.751 -3.709 3.513 1.00 . A A . 27 CYS H 1 1 9 5362 1 1 27 CYS HA H 3.778 -4.437 1.634 1.00 . A A . 27 CYS HA 1 1 9 5363 1 1 27 CYS HB2 H 1.566 -2.416 1.181 1.00 . A A . 27 CYS HB2 1 1 9 5364 1 1 27 CYS HB3 H 2.664 -3.130 0.042 1.00 . A A . 27 CYS HB3 1 1 9 5365 1 1 27 CYS N N 2.729 -3.878 3.351 1.00 . A A . 27 CYS N 1 1 9 5366 1 1 27 CYS O O 4.800 -2.111 0.986 1.00 . A A . 27 CYS O 1 1 9 5367 1 1 27 CYS SG S 1.159 -4.814 0.794 1.00 . A A . 27 CYS SG 1 1 9 5368 1 1 28 LEU C C 7.030 -1.278 3.726 1.00 . A A . 28 LEU C 1 1 9 5369 1 1 28 LEU CA C 5.695 -0.759 3.225 1.00 . A A . 28 LEU CA 1 1 9 5370 1 1 28 LEU CB C 5.215 0.377 4.131 1.00 . A A . 28 LEU CB 1 1 9 5371 1 1 28 LEU CD1 C 4.627 2.119 2.383 1.00 . A A . 28 LEU CD1 1 1 9 5372 1 1 28 LEU CD2 C 2.897 0.480 2.993 1.00 . A A . 28 LEU CD2 1 1 9 5373 1 1 28 LEU CG C 4.112 1.236 3.513 1.00 . A A . 28 LEU CG 1 1 9 5374 1 1 28 LEU H H 4.104 -1.830 4.023 1.00 . A A . 28 LEU H 1 1 9 5375 1 1 28 LEU HA H 5.855 -0.364 2.225 1.00 . A A . 28 LEU HA 1 1 9 5376 1 1 28 LEU HB2 H 4.855 -0.027 5.080 1.00 . A A . 28 LEU HB2 1 1 9 5377 1 1 28 LEU HB3 H 6.062 1.027 4.362 1.00 . A A . 28 LEU HB3 1 1 9 5378 1 1 28 LEU HD11 H 5.607 2.519 2.637 1.00 . A A . 28 LEU HD11 1 1 9 5379 1 1 28 LEU HD12 H 4.696 1.511 1.483 1.00 . A A . 28 LEU HD12 1 1 9 5380 1 1 28 LEU HD13 H 3.938 2.945 2.212 1.00 . A A . 28 LEU HD13 1 1 9 5381 1 1 28 LEU HD21 H 2.590 -0.266 3.715 1.00 . A A . 28 LEU HD21 1 1 9 5382 1 1 28 LEU HD22 H 2.072 1.173 2.878 1.00 . A A . 28 LEU HD22 1 1 9 5383 1 1 28 LEU HD23 H 3.138 0.015 2.031 1.00 . A A . 28 LEU HD23 1 1 9 5384 1 1 28 LEU HG H 3.770 1.849 4.318 1.00 . A A . 28 LEU HG 1 1 9 5385 1 1 28 LEU N N 4.682 -1.808 3.189 1.00 . A A . 28 LEU N 1 1 9 5386 1 1 28 LEU O O 8.024 -1.199 3.009 1.00 . A A . 28 LEU O 1 1 9 5387 1 1 29 ALA C C 8.867 -3.396 4.969 1.00 . A A . 29 ALA C 1 1 9 5388 1 1 29 ALA CA C 8.321 -2.129 5.618 1.00 . A A . 29 ALA CA 1 1 9 5389 1 1 29 ALA CB C 8.075 -2.320 7.111 1.00 . A A . 29 ALA CB 1 1 9 5390 1 1 29 ALA H H 6.225 -1.763 5.516 1.00 . A A . 29 ALA H 1 1 9 5391 1 1 29 ALA HA H 9.055 -1.335 5.489 1.00 . A A . 29 ALA HA 1 1 9 5392 1 1 29 ALA HB1 H 8.967 -2.752 7.565 1.00 . A A . 29 ALA HB1 1 1 9 5393 1 1 29 ALA HB2 H 7.894 -1.354 7.572 1.00 . A A . 29 ALA HB2 1 1 9 5394 1 1 29 ALA HB3 H 7.211 -2.968 7.276 1.00 . A A . 29 ALA HB3 1 1 9 5395 1 1 29 ALA N N 7.078 -1.733 4.978 1.00 . A A . 29 ALA N 1 1 9 5396 1 1 29 ALA O O 9.924 -3.384 4.331 1.00 . A A . 29 ALA O 1 1 9 5397 1 1 30 GLY C C 7.845 -5.796 3.120 1.00 . A A . 30 GLY C 1 1 9 5398 1 1 30 GLY CA C 8.436 -5.766 4.515 1.00 . A A . 30 GLY CA 1 1 9 5399 1 1 30 GLY H H 7.274 -4.446 5.666 1.00 . A A . 30 GLY H 1 1 9 5400 1 1 30 GLY HA2 H 8.033 -6.579 5.114 1.00 . A A . 30 GLY HA2 1 1 9 5401 1 1 30 GLY HA3 H 9.508 -5.894 4.464 1.00 . A A . 30 GLY HA3 1 1 9 5402 1 1 30 GLY N N 8.129 -4.494 5.126 1.00 . A A . 30 GLY N 1 1 9 5403 1 1 30 GLY O O 6.856 -6.498 2.885 1.00 . A A . 30 GLY O 1 1 9 5404 1 1 31 TYR C C 8.927 -5.300 -0.233 1.00 . A A . 31 TYR C 1 1 9 5405 1 1 31 TYR CA C 7.896 -4.953 0.850 1.00 . A A . 31 TYR CA 1 1 9 5406 1 1 31 TYR CB C 7.344 -3.521 0.735 1.00 . A A . 31 TYR CB 1 1 9 5407 1 1 31 TYR CD1 C 9.607 -2.437 0.211 1.00 . A A . 31 TYR CD1 1 1 9 5408 1 1 31 TYR CD2 C 7.554 -1.522 -0.717 1.00 . A A . 31 TYR CD2 1 1 9 5409 1 1 31 TYR CE1 C 10.343 -1.531 -0.576 1.00 . A A . 31 TYR CE1 1 1 9 5410 1 1 31 TYR CE2 C 8.273 -0.630 -1.520 1.00 . A A . 31 TYR CE2 1 1 9 5411 1 1 31 TYR CG C 8.205 -2.457 0.092 1.00 . A A . 31 TYR CG 1 1 9 5412 1 1 31 TYR CZ C 9.686 -0.656 -1.477 1.00 . A A . 31 TYR CZ 1 1 9 5413 1 1 31 TYR H H 9.268 -4.514 2.410 1.00 . A A . 31 TYR H 1 1 9 5414 1 1 31 TYR HA H 7.056 -5.614 0.718 1.00 . A A . 31 TYR HA 1 1 9 5415 1 1 31 TYR HB2 H 6.475 -3.629 0.094 1.00 . A A . 31 TYR HB2 1 1 9 5416 1 1 31 TYR HB3 H 6.978 -3.125 1.685 1.00 . A A . 31 TYR HB3 1 1 9 5417 1 1 31 TYR HD1 H 10.106 -3.226 0.772 1.00 . A A . 31 TYR HD1 1 1 9 5418 1 1 31 TYR HD2 H 6.484 -1.569 -0.750 1.00 . A A . 31 TYR HD2 1 1 9 5419 1 1 31 TYR HE1 H 11.416 -1.546 -0.520 1.00 . A A . 31 TYR HE1 1 1 9 5420 1 1 31 TYR HE2 H 7.734 0.083 -2.139 1.00 . A A . 31 TYR HE2 1 1 9 5421 1 1 31 TYR HH H 11.235 0.443 -2.070 1.00 . A A . 31 TYR HH 1 1 9 5422 1 1 31 TYR N N 8.430 -5.033 2.194 1.00 . A A . 31 TYR N 1 1 9 5423 1 1 31 TYR O O 8.906 -4.701 -1.306 1.00 . A A . 31 TYR O 1 1 9 5424 1 1 31 TYR OH O 10.382 0.079 -2.382 1.00 . A A . 31 TYR OH 1 1 9 5425 1 1 32 PRO C C 9.835 -7.106 -2.474 1.00 . A A . 32 PRO C 1 1 9 5426 1 1 32 PRO CA C 10.613 -6.706 -1.215 1.00 . A A . 32 PRO CA 1 1 9 5427 1 1 32 PRO CB C 11.530 -7.795 -0.670 1.00 . A A . 32 PRO CB 1 1 9 5428 1 1 32 PRO CD C 9.714 -7.392 0.907 1.00 . A A . 32 PRO CD 1 1 9 5429 1 1 32 PRO CG C 10.742 -8.429 0.478 1.00 . A A . 32 PRO CG 1 1 9 5430 1 1 32 PRO HA H 11.190 -5.796 -1.395 1.00 . A A . 32 PRO HA 1 1 9 5431 1 1 32 PRO HB2 H 11.795 -8.524 -1.436 1.00 . A A . 32 PRO HB2 1 1 9 5432 1 1 32 PRO HB3 H 12.433 -7.329 -0.271 1.00 . A A . 32 PRO HB3 1 1 9 5433 1 1 32 PRO HD2 H 8.738 -7.849 1.076 1.00 . A A . 32 PRO HD2 1 1 9 5434 1 1 32 PRO HD3 H 10.064 -6.909 1.815 1.00 . A A . 32 PRO HD3 1 1 9 5435 1 1 32 PRO HG2 H 10.245 -9.338 0.140 1.00 . A A . 32 PRO HG2 1 1 9 5436 1 1 32 PRO HG3 H 11.399 -8.617 1.318 1.00 . A A . 32 PRO HG3 1 1 9 5437 1 1 32 PRO N N 9.658 -6.418 -0.159 1.00 . A A . 32 PRO N 1 1 9 5438 1 1 32 PRO O O 10.071 -6.582 -3.563 1.00 . A A . 32 PRO O 1 1 9 5439 1 1 33 ALA C C 6.665 -7.436 -3.456 1.00 . A A . 33 ALA C 1 1 9 5440 1 1 33 ALA CA C 7.859 -8.385 -3.274 1.00 . A A . 33 ALA CA 1 1 9 5441 1 1 33 ALA CB C 7.347 -9.761 -2.850 1.00 . A A . 33 ALA CB 1 1 9 5442 1 1 33 ALA H H 8.671 -8.252 -1.324 1.00 . A A . 33 ALA H 1 1 9 5443 1 1 33 ALA HA H 8.372 -8.467 -4.230 1.00 . A A . 33 ALA HA 1 1 9 5444 1 1 33 ALA HB1 H 6.654 -10.134 -3.600 1.00 . A A . 33 ALA HB1 1 1 9 5445 1 1 33 ALA HB2 H 8.179 -10.457 -2.743 1.00 . A A . 33 ALA HB2 1 1 9 5446 1 1 33 ALA HB3 H 6.813 -9.661 -1.907 1.00 . A A . 33 ALA HB3 1 1 9 5447 1 1 33 ALA N N 8.813 -7.940 -2.274 1.00 . A A . 33 ALA N 1 1 9 5448 1 1 33 ALA O O 5.757 -7.765 -4.216 1.00 . A A . 33 ALA O 1 1 9 5449 1 1 34 GLY C C 5.031 -4.977 -4.164 1.00 . A A . 34 GLY C 1 1 9 5450 1 1 34 GLY CA C 5.408 -5.450 -2.755 1.00 . A A . 34 GLY CA 1 1 9 5451 1 1 34 GLY H H 7.411 -6.003 -2.235 1.00 . A A . 34 GLY H 1 1 9 5452 1 1 34 GLY HA2 H 5.567 -4.587 -2.117 1.00 . A A . 34 GLY HA2 1 1 9 5453 1 1 34 GLY HA3 H 4.573 -6.014 -2.339 1.00 . A A . 34 GLY HA3 1 1 9 5454 1 1 34 GLY N N 6.596 -6.306 -2.746 1.00 . A A . 34 GLY N 1 1 9 5455 1 1 34 GLY O O 3.857 -5.027 -4.523 1.00 . A A . 34 GLY O 1 1 9 5456 1 1 35 CYS C C 5.320 -5.364 -7.257 1.00 . A A . 35 CYS C 1 1 9 5457 1 1 35 CYS CA C 5.889 -4.240 -6.386 1.00 . A A . 35 CYS CA 1 1 9 5458 1 1 35 CYS CB C 7.279 -3.910 -6.937 1.00 . A A . 35 CYS CB 1 1 9 5459 1 1 35 CYS H H 6.926 -4.442 -4.543 1.00 . A A . 35 CYS H 1 1 9 5460 1 1 35 CYS HA H 5.240 -3.366 -6.456 1.00 . A A . 35 CYS HA 1 1 9 5461 1 1 35 CYS HB2 H 7.853 -4.839 -6.943 1.00 . A A . 35 CYS HB2 1 1 9 5462 1 1 35 CYS HB3 H 7.174 -3.597 -7.978 1.00 . A A . 35 CYS HB3 1 1 9 5463 1 1 35 CYS N N 6.024 -4.607 -4.976 1.00 . A A . 35 CYS N 1 1 9 5464 1 1 35 CYS O O 4.888 -5.120 -8.382 1.00 . A A . 35 CYS O 1 1 9 5465 1 1 35 CYS SG S 8.169 -2.617 -6.026 1.00 . A A . 35 CYS SG 1 1 9 5466 1 1 36 SER C C 3.462 -8.154 -6.893 1.00 . A A . 36 SER C 1 1 9 5467 1 1 36 SER CA C 4.841 -7.780 -7.451 1.00 . A A . 36 SER CA 1 1 9 5468 1 1 36 SER CB C 5.844 -8.915 -7.256 1.00 . A A . 36 SER CB 1 1 9 5469 1 1 36 SER H H 5.726 -6.754 -5.845 1.00 . A A . 36 SER H 1 1 9 5470 1 1 36 SER HA H 4.780 -7.553 -8.512 1.00 . A A . 36 SER HA 1 1 9 5471 1 1 36 SER HB2 H 6.843 -8.530 -7.448 1.00 . A A . 36 SER HB2 1 1 9 5472 1 1 36 SER HB3 H 5.806 -9.268 -6.228 1.00 . A A . 36 SER HB3 1 1 9 5473 1 1 36 SER HG H 6.378 -10.593 -8.048 1.00 . A A . 36 SER HG 1 1 9 5474 1 1 36 SER N N 5.365 -6.607 -6.777 1.00 . A A . 36 SER N 1 1 9 5475 1 1 36 SER O O 2.659 -8.800 -7.568 1.00 . A A . 36 SER O 1 1 9 5476 1 1 36 SER OG O 5.600 -10.001 -8.122 1.00 . A A . 36 SER OG 1 1 9 5477 1 1 37 ASN C C 0.906 -6.957 -5.680 1.00 . A A . 37 ASN C 1 1 9 5478 1 1 37 ASN CA C 1.866 -7.937 -5.025 1.00 . A A . 37 ASN CA 1 1 9 5479 1 1 37 ASN CB C 1.963 -7.698 -3.496 1.00 . A A . 37 ASN CB 1 1 9 5480 1 1 37 ASN CG C 1.625 -8.962 -2.729 1.00 . A A . 37 ASN CG 1 1 9 5481 1 1 37 ASN H H 3.819 -7.117 -5.205 1.00 . A A . 37 ASN H 1 1 9 5482 1 1 37 ASN HA H 1.543 -8.961 -5.216 1.00 . A A . 37 ASN HA 1 1 9 5483 1 1 37 ASN HB2 H 2.967 -7.365 -3.220 1.00 . A A . 37 ASN HB2 1 1 9 5484 1 1 37 ASN HB3 H 1.275 -6.916 -3.181 1.00 . A A . 37 ASN HB3 1 1 9 5485 1 1 37 ASN HD21 H -0.168 -8.249 -2.030 1.00 . A A . 37 ASN HD21 1 1 9 5486 1 1 37 ASN HD22 H 0.213 -9.895 -1.634 1.00 . A A . 37 ASN HD22 1 1 9 5487 1 1 37 ASN N N 3.143 -7.703 -5.676 1.00 . A A . 37 ASN N 1 1 9 5488 1 1 37 ASN ND2 N 0.477 -9.021 -2.075 1.00 . A A . 37 ASN ND2 1 1 9 5489 1 1 37 ASN O O 0.856 -5.796 -5.284 1.00 . A A . 37 ASN O 1 1 9 5490 1 1 37 ASN OD1 O 2.412 -9.903 -2.726 1.00 . A A . 37 ASN OD1 1 1 9 5491 1 1 38 SER C C -1.667 -5.737 -6.674 1.00 . A A . 38 SER C 1 1 9 5492 1 1 38 SER CA C -0.674 -6.530 -7.542 1.00 . A A . 38 SER CA 1 1 9 5493 1 1 38 SER CB C -1.401 -7.420 -8.558 1.00 . A A . 38 SER CB 1 1 9 5494 1 1 38 SER H H 0.247 -8.358 -6.955 1.00 . A A . 38 SER H 1 1 9 5495 1 1 38 SER HA H -0.040 -5.821 -8.097 1.00 . A A . 38 SER HA 1 1 9 5496 1 1 38 SER HB2 H -0.769 -8.270 -8.811 1.00 . A A . 38 SER HB2 1 1 9 5497 1 1 38 SER HB3 H -2.331 -7.794 -8.126 1.00 . A A . 38 SER HB3 1 1 9 5498 1 1 38 SER HG H -1.080 -7.102 -10.441 1.00 . A A . 38 SER HG 1 1 9 5499 1 1 38 SER N N 0.187 -7.377 -6.722 1.00 . A A . 38 SER N 1 1 9 5500 1 1 38 SER O O -1.970 -4.594 -7.014 1.00 . A A . 38 SER O 1 1 9 5501 1 1 38 SER OG O -1.670 -6.715 -9.755 1.00 . A A . 38 SER OG 1 1 9 5502 1 1 39 ASP C C -2.318 -4.323 -4.009 1.00 . A A . 39 ASP C 1 1 9 5503 1 1 39 ASP CA C -2.994 -5.559 -4.603 1.00 . A A . 39 ASP CA 1 1 9 5504 1 1 39 ASP CB C -3.469 -6.478 -3.464 1.00 . A A . 39 ASP CB 1 1 9 5505 1 1 39 ASP CG C -4.359 -5.737 -2.456 1.00 . A A . 39 ASP CG 1 1 9 5506 1 1 39 ASP H H -1.816 -7.221 -5.298 1.00 . A A . 39 ASP H 1 1 9 5507 1 1 39 ASP HA H -3.869 -5.217 -5.150 1.00 . A A . 39 ASP HA 1 1 9 5508 1 1 39 ASP HB2 H -4.029 -7.315 -3.880 1.00 . A A . 39 ASP HB2 1 1 9 5509 1 1 39 ASP HB3 H -2.596 -6.892 -2.946 1.00 . A A . 39 ASP HB3 1 1 9 5510 1 1 39 ASP N N -2.120 -6.285 -5.538 1.00 . A A . 39 ASP N 1 1 9 5511 1 1 39 ASP O O -2.965 -3.301 -3.816 1.00 . A A . 39 ASP O 1 1 9 5512 1 1 39 ASP OD1 O -5.397 -5.178 -2.860 1.00 . A A . 39 ASP OD1 1 1 9 5513 1 1 39 ASP OD2 O -4.092 -5.816 -1.239 1.00 . A A . 39 ASP OD2 1 1 9 5514 1 1 40 CYS C C 0.582 -2.544 -4.204 1.00 . A A . 40 CYS C 1 1 9 5515 1 1 40 CYS CA C -0.208 -3.326 -3.161 1.00 . A A . 40 CYS CA 1 1 9 5516 1 1 40 CYS CB C 0.717 -3.937 -2.095 1.00 . A A . 40 CYS CB 1 1 9 5517 1 1 40 CYS H H -0.495 -5.164 -4.161 1.00 . A A . 40 CYS H 1 1 9 5518 1 1 40 CYS HA H -0.864 -2.618 -2.667 1.00 . A A . 40 CYS HA 1 1 9 5519 1 1 40 CYS HB2 H 1.234 -4.802 -2.503 1.00 . A A . 40 CYS HB2 1 1 9 5520 1 1 40 CYS HB3 H 1.486 -3.215 -1.804 1.00 . A A . 40 CYS HB3 1 1 9 5521 1 1 40 CYS N N -1.011 -4.386 -3.763 1.00 . A A . 40 CYS N 1 1 9 5522 1 1 40 CYS O O 1.118 -1.490 -3.888 1.00 . A A . 40 CYS O 1 1 9 5523 1 1 40 CYS SG S -0.228 -4.389 -0.616 1.00 . A A . 40 CYS SG 1 1 9 5524 1 1 41 THR C C 1.193 -1.047 -6.764 1.00 . A A . 41 THR C 1 1 9 5525 1 1 41 THR CA C 1.515 -2.508 -6.472 1.00 . A A . 41 THR CA 1 1 9 5526 1 1 41 THR CB C 1.349 -3.416 -7.694 1.00 . A A . 41 THR CB 1 1 9 5527 1 1 41 THR CG2 C 1.878 -2.895 -9.019 1.00 . A A . 41 THR CG2 1 1 9 5528 1 1 41 THR H H 0.179 -3.900 -5.637 1.00 . A A . 41 THR H 1 1 9 5529 1 1 41 THR HA H 2.544 -2.560 -6.101 1.00 . A A . 41 THR HA 1 1 9 5530 1 1 41 THR HB H 0.286 -3.606 -7.840 1.00 . A A . 41 THR HB 1 1 9 5531 1 1 41 THR HG1 H 1.826 -4.904 -6.528 1.00 . A A . 41 THR HG1 1 1 9 5532 1 1 41 THR HG21 H 1.445 -1.921 -9.264 1.00 . A A . 41 THR HG21 1 1 9 5533 1 1 41 THR HG22 H 2.960 -2.795 -8.978 1.00 . A A . 41 THR HG22 1 1 9 5534 1 1 41 THR HG23 H 1.581 -3.630 -9.767 1.00 . A A . 41 THR HG23 1 1 9 5535 1 1 41 THR N N 0.649 -3.028 -5.439 1.00 . A A . 41 THR N 1 1 9 5536 1 1 41 THR O O 2.101 -0.228 -6.694 1.00 . A A . 41 THR O 1 1 9 5537 1 1 41 THR OG1 O 2.005 -4.641 -7.445 1.00 . A A . 41 THR OG1 1 1 9 5538 1 1 42 ALA C C -0.355 1.635 -6.287 1.00 . A A . 42 ALA C 1 1 9 5539 1 1 42 ALA CA C -0.384 0.673 -7.479 1.00 . A A . 42 ALA CA 1 1 9 5540 1 1 42 ALA CB C -1.729 0.741 -8.193 1.00 . A A . 42 ALA CB 1 1 9 5541 1 1 42 ALA H H -0.805 -1.375 -6.995 1.00 . A A . 42 ALA H 1 1 9 5542 1 1 42 ALA HA H 0.364 1.005 -8.194 1.00 . A A . 42 ALA HA 1 1 9 5543 1 1 42 ALA HB1 H -1.694 0.161 -9.115 1.00 . A A . 42 ALA HB1 1 1 9 5544 1 1 42 ALA HB2 H -1.956 1.780 -8.430 1.00 . A A . 42 ALA HB2 1 1 9 5545 1 1 42 ALA HB3 H -2.500 0.357 -7.543 1.00 . A A . 42 ALA HB3 1 1 9 5546 1 1 42 ALA N N -0.059 -0.698 -7.082 1.00 . A A . 42 ALA N 1 1 9 5547 1 1 42 ALA O O -0.071 2.819 -6.472 1.00 . A A . 42 ALA O 1 1 9 5548 1 1 43 PHE C C 1.209 2.221 -3.863 1.00 . A A . 43 PHE C 1 1 9 5549 1 1 43 PHE CA C -0.284 1.897 -3.860 1.00 . A A . 43 PHE CA 1 1 9 5550 1 1 43 PHE CB C -0.749 1.141 -2.596 1.00 . A A . 43 PHE CB 1 1 9 5551 1 1 43 PHE CD1 C 0.956 1.483 -0.787 1.00 . A A . 43 PHE CD1 1 1 9 5552 1 1 43 PHE CD2 C -1.250 2.404 -0.424 1.00 . A A . 43 PHE CD2 1 1 9 5553 1 1 43 PHE CE1 C 1.380 1.992 0.444 1.00 . A A . 43 PHE CE1 1 1 9 5554 1 1 43 PHE CE2 C -0.841 2.892 0.830 1.00 . A A . 43 PHE CE2 1 1 9 5555 1 1 43 PHE CG C -0.342 1.724 -1.255 1.00 . A A . 43 PHE CG 1 1 9 5556 1 1 43 PHE CZ C 0.485 2.700 1.256 1.00 . A A . 43 PHE CZ 1 1 9 5557 1 1 43 PHE H H -0.836 0.156 -4.991 1.00 . A A . 43 PHE H 1 1 9 5558 1 1 43 PHE HA H -0.822 2.840 -3.940 1.00 . A A . 43 PHE HA 1 1 9 5559 1 1 43 PHE HB2 H -1.833 1.050 -2.635 1.00 . A A . 43 PHE HB2 1 1 9 5560 1 1 43 PHE HB3 H -0.328 0.138 -2.597 1.00 . A A . 43 PHE HB3 1 1 9 5561 1 1 43 PHE HD1 H 1.631 0.898 -1.375 1.00 . A A . 43 PHE HD1 1 1 9 5562 1 1 43 PHE HD2 H -2.272 2.534 -0.730 1.00 . A A . 43 PHE HD2 1 1 9 5563 1 1 43 PHE HE1 H 2.399 1.850 0.747 1.00 . A A . 43 PHE HE1 1 1 9 5564 1 1 43 PHE HE2 H -1.545 3.422 1.455 1.00 . A A . 43 PHE HE2 1 1 9 5565 1 1 43 PHE HZ H 0.835 3.082 2.200 1.00 . A A . 43 PHE HZ 1 1 9 5566 1 1 43 PHE N N -0.584 1.135 -5.066 1.00 . A A . 43 PHE N 1 1 9 5567 1 1 43 PHE O O 1.600 3.384 -3.903 1.00 . A A . 43 PHE O 1 1 9 5568 1 1 44 LEU C C 4.129 2.161 -4.937 1.00 . A A . 44 LEU C 1 1 9 5569 1 1 44 LEU CA C 3.511 1.408 -3.758 1.00 . A A . 44 LEU CA 1 1 9 5570 1 1 44 LEU CB C 4.198 0.057 -3.595 1.00 . A A . 44 LEU CB 1 1 9 5571 1 1 44 LEU CD1 C 4.370 -2.080 -2.376 1.00 . A A . 44 LEU CD1 1 1 9 5572 1 1 44 LEU CD2 C 4.193 0.115 -1.036 1.00 . A A . 44 LEU CD2 1 1 9 5573 1 1 44 LEU CG C 3.797 -0.667 -2.300 1.00 . A A . 44 LEU CG 1 1 9 5574 1 1 44 LEU H H 1.713 0.257 -3.726 1.00 . A A . 44 LEU H 1 1 9 5575 1 1 44 LEU HA H 3.666 2.013 -2.873 1.00 . A A . 44 LEU HA 1 1 9 5576 1 1 44 LEU HB2 H 3.937 -0.561 -4.458 1.00 . A A . 44 LEU HB2 1 1 9 5577 1 1 44 LEU HB3 H 5.274 0.210 -3.615 1.00 . A A . 44 LEU HB3 1 1 9 5578 1 1 44 LEU HD11 H 5.424 -2.055 -2.637 1.00 . A A . 44 LEU HD11 1 1 9 5579 1 1 44 LEU HD12 H 4.232 -2.601 -1.433 1.00 . A A . 44 LEU HD12 1 1 9 5580 1 1 44 LEU HD13 H 3.847 -2.625 -3.164 1.00 . A A . 44 LEU HD13 1 1 9 5581 1 1 44 LEU HD21 H 3.826 1.137 -1.048 1.00 . A A . 44 LEU HD21 1 1 9 5582 1 1 44 LEU HD22 H 3.709 -0.346 -0.180 1.00 . A A . 44 LEU HD22 1 1 9 5583 1 1 44 LEU HD23 H 5.269 0.130 -0.904 1.00 . A A . 44 LEU HD23 1 1 9 5584 1 1 44 LEU HG H 2.720 -0.785 -2.252 1.00 . A A . 44 LEU HG 1 1 9 5585 1 1 44 LEU N N 2.072 1.206 -3.858 1.00 . A A . 44 LEU N 1 1 9 5586 1 1 44 LEU O O 5.101 2.896 -4.762 1.00 . A A . 44 LEU O 1 1 9 5587 1 1 45 SER C C 3.750 4.302 -7.044 1.00 . A A . 45 SER C 1 1 9 5588 1 1 45 SER CA C 3.882 2.791 -7.312 1.00 . A A . 45 SER CA 1 1 9 5589 1 1 45 SER CB C 2.910 2.294 -8.378 1.00 . A A . 45 SER CB 1 1 9 5590 1 1 45 SER H H 2.794 1.382 -6.245 1.00 . A A . 45 SER H 1 1 9 5591 1 1 45 SER HA H 4.899 2.573 -7.629 1.00 . A A . 45 SER HA 1 1 9 5592 1 1 45 SER HB2 H 1.899 2.314 -7.985 1.00 . A A . 45 SER HB2 1 1 9 5593 1 1 45 SER HB3 H 2.934 2.942 -9.226 1.00 . A A . 45 SER HB3 1 1 9 5594 1 1 45 SER HG H 3.204 0.379 -8.099 1.00 . A A . 45 SER HG 1 1 9 5595 1 1 45 SER N N 3.553 2.038 -6.124 1.00 . A A . 45 SER N 1 1 9 5596 1 1 45 SER O O 4.488 5.099 -7.621 1.00 . A A . 45 SER O 1 1 9 5597 1 1 45 SER OG O 3.252 1.001 -8.844 1.00 . A A . 45 SER OG 1 1 9 5598 1 1 46 GLN C C 3.714 6.216 -4.354 1.00 . A A . 46 GLN C 1 1 9 5599 1 1 46 GLN CA C 2.782 6.054 -5.574 1.00 . A A . 46 GLN CA 1 1 9 5600 1 1 46 GLN CB C 1.291 6.383 -5.316 1.00 . A A . 46 GLN CB 1 1 9 5601 1 1 46 GLN CD C -0.786 7.203 -6.587 1.00 . A A . 46 GLN CD 1 1 9 5602 1 1 46 GLN CG C 0.541 6.449 -6.662 1.00 . A A . 46 GLN CG 1 1 9 5603 1 1 46 GLN H H 2.290 3.995 -5.685 1.00 . A A . 46 GLN H 1 1 9 5604 1 1 46 GLN HA H 3.145 6.756 -6.327 1.00 . A A . 46 GLN HA 1 1 9 5605 1 1 46 GLN HB2 H 0.827 5.628 -4.684 1.00 . A A . 46 GLN HB2 1 1 9 5606 1 1 46 GLN HB3 H 1.188 7.336 -4.804 1.00 . A A . 46 GLN HB3 1 1 9 5607 1 1 46 GLN HE21 H -1.882 5.497 -6.557 1.00 . A A . 46 GLN HE21 1 1 9 5608 1 1 46 GLN HE22 H -2.791 7.011 -6.482 1.00 . A A . 46 GLN HE22 1 1 9 5609 1 1 46 GLN HG2 H 1.164 6.966 -7.395 1.00 . A A . 46 GLN HG2 1 1 9 5610 1 1 46 GLN HG3 H 0.372 5.437 -7.031 1.00 . A A . 46 GLN HG3 1 1 9 5611 1 1 46 GLN N N 2.880 4.702 -6.111 1.00 . A A . 46 GLN N 1 1 9 5612 1 1 46 GLN NE2 N -1.911 6.506 -6.616 1.00 . A A . 46 GLN NE2 1 1 9 5613 1 1 46 GLN O O 4.583 7.088 -4.363 1.00 . A A . 46 GLN O 1 1 9 5614 1 1 46 GLN OE1 O -0.823 8.427 -6.606 1.00 . A A . 46 GLN OE1 1 1 9 5615 1 1 47 CYS C C 5.773 5.282 -1.987 1.00 . A A . 47 CYS C 1 1 9 5616 1 1 47 CYS CA C 4.273 5.617 -2.019 1.00 . A A . 47 CYS CA 1 1 9 5617 1 1 47 CYS CB C 3.546 4.885 -0.877 1.00 . A A . 47 CYS CB 1 1 9 5618 1 1 47 CYS H H 2.855 4.695 -3.348 1.00 . A A . 47 CYS H 1 1 9 5619 1 1 47 CYS HA H 4.179 6.684 -1.811 1.00 . A A . 47 CYS HA 1 1 9 5620 1 1 47 CYS HB2 H 3.974 3.879 -0.733 1.00 . A A . 47 CYS HB2 1 1 9 5621 1 1 47 CYS HB3 H 3.723 5.455 0.038 1.00 . A A . 47 CYS HB3 1 1 9 5622 1 1 47 CYS N N 3.605 5.380 -3.313 1.00 . A A . 47 CYS N 1 1 9 5623 1 1 47 CYS O O 6.432 5.504 -0.967 1.00 . A A . 47 CYS O 1 1 9 5624 1 1 47 CYS SG S 1.748 4.793 -1.096 1.00 . A A . 47 CYS SG 1 1 9 5625 1 1 48 TYR C C 8.189 4.894 -4.685 1.00 . A A . 48 TYR C 1 1 9 5626 1 1 48 TYR CA C 7.740 4.470 -3.287 1.00 . A A . 48 TYR CA 1 1 9 5627 1 1 48 TYR CB C 8.066 2.996 -3.073 1.00 . A A . 48 TYR CB 1 1 9 5628 1 1 48 TYR CD1 C 7.201 2.224 -0.848 1.00 . A A . 48 TYR CD1 1 1 9 5629 1 1 48 TYR CD2 C 9.573 2.702 -1.053 1.00 . A A . 48 TYR CD2 1 1 9 5630 1 1 48 TYR CE1 C 7.428 1.695 0.427 1.00 . A A . 48 TYR CE1 1 1 9 5631 1 1 48 TYR CE2 C 9.794 2.241 0.256 1.00 . A A . 48 TYR CE2 1 1 9 5632 1 1 48 TYR CG C 8.285 2.659 -1.618 1.00 . A A . 48 TYR CG 1 1 9 5633 1 1 48 TYR CZ C 8.724 1.690 0.990 1.00 . A A . 48 TYR CZ 1 1 9 5634 1 1 48 TYR H H 5.686 4.460 -3.811 1.00 . A A . 48 TYR H 1 1 9 5635 1 1 48 TYR HA H 8.336 4.999 -2.553 1.00 . A A . 48 TYR HA 1 1 9 5636 1 1 48 TYR HB2 H 7.277 2.368 -3.487 1.00 . A A . 48 TYR HB2 1 1 9 5637 1 1 48 TYR HB3 H 8.975 2.746 -3.621 1.00 . A A . 48 TYR HB3 1 1 9 5638 1 1 48 TYR HD1 H 6.212 2.195 -1.279 1.00 . A A . 48 TYR HD1 1 1 9 5639 1 1 48 TYR HD2 H 10.418 3.029 -1.640 1.00 . A A . 48 TYR HD2 1 1 9 5640 1 1 48 TYR HE1 H 6.597 1.227 0.910 1.00 . A A . 48 TYR HE1 1 1 9 5641 1 1 48 TYR HE2 H 10.796 2.228 0.663 1.00 . A A . 48 TYR HE2 1 1 9 5642 1 1 48 TYR HH H 8.609 0.239 2.283 1.00 . A A . 48 TYR HH 1 1 9 5643 1 1 48 TYR N N 6.318 4.723 -3.065 1.00 . A A . 48 TYR N 1 1 9 5644 1 1 48 TYR O O 9.387 5.061 -4.898 1.00 . A A . 48 TYR O 1 1 9 5645 1 1 48 TYR OH O 8.957 1.149 2.216 1.00 . A A . 48 TYR OH 1 1 9 5646 1 1 49 GLY C C 7.538 3.788 -7.769 1.00 . A A . 49 GLY C 1 1 9 5647 1 1 49 GLY CA C 7.573 5.141 -7.059 1.00 . A A . 49 GLY CA 1 1 9 5648 1 1 49 GLY H H 6.294 4.855 -5.415 1.00 . A A . 49 GLY H 1 1 9 5649 1 1 49 GLY HA2 H 8.572 5.552 -7.182 1.00 . A A . 49 GLY HA2 1 1 9 5650 1 1 49 GLY HA3 H 6.870 5.822 -7.535 1.00 . A A . 49 GLY HA3 1 1 9 5651 1 1 49 GLY N N 7.262 5.024 -5.638 1.00 . A A . 49 GLY N 1 1 9 5652 1 1 49 GLY O O 7.585 3.746 -8.998 1.00 . A A . 49 GLY O 1 1 9 5653 1 1 50 GLY C C 9.096 1.039 -7.553 1.00 . A A . 50 GLY C 1 1 9 5654 1 1 50 GLY CA C 7.601 1.336 -7.484 1.00 . A A . 50 GLY CA 1 1 9 5655 1 1 50 GLY H H 7.372 2.828 -6.008 1.00 . A A . 50 GLY H 1 1 9 5656 1 1 50 GLY HA2 H 7.156 1.237 -8.474 1.00 . A A . 50 GLY HA2 1 1 9 5657 1 1 50 GLY HA3 H 7.103 0.638 -6.810 1.00 . A A . 50 GLY HA3 1 1 9 5658 1 1 50 GLY N N 7.427 2.694 -7.003 1.00 . A A . 50 GLY N 1 1 9 5659 1 1 50 GLY O O 9.781 1.601 -8.406 1.00 . A A . 50 GLY O 1 1 9 5660 1 1 51 CYS C C 11.873 -0.112 -7.589 1.00 . A A . 51 CYS C 1 1 9 5661 1 1 51 CYS CA C 10.960 -0.155 -6.363 1.00 . A A . 51 CYS CA 1 1 9 5662 1 1 51 CYS CB C 11.024 -1.520 -5.665 1.00 . A A . 51 CYS CB 1 1 9 5663 1 1 51 CYS H H 8.897 -0.248 -6.026 1.00 . A A . 51 CYS H 1 1 9 5664 1 1 51 CYS HA H 11.333 0.586 -5.656 1.00 . A A . 51 CYS HA 1 1 9 5665 1 1 51 CYS HB2 H 12.080 -1.784 -5.615 1.00 . A A . 51 CYS HB2 1 1 9 5666 1 1 51 CYS HB3 H 10.665 -1.407 -4.644 1.00 . A A . 51 CYS HB3 1 1 9 5667 1 1 51 CYS N N 9.568 0.172 -6.652 1.00 . A A . 51 CYS N 1 1 9 5668 1 1 51 CYS O O 12.637 0.866 -7.721 1.00 . A A . 51 CYS O 1 1 9 5669 1 1 51 CYS OXT O 11.834 -1.053 -8.411 1.00 . A A . 51 CYS OXT 1 1 9 5670 1 1 51 CYS SG S 10.141 -2.913 -6.442 1.00 . A A . 51 CYS SG 1 1 10 5671 1 1 1 GLY C C -7.861 -5.790 -0.956 1.00 . A A . 1 GLY C 1 1 10 5672 1 1 1 GLY CA C -7.972 -6.882 -1.985 1.00 . A A . 1 GLY CA 1 1 10 5673 1 1 1 GLY H1 H -9.385 -5.809 -2.978 1.00 . A A . 1 GLY H1 1 1 10 5674 1 1 1 GLY H2 H -9.293 -7.387 -3.455 1.00 . A A . 1 GLY H2 1 1 10 5675 1 1 1 GLY H3 H -10.009 -6.968 -2.007 1.00 . A A . 1 GLY H3 1 1 10 5676 1 1 1 GLY HA2 H -7.161 -6.769 -2.701 1.00 . A A . 1 GLY HA2 1 1 10 5677 1 1 1 GLY HA3 H -7.906 -7.852 -1.508 1.00 . A A . 1 GLY HA3 1 1 10 5678 1 1 1 GLY N N -9.267 -6.761 -2.662 1.00 . A A . 1 GLY N 1 1 10 5679 1 1 1 GLY O O -8.444 -4.728 -1.148 1.00 . A A . 1 GLY O 1 1 10 5680 1 1 2 GLU C C -6.691 -3.721 0.906 1.00 . A A . 2 GLU C 1 1 10 5681 1 1 2 GLU CA C -7.159 -5.123 1.285 1.00 . A A . 2 GLU CA 1 1 10 5682 1 1 2 GLU CB C -6.369 -5.708 2.471 1.00 . A A . 2 GLU CB 1 1 10 5683 1 1 2 GLU CD C -4.365 -7.261 2.821 1.00 . A A . 2 GLU CD 1 1 10 5684 1 1 2 GLU CG C -4.897 -5.994 2.143 1.00 . A A . 2 GLU CG 1 1 10 5685 1 1 2 GLU H H -6.601 -6.874 0.198 1.00 . A A . 2 GLU H 1 1 10 5686 1 1 2 GLU HA H -8.187 -5.014 1.593 1.00 . A A . 2 GLU HA 1 1 10 5687 1 1 2 GLU HB2 H -6.403 -4.988 3.287 1.00 . A A . 2 GLU HB2 1 1 10 5688 1 1 2 GLU HB3 H -6.860 -6.632 2.789 1.00 . A A . 2 GLU HB3 1 1 10 5689 1 1 2 GLU HG2 H -4.831 -6.134 1.072 1.00 . A A . 2 GLU HG2 1 1 10 5690 1 1 2 GLU HG3 H -4.286 -5.128 2.400 1.00 . A A . 2 GLU HG3 1 1 10 5691 1 1 2 GLU N N -7.169 -6.040 0.151 1.00 . A A . 2 GLU N 1 1 10 5692 1 1 2 GLU O O -7.279 -2.732 1.360 1.00 . A A . 2 GLU O 1 1 10 5693 1 1 2 GLU OE1 O -4.577 -8.364 2.259 1.00 . A A . 2 GLU OE1 1 1 10 5694 1 1 2 GLU OE2 O -3.752 -7.190 3.917 1.00 . A A . 2 GLU OE2 1 1 10 5695 1 1 3 CYS C C -5.877 -1.704 -1.402 1.00 . A A . 3 CYS C 1 1 10 5696 1 1 3 CYS CA C -5.069 -2.353 -0.272 1.00 . A A . 3 CYS CA 1 1 10 5697 1 1 3 CYS CB C -3.608 -2.584 -0.636 1.00 . A A . 3 CYS CB 1 1 10 5698 1 1 3 CYS H H -5.248 -4.462 -0.343 1.00 . A A . 3 CYS H 1 1 10 5699 1 1 3 CYS HA H -5.106 -1.713 0.610 1.00 . A A . 3 CYS HA 1 1 10 5700 1 1 3 CYS HB2 H -3.110 -3.069 0.202 1.00 . A A . 3 CYS HB2 1 1 10 5701 1 1 3 CYS HB3 H -3.572 -3.267 -1.477 1.00 . A A . 3 CYS HB3 1 1 10 5702 1 1 3 CYS N N -5.650 -3.626 0.083 1.00 . A A . 3 CYS N 1 1 10 5703 1 1 3 CYS O O -6.135 -0.498 -1.332 1.00 . A A . 3 CYS O 1 1 10 5704 1 1 3 CYS SG S -2.681 -1.104 -1.075 1.00 . A A . 3 CYS SG 1 1 10 5705 1 1 4 GLU C C -8.506 -1.456 -2.915 1.00 . A A . 4 GLU C 1 1 10 5706 1 1 4 GLU CA C -7.197 -2.021 -3.475 1.00 . A A . 4 GLU CA 1 1 10 5707 1 1 4 GLU CB C -7.502 -3.178 -4.456 1.00 . A A . 4 GLU CB 1 1 10 5708 1 1 4 GLU CD C -6.557 -4.700 -6.299 1.00 . A A . 4 GLU CD 1 1 10 5709 1 1 4 GLU CG C -6.326 -3.479 -5.394 1.00 . A A . 4 GLU CG 1 1 10 5710 1 1 4 GLU H H -6.056 -3.468 -2.397 1.00 . A A . 4 GLU H 1 1 10 5711 1 1 4 GLU HA H -6.687 -1.211 -4.003 1.00 . A A . 4 GLU HA 1 1 10 5712 1 1 4 GLU HB2 H -7.767 -4.074 -3.894 1.00 . A A . 4 GLU HB2 1 1 10 5713 1 1 4 GLU HB3 H -8.360 -2.907 -5.072 1.00 . A A . 4 GLU HB3 1 1 10 5714 1 1 4 GLU HG2 H -6.178 -2.606 -6.027 1.00 . A A . 4 GLU HG2 1 1 10 5715 1 1 4 GLU HG3 H -5.425 -3.619 -4.804 1.00 . A A . 4 GLU HG3 1 1 10 5716 1 1 4 GLU N N -6.331 -2.482 -2.391 1.00 . A A . 4 GLU N 1 1 10 5717 1 1 4 GLU O O -8.984 -0.424 -3.386 1.00 . A A . 4 GLU O 1 1 10 5718 1 1 4 GLU OE1 O -7.076 -4.536 -7.428 1.00 . A A . 4 GLU OE1 1 1 10 5719 1 1 4 GLU OE2 O -6.193 -5.845 -5.939 1.00 . A A . 4 GLU OE2 1 1 10 5720 1 1 5 GLN C C -10.155 -0.320 -0.606 1.00 . A A . 5 GLN C 1 1 10 5721 1 1 5 GLN CA C -10.297 -1.716 -1.203 1.00 . A A . 5 GLN CA 1 1 10 5722 1 1 5 GLN CB C -10.552 -2.759 -0.103 1.00 . A A . 5 GLN CB 1 1 10 5723 1 1 5 GLN CD C -13.044 -3.043 -0.253 1.00 . A A . 5 GLN CD 1 1 10 5724 1 1 5 GLN CG C -11.878 -2.644 0.642 1.00 . A A . 5 GLN CG 1 1 10 5725 1 1 5 GLN H H -8.612 -2.954 -1.585 1.00 . A A . 5 GLN H 1 1 10 5726 1 1 5 GLN HA H -11.124 -1.714 -1.913 1.00 . A A . 5 GLN HA 1 1 10 5727 1 1 5 GLN HB2 H -10.531 -3.741 -0.558 1.00 . A A . 5 GLN HB2 1 1 10 5728 1 1 5 GLN HB3 H -9.750 -2.703 0.631 1.00 . A A . 5 GLN HB3 1 1 10 5729 1 1 5 GLN HE21 H -13.663 -1.120 -0.457 1.00 . A A . 5 GLN HE21 1 1 10 5730 1 1 5 GLN HE22 H -14.615 -2.298 -1.311 1.00 . A A . 5 GLN HE22 1 1 10 5731 1 1 5 GLN HG2 H -11.857 -3.323 1.497 1.00 . A A . 5 GLN HG2 1 1 10 5732 1 1 5 GLN HG3 H -11.992 -1.631 1.016 1.00 . A A . 5 GLN HG3 1 1 10 5733 1 1 5 GLN N N -9.073 -2.103 -1.895 1.00 . A A . 5 GLN N 1 1 10 5734 1 1 5 GLN NE2 N -13.804 -2.081 -0.747 1.00 . A A . 5 GLN NE2 1 1 10 5735 1 1 5 GLN O O -11.088 0.485 -0.668 1.00 . A A . 5 GLN O 1 1 10 5736 1 1 5 GLN OE1 O -13.238 -4.230 -0.530 1.00 . A A . 5 GLN OE1 1 1 10 5737 1 1 6 CYS C C -8.527 2.321 -0.457 1.00 . A A . 6 CYS C 1 1 10 5738 1 1 6 CYS CA C -8.699 1.225 0.605 1.00 . A A . 6 CYS CA 1 1 10 5739 1 1 6 CYS CB C -7.450 1.053 1.467 1.00 . A A . 6 CYS CB 1 1 10 5740 1 1 6 CYS H H -8.275 -0.761 -0.026 1.00 . A A . 6 CYS H 1 1 10 5741 1 1 6 CYS HA H -9.535 1.490 1.253 1.00 . A A . 6 CYS HA 1 1 10 5742 1 1 6 CYS HB2 H -7.417 0.055 1.903 1.00 . A A . 6 CYS HB2 1 1 10 5743 1 1 6 CYS HB3 H -6.579 1.151 0.832 1.00 . A A . 6 CYS HB3 1 1 10 5744 1 1 6 CYS N N -8.991 -0.046 -0.022 1.00 . A A . 6 CYS N 1 1 10 5745 1 1 6 CYS O O -9.049 3.425 -0.296 1.00 . A A . 6 CYS O 1 1 10 5746 1 1 6 CYS SG S -7.346 2.275 2.784 1.00 . A A . 6 CYS SG 1 1 10 5747 1 1 7 PHE C C -9.012 3.234 -3.370 1.00 . A A . 7 PHE C 1 1 10 5748 1 1 7 PHE CA C -7.681 2.909 -2.706 1.00 . A A . 7 PHE CA 1 1 10 5749 1 1 7 PHE CB C -6.748 2.289 -3.754 1.00 . A A . 7 PHE CB 1 1 10 5750 1 1 7 PHE CD1 C -4.421 2.941 -3.086 1.00 . A A . 7 PHE CD1 1 1 10 5751 1 1 7 PHE CD2 C -5.413 4.042 -5.015 1.00 . A A . 7 PHE CD2 1 1 10 5752 1 1 7 PHE CE1 C -3.251 3.698 -3.270 1.00 . A A . 7 PHE CE1 1 1 10 5753 1 1 7 PHE CE2 C -4.236 4.788 -5.205 1.00 . A A . 7 PHE CE2 1 1 10 5754 1 1 7 PHE CG C -5.501 3.111 -3.963 1.00 . A A . 7 PHE CG 1 1 10 5755 1 1 7 PHE CZ C -3.156 4.617 -4.326 1.00 . A A . 7 PHE CZ 1 1 10 5756 1 1 7 PHE H H -7.451 1.076 -1.639 1.00 . A A . 7 PHE H 1 1 10 5757 1 1 7 PHE HA H -7.247 3.843 -2.346 1.00 . A A . 7 PHE HA 1 1 10 5758 1 1 7 PHE HB2 H -6.460 1.279 -3.458 1.00 . A A . 7 PHE HB2 1 1 10 5759 1 1 7 PHE HB3 H -7.269 2.199 -4.710 1.00 . A A . 7 PHE HB3 1 1 10 5760 1 1 7 PHE HD1 H -4.523 2.241 -2.270 1.00 . A A . 7 PHE HD1 1 1 10 5761 1 1 7 PHE HD2 H -6.248 4.207 -5.677 1.00 . A A . 7 PHE HD2 1 1 10 5762 1 1 7 PHE HE1 H -2.415 3.623 -2.593 1.00 . A A . 7 PHE HE1 1 1 10 5763 1 1 7 PHE HE2 H -4.173 5.507 -6.009 1.00 . A A . 7 PHE HE2 1 1 10 5764 1 1 7 PHE HZ H -2.260 5.211 -4.432 1.00 . A A . 7 PHE HZ 1 1 10 5765 1 1 7 PHE N N -7.848 2.005 -1.568 1.00 . A A . 7 PHE N 1 1 10 5766 1 1 7 PHE O O -9.231 4.361 -3.802 1.00 . A A . 7 PHE O 1 1 10 5767 1 1 8 SER C C -11.982 3.529 -3.323 1.00 . A A . 8 SER C 1 1 10 5768 1 1 8 SER CA C -11.221 2.405 -4.043 1.00 . A A . 8 SER CA 1 1 10 5769 1 1 8 SER CB C -11.932 1.042 -4.027 1.00 . A A . 8 SER CB 1 1 10 5770 1 1 8 SER H H -9.628 1.347 -3.086 1.00 . A A . 8 SER H 1 1 10 5771 1 1 8 SER HA H -11.092 2.717 -5.080 1.00 . A A . 8 SER HA 1 1 10 5772 1 1 8 SER HB2 H -12.037 0.672 -3.003 1.00 . A A . 8 SER HB2 1 1 10 5773 1 1 8 SER HB3 H -12.920 1.139 -4.475 1.00 . A A . 8 SER HB3 1 1 10 5774 1 1 8 SER HG H -10.321 -0.031 -4.280 1.00 . A A . 8 SER HG 1 1 10 5775 1 1 8 SER N N -9.903 2.249 -3.452 1.00 . A A . 8 SER N 1 1 10 5776 1 1 8 SER O O -12.625 4.354 -3.974 1.00 . A A . 8 SER O 1 1 10 5777 1 1 8 SER OG O -11.162 0.101 -4.771 1.00 . A A . 8 SER OG 1 1 10 5778 1 1 9 ASP C C -11.400 5.957 -1.197 1.00 . A A . 9 ASP C 1 1 10 5779 1 1 9 ASP CA C -12.318 4.719 -1.157 1.00 . A A . 9 ASP CA 1 1 10 5780 1 1 9 ASP CB C -12.452 4.145 0.259 1.00 . A A . 9 ASP CB 1 1 10 5781 1 1 9 ASP CG C -13.478 4.865 1.137 1.00 . A A . 9 ASP CG 1 1 10 5782 1 1 9 ASP H H -11.196 2.976 -1.548 1.00 . A A . 9 ASP H 1 1 10 5783 1 1 9 ASP HA H -13.309 5.007 -1.511 1.00 . A A . 9 ASP HA 1 1 10 5784 1 1 9 ASP HB2 H -12.770 3.104 0.169 1.00 . A A . 9 ASP HB2 1 1 10 5785 1 1 9 ASP HB3 H -11.485 4.138 0.758 1.00 . A A . 9 ASP HB3 1 1 10 5786 1 1 9 ASP N N -11.800 3.644 -2.005 1.00 . A A . 9 ASP N 1 1 10 5787 1 1 9 ASP O O -11.142 6.602 -0.183 1.00 . A A . 9 ASP O 1 1 10 5788 1 1 9 ASP OD1 O -13.308 6.056 1.477 1.00 . A A . 9 ASP OD1 1 1 10 5789 1 1 9 ASP OD2 O -14.408 4.147 1.580 1.00 . A A . 9 ASP OD2 1 1 10 5790 1 1 10 GLY C C -8.708 7.479 -1.753 1.00 . A A . 10 GLY C 1 1 10 5791 1 1 10 GLY CA C -10.004 7.463 -2.572 1.00 . A A . 10 GLY CA 1 1 10 5792 1 1 10 GLY H H -10.984 5.673 -3.153 1.00 . A A . 10 GLY H 1 1 10 5793 1 1 10 GLY HA2 H -10.582 8.352 -2.323 1.00 . A A . 10 GLY HA2 1 1 10 5794 1 1 10 GLY HA3 H -9.741 7.521 -3.627 1.00 . A A . 10 GLY HA3 1 1 10 5795 1 1 10 GLY N N -10.842 6.287 -2.362 1.00 . A A . 10 GLY N 1 1 10 5796 1 1 10 GLY O O -8.133 8.557 -1.562 1.00 . A A . 10 GLY O 1 1 10 5797 1 1 11 GLY C C -5.816 6.439 -1.281 1.00 . A A . 11 GLY C 1 1 10 5798 1 1 11 GLY CA C -7.057 6.230 -0.425 1.00 . A A . 11 GLY CA 1 1 10 5799 1 1 11 GLY H H -8.762 5.481 -1.454 1.00 . A A . 11 GLY H 1 1 10 5800 1 1 11 GLY HA2 H -7.018 5.242 0.022 1.00 . A A . 11 GLY HA2 1 1 10 5801 1 1 11 GLY HA3 H -7.104 6.978 0.359 1.00 . A A . 11 GLY HA3 1 1 10 5802 1 1 11 GLY N N -8.260 6.330 -1.238 1.00 . A A . 11 GLY N 1 1 10 5803 1 1 11 GLY O O -5.811 6.021 -2.438 1.00 . A A . 11 GLY O 1 1 10 5804 1 1 12 ASP C C -2.348 6.805 -1.095 1.00 . A A . 12 ASP C 1 1 10 5805 1 1 12 ASP CA C -3.626 7.531 -1.521 1.00 . A A . 12 ASP CA 1 1 10 5806 1 1 12 ASP CB C -3.417 9.051 -1.367 1.00 . A A . 12 ASP CB 1 1 10 5807 1 1 12 ASP CG C -3.673 9.688 0.017 1.00 . A A . 12 ASP CG 1 1 10 5808 1 1 12 ASP H H -4.788 7.352 0.233 1.00 . A A . 12 ASP H 1 1 10 5809 1 1 12 ASP HA H -3.793 7.296 -2.577 1.00 . A A . 12 ASP HA 1 1 10 5810 1 1 12 ASP HB2 H -2.403 9.286 -1.687 1.00 . A A . 12 ASP HB2 1 1 10 5811 1 1 12 ASP HB3 H -4.095 9.532 -2.075 1.00 . A A . 12 ASP HB3 1 1 10 5812 1 1 12 ASP N N -4.765 7.057 -0.736 1.00 . A A . 12 ASP N 1 1 10 5813 1 1 12 ASP O O -1.821 5.983 -1.839 1.00 . A A . 12 ASP O 1 1 10 5814 1 1 12 ASP OD1 O -3.635 9.001 1.070 1.00 . A A . 12 ASP OD1 1 1 10 5815 1 1 12 ASP OD2 O -3.797 10.936 0.047 1.00 . A A . 12 ASP OD2 1 1 10 5816 1 1 13 CYS C C -1.084 6.532 2.291 1.00 . A A . 13 CYS C 1 1 10 5817 1 1 13 CYS CA C -0.849 6.320 0.800 1.00 . A A . 13 CYS CA 1 1 10 5818 1 1 13 CYS CB C 0.581 6.680 0.364 1.00 . A A . 13 CYS CB 1 1 10 5819 1 1 13 CYS H H -2.367 7.783 0.646 1.00 . A A . 13 CYS H 1 1 10 5820 1 1 13 CYS HA H -1.022 5.276 0.563 1.00 . A A . 13 CYS HA 1 1 10 5821 1 1 13 CYS HB2 H 0.651 6.541 -0.716 1.00 . A A . 13 CYS HB2 1 1 10 5822 1 1 13 CYS HB3 H 0.771 7.730 0.579 1.00 . A A . 13 CYS HB3 1 1 10 5823 1 1 13 CYS N N -1.841 7.107 0.097 1.00 . A A . 13 CYS N 1 1 10 5824 1 1 13 CYS O O -1.286 5.565 3.027 1.00 . A A . 13 CYS O 1 1 10 5825 1 1 13 CYS SG S 1.869 5.662 1.155 1.00 . A A . 13 CYS SG 1 1 10 5826 1 1 14 THR C C -2.648 7.569 4.625 1.00 . A A . 14 THR C 1 1 10 5827 1 1 14 THR CA C -1.323 8.143 4.136 1.00 . A A . 14 THR CA 1 1 10 5828 1 1 14 THR CB C -1.248 9.671 4.299 1.00 . A A . 14 THR CB 1 1 10 5829 1 1 14 THR CG2 C -1.597 10.143 5.718 1.00 . A A . 14 THR CG2 1 1 10 5830 1 1 14 THR H H -0.928 8.559 2.097 1.00 . A A . 14 THR H 1 1 10 5831 1 1 14 THR HA H -0.538 7.680 4.739 1.00 . A A . 14 THR HA 1 1 10 5832 1 1 14 THR HB H -1.933 10.143 3.592 1.00 . A A . 14 THR HB 1 1 10 5833 1 1 14 THR HG1 H 0.037 11.043 3.841 1.00 . A A . 14 THR HG1 1 1 10 5834 1 1 14 THR HG21 H -0.989 9.623 6.460 1.00 . A A . 14 THR HG21 1 1 10 5835 1 1 14 THR HG22 H -1.439 11.216 5.810 1.00 . A A . 14 THR HG22 1 1 10 5836 1 1 14 THR HG23 H -2.649 9.946 5.926 1.00 . A A . 14 THR HG23 1 1 10 5837 1 1 14 THR N N -1.098 7.793 2.740 1.00 . A A . 14 THR N 1 1 10 5838 1 1 14 THR O O -2.648 6.860 5.636 1.00 . A A . 14 THR O 1 1 10 5839 1 1 14 THR OG1 O 0.074 10.082 4.004 1.00 . A A . 14 THR OG1 1 1 10 5840 1 1 15 THR C C -5.475 6.060 4.279 1.00 . A A . 15 THR C 1 1 10 5841 1 1 15 THR CA C -5.076 7.524 4.522 1.00 . A A . 15 THR CA 1 1 10 5842 1 1 15 THR CB C -6.063 8.578 3.985 1.00 . A A . 15 THR CB 1 1 10 5843 1 1 15 THR CG2 C -6.629 8.318 2.587 1.00 . A A . 15 THR CG2 1 1 10 5844 1 1 15 THR H H -3.744 8.332 3.050 1.00 . A A . 15 THR H 1 1 10 5845 1 1 15 THR HA H -5.003 7.658 5.603 1.00 . A A . 15 THR HA 1 1 10 5846 1 1 15 THR HB H -5.517 9.519 3.914 1.00 . A A . 15 THR HB 1 1 10 5847 1 1 15 THR HG1 H -6.771 8.754 5.794 1.00 . A A . 15 THR HG1 1 1 10 5848 1 1 15 THR HG21 H -5.827 8.017 1.917 1.00 . A A . 15 THR HG21 1 1 10 5849 1 1 15 THR HG22 H -7.389 7.539 2.610 1.00 . A A . 15 THR HG22 1 1 10 5850 1 1 15 THR HG23 H -7.097 9.221 2.199 1.00 . A A . 15 THR HG23 1 1 10 5851 1 1 15 THR N N -3.770 7.823 3.934 1.00 . A A . 15 THR N 1 1 10 5852 1 1 15 THR O O -6.650 5.707 4.208 1.00 . A A . 15 THR O 1 1 10 5853 1 1 15 THR OG1 O -7.125 8.803 4.893 1.00 . A A . 15 THR OG1 1 1 10 5854 1 1 16 CYS C C -3.439 3.204 5.129 1.00 . A A . 16 CYS C 1 1 10 5855 1 1 16 CYS CA C -4.563 3.742 4.266 1.00 . A A . 16 CYS CA 1 1 10 5856 1 1 16 CYS CB C -4.501 3.265 2.818 1.00 . A A . 16 CYS CB 1 1 10 5857 1 1 16 CYS H H -3.563 5.573 4.489 1.00 . A A . 16 CYS H 1 1 10 5858 1 1 16 CYS HA H -5.502 3.402 4.704 1.00 . A A . 16 CYS HA 1 1 10 5859 1 1 16 CYS HB2 H -3.678 3.772 2.310 1.00 . A A . 16 CYS HB2 1 1 10 5860 1 1 16 CYS HB3 H -4.320 2.193 2.794 1.00 . A A . 16 CYS HB3 1 1 10 5861 1 1 16 CYS N N -4.478 5.181 4.318 1.00 . A A . 16 CYS N 1 1 10 5862 1 1 16 CYS O O -3.753 2.434 6.026 1.00 . A A . 16 CYS O 1 1 10 5863 1 1 16 CYS SG S -6.059 3.599 1.958 1.00 . A A . 16 CYS SG 1 1 10 5864 1 1 17 PHE C C -1.388 3.268 7.272 1.00 . A A . 17 PHE C 1 1 10 5865 1 1 17 PHE CA C -1.070 3.158 5.782 1.00 . A A . 17 PHE CA 1 1 10 5866 1 1 17 PHE CB C 0.240 3.900 5.458 1.00 . A A . 17 PHE CB 1 1 10 5867 1 1 17 PHE CD1 C 1.744 1.991 6.107 1.00 . A A . 17 PHE CD1 1 1 10 5868 1 1 17 PHE CD2 C 2.230 4.168 7.051 1.00 . A A . 17 PHE CD2 1 1 10 5869 1 1 17 PHE CE1 C 2.813 1.418 6.814 1.00 . A A . 17 PHE CE1 1 1 10 5870 1 1 17 PHE CE2 C 3.324 3.605 7.735 1.00 . A A . 17 PHE CE2 1 1 10 5871 1 1 17 PHE CG C 1.439 3.355 6.218 1.00 . A A . 17 PHE CG 1 1 10 5872 1 1 17 PHE CZ C 3.618 2.237 7.611 1.00 . A A . 17 PHE CZ 1 1 10 5873 1 1 17 PHE H H -1.956 4.305 4.225 1.00 . A A . 17 PHE H 1 1 10 5874 1 1 17 PHE HA H -0.939 2.101 5.558 1.00 . A A . 17 PHE HA 1 1 10 5875 1 1 17 PHE HB2 H 0.445 3.803 4.392 1.00 . A A . 17 PHE HB2 1 1 10 5876 1 1 17 PHE HB3 H 0.121 4.961 5.676 1.00 . A A . 17 PHE HB3 1 1 10 5877 1 1 17 PHE HD1 H 1.157 1.391 5.444 1.00 . A A . 17 PHE HD1 1 1 10 5878 1 1 17 PHE HD2 H 2.001 5.216 7.191 1.00 . A A . 17 PHE HD2 1 1 10 5879 1 1 17 PHE HE1 H 3.034 0.357 6.747 1.00 . A A . 17 PHE HE1 1 1 10 5880 1 1 17 PHE HE2 H 3.935 4.203 8.396 1.00 . A A . 17 PHE HE2 1 1 10 5881 1 1 17 PHE HZ H 4.446 1.802 8.150 1.00 . A A . 17 PHE HZ 1 1 10 5882 1 1 17 PHE N N -2.181 3.635 4.955 1.00 . A A . 17 PHE N 1 1 10 5883 1 1 17 PHE O O -1.104 2.331 8.026 1.00 . A A . 17 PHE O 1 1 10 5884 1 1 18 ASN C C -1.365 4.528 10.040 1.00 . A A . 18 ASN C 1 1 10 5885 1 1 18 ASN CA C -2.515 4.598 9.040 1.00 . A A . 18 ASN CA 1 1 10 5886 1 1 18 ASN CB C -3.601 3.578 9.400 1.00 . A A . 18 ASN CB 1 1 10 5887 1 1 18 ASN CG C -4.666 4.174 10.311 1.00 . A A . 18 ASN CG 1 1 10 5888 1 1 18 ASN H H -2.188 5.114 6.999 1.00 . A A . 18 ASN H 1 1 10 5889 1 1 18 ASN HA H -2.947 5.599 9.085 1.00 . A A . 18 ASN HA 1 1 10 5890 1 1 18 ASN HB2 H -4.075 3.215 8.495 1.00 . A A . 18 ASN HB2 1 1 10 5891 1 1 18 ASN HB3 H -3.105 2.736 9.883 1.00 . A A . 18 ASN HB3 1 1 10 5892 1 1 18 ASN HD21 H -6.115 3.626 9.036 1.00 . A A . 18 ASN HD21 1 1 10 5893 1 1 18 ASN HD22 H -6.664 4.555 10.415 1.00 . A A . 18 ASN HD22 1 1 10 5894 1 1 18 ASN N N -2.039 4.370 7.675 1.00 . A A . 18 ASN N 1 1 10 5895 1 1 18 ASN ND2 N -5.911 4.179 9.867 1.00 . A A . 18 ASN ND2 1 1 10 5896 1 1 18 ASN O O -1.534 4.116 11.183 1.00 . A A . 18 ASN O 1 1 10 5897 1 1 18 ASN OD1 O -4.387 4.682 11.396 1.00 . A A . 18 ASN OD1 1 1 10 5898 1 1 19 ASN C C 1.211 3.177 10.811 1.00 . A A . 19 ASN C 1 1 10 5899 1 1 19 ASN CA C 1.073 4.621 10.322 1.00 . A A . 19 ASN CA 1 1 10 5900 1 1 19 ASN CB C 1.329 5.696 11.373 1.00 . A A . 19 ASN CB 1 1 10 5901 1 1 19 ASN CG C 2.777 5.652 11.826 1.00 . A A . 19 ASN CG 1 1 10 5902 1 1 19 ASN H H -0.085 5.257 8.665 1.00 . A A . 19 ASN H 1 1 10 5903 1 1 19 ASN HA H 1.834 4.741 9.574 1.00 . A A . 19 ASN HA 1 1 10 5904 1 1 19 ASN HB2 H 1.152 6.670 10.915 1.00 . A A . 19 ASN HB2 1 1 10 5905 1 1 19 ASN HB3 H 0.654 5.547 12.214 1.00 . A A . 19 ASN HB3 1 1 10 5906 1 1 19 ASN HD21 H 2.338 4.709 13.570 1.00 . A A . 19 ASN HD21 1 1 10 5907 1 1 19 ASN HD22 H 4.038 5.035 13.251 1.00 . A A . 19 ASN HD22 1 1 10 5908 1 1 19 ASN N N -0.158 4.865 9.599 1.00 . A A . 19 ASN N 1 1 10 5909 1 1 19 ASN ND2 N 3.059 5.148 13.013 1.00 . A A . 19 ASN ND2 1 1 10 5910 1 1 19 ASN O O 1.192 2.903 12.013 1.00 . A A . 19 ASN O 1 1 10 5911 1 1 19 ASN OD1 O 3.653 6.098 11.093 1.00 . A A . 19 ASN OD1 1 1 10 5912 1 1 20 GLY C C 0.690 -0.097 10.552 1.00 . A A . 20 GLY C 1 1 10 5913 1 1 20 GLY CA C 1.749 0.894 10.083 1.00 . A A . 20 GLY CA 1 1 10 5914 1 1 20 GLY H H 1.195 2.544 8.895 1.00 . A A . 20 GLY H 1 1 10 5915 1 1 20 GLY HA2 H 2.574 0.934 10.795 1.00 . A A . 20 GLY HA2 1 1 10 5916 1 1 20 GLY HA3 H 2.156 0.512 9.151 1.00 . A A . 20 GLY HA3 1 1 10 5917 1 1 20 GLY N N 1.251 2.243 9.859 1.00 . A A . 20 GLY N 1 1 10 5918 1 1 20 GLY O O 1.015 -1.268 10.757 1.00 . A A . 20 GLY O 1 1 10 5919 1 1 21 THR C C -2.812 -0.756 10.177 1.00 . A A . 21 THR C 1 1 10 5920 1 1 21 THR CA C -1.645 -0.562 11.156 1.00 . A A . 21 THR CA 1 1 10 5921 1 1 21 THR CB C -2.007 -0.168 12.593 1.00 . A A . 21 THR CB 1 1 10 5922 1 1 21 THR CG2 C -2.942 1.020 12.606 1.00 . A A . 21 THR CG2 1 1 10 5923 1 1 21 THR H H -0.800 1.258 10.405 1.00 . A A . 21 THR H 1 1 10 5924 1 1 21 THR HA H -1.253 -1.545 11.303 1.00 . A A . 21 THR HA 1 1 10 5925 1 1 21 THR HB H -1.095 0.093 13.131 1.00 . A A . 21 THR HB 1 1 10 5926 1 1 21 THR HG1 H -3.417 -1.481 12.776 1.00 . A A . 21 THR HG1 1 1 10 5927 1 1 21 THR HG21 H -2.456 1.840 12.088 1.00 . A A . 21 THR HG21 1 1 10 5928 1 1 21 THR HG22 H -3.855 0.744 12.089 1.00 . A A . 21 THR HG22 1 1 10 5929 1 1 21 THR HG23 H -3.173 1.306 13.628 1.00 . A A . 21 THR HG23 1 1 10 5930 1 1 21 THR N N -0.581 0.301 10.643 1.00 . A A . 21 THR N 1 1 10 5931 1 1 21 THR O O -3.669 -1.594 10.447 1.00 . A A . 21 THR O 1 1 10 5932 1 1 21 THR OG1 O -2.601 -1.262 13.259 1.00 . A A . 21 THR OG1 1 1 10 5933 1 1 22 GLY C C -3.687 -1.363 7.077 1.00 . A A . 22 GLY C 1 1 10 5934 1 1 22 GLY CA C -3.897 -0.194 8.048 1.00 . A A . 22 GLY CA 1 1 10 5935 1 1 22 GLY H H -2.103 0.609 8.822 1.00 . A A . 22 GLY H 1 1 10 5936 1 1 22 GLY HA2 H -3.959 0.733 7.503 1.00 . A A . 22 GLY HA2 1 1 10 5937 1 1 22 GLY HA3 H -4.847 -0.341 8.561 1.00 . A A . 22 GLY HA3 1 1 10 5938 1 1 22 GLY N N -2.831 -0.061 9.035 1.00 . A A . 22 GLY N 1 1 10 5939 1 1 22 GLY O O -2.889 -2.260 7.369 1.00 . A A . 22 GLY O 1 1 10 5940 1 1 23 PRO C C -3.123 -2.634 4.236 1.00 . A A . 23 PRO C 1 1 10 5941 1 1 23 PRO CA C -4.432 -2.536 5.027 1.00 . A A . 23 PRO CA 1 1 10 5942 1 1 23 PRO CB C -5.653 -2.316 4.136 1.00 . A A . 23 PRO CB 1 1 10 5943 1 1 23 PRO CD C -5.241 -0.318 5.415 1.00 . A A . 23 PRO CD 1 1 10 5944 1 1 23 PRO CG C -5.870 -0.808 4.118 1.00 . A A . 23 PRO CG 1 1 10 5945 1 1 23 PRO HA H -4.572 -3.460 5.590 1.00 . A A . 23 PRO HA 1 1 10 5946 1 1 23 PRO HB2 H -5.495 -2.685 3.126 1.00 . A A . 23 PRO HB2 1 1 10 5947 1 1 23 PRO HB3 H -6.515 -2.800 4.593 1.00 . A A . 23 PRO HB3 1 1 10 5948 1 1 23 PRO HD2 H -4.609 0.520 5.161 1.00 . A A . 23 PRO HD2 1 1 10 5949 1 1 23 PRO HD3 H -6.011 -0.012 6.123 1.00 . A A . 23 PRO HD3 1 1 10 5950 1 1 23 PRO HG2 H -5.345 -0.372 3.269 1.00 . A A . 23 PRO HG2 1 1 10 5951 1 1 23 PRO HG3 H -6.926 -0.555 4.067 1.00 . A A . 23 PRO HG3 1 1 10 5952 1 1 23 PRO N N -4.413 -1.400 5.940 1.00 . A A . 23 PRO N 1 1 10 5953 1 1 23 PRO O O -2.378 -3.602 4.399 1.00 . A A . 23 PRO O 1 1 10 5954 1 1 24 CYS C C -0.560 -0.992 3.964 1.00 . A A . 24 CYS C 1 1 10 5955 1 1 24 CYS CA C -1.474 -1.472 2.835 1.00 . A A . 24 CYS CA 1 1 10 5956 1 1 24 CYS CB C -1.486 -0.495 1.636 1.00 . A A . 24 CYS CB 1 1 10 5957 1 1 24 CYS H H -3.410 -0.824 3.400 1.00 . A A . 24 CYS H 1 1 10 5958 1 1 24 CYS HA H -1.118 -2.442 2.486 1.00 . A A . 24 CYS HA 1 1 10 5959 1 1 24 CYS HB2 H -2.461 -0.023 1.527 1.00 . A A . 24 CYS HB2 1 1 10 5960 1 1 24 CYS HB3 H -0.766 0.305 1.796 1.00 . A A . 24 CYS HB3 1 1 10 5961 1 1 24 CYS N N -2.801 -1.627 3.415 1.00 . A A . 24 CYS N 1 1 10 5962 1 1 24 CYS O O -0.323 0.203 4.082 1.00 . A A . 24 CYS O 1 1 10 5963 1 1 24 CYS SG S -1.007 -1.222 0.061 1.00 . A A . 24 CYS SG 1 1 10 5964 1 1 25 ALA C C 2.098 -2.465 5.773 1.00 . A A . 25 ALA C 1 1 10 5965 1 1 25 ALA CA C 0.850 -1.607 5.893 1.00 . A A . 25 ALA CA 1 1 10 5966 1 1 25 ALA CB C 0.212 -1.690 7.270 1.00 . A A . 25 ALA CB 1 1 10 5967 1 1 25 ALA H H -0.470 -2.843 4.739 1.00 . A A . 25 ALA H 1 1 10 5968 1 1 25 ALA HA H 1.186 -0.588 5.774 1.00 . A A . 25 ALA HA 1 1 10 5969 1 1 25 ALA HB1 H 0.984 -1.507 8.017 1.00 . A A . 25 ALA HB1 1 1 10 5970 1 1 25 ALA HB2 H -0.217 -2.680 7.410 1.00 . A A . 25 ALA HB2 1 1 10 5971 1 1 25 ALA HB3 H -0.554 -0.920 7.366 1.00 . A A . 25 ALA HB3 1 1 10 5972 1 1 25 ALA N N -0.109 -1.902 4.833 1.00 . A A . 25 ALA N 1 1 10 5973 1 1 25 ALA O O 3.188 -1.915 5.643 1.00 . A A . 25 ALA O 1 1 10 5974 1 1 26 ASN C C 3.813 -4.295 4.200 1.00 . A A . 26 ASN C 1 1 10 5975 1 1 26 ASN CA C 3.099 -4.676 5.496 1.00 . A A . 26 ASN CA 1 1 10 5976 1 1 26 ASN CB C 2.682 -6.150 5.381 1.00 . A A . 26 ASN CB 1 1 10 5977 1 1 26 ASN CG C 2.340 -6.799 6.706 1.00 . A A . 26 ASN CG 1 1 10 5978 1 1 26 ASN H H 1.045 -4.206 5.915 1.00 . A A . 26 ASN H 1 1 10 5979 1 1 26 ASN HA H 3.802 -4.538 6.320 1.00 . A A . 26 ASN HA 1 1 10 5980 1 1 26 ASN HB2 H 1.861 -6.261 4.673 1.00 . A A . 26 ASN HB2 1 1 10 5981 1 1 26 ASN HB3 H 3.532 -6.702 4.977 1.00 . A A . 26 ASN HB3 1 1 10 5982 1 1 26 ASN HD21 H 0.311 -6.547 6.476 1.00 . A A . 26 ASN HD21 1 1 10 5983 1 1 26 ASN HD22 H 0.861 -7.162 8.013 1.00 . A A . 26 ASN HD22 1 1 10 5984 1 1 26 ASN N N 1.950 -3.795 5.736 1.00 . A A . 26 ASN N 1 1 10 5985 1 1 26 ASN ND2 N 1.078 -6.788 7.091 1.00 . A A . 26 ASN ND2 1 1 10 5986 1 1 26 ASN O O 5.040 -4.320 4.139 1.00 . A A . 26 ASN O 1 1 10 5987 1 1 26 ASN OD1 O 3.198 -7.381 7.363 1.00 . A A . 26 ASN OD1 1 1 10 5988 1 1 27 CYS C C 4.452 -2.181 2.025 1.00 . A A . 27 CYS C 1 1 10 5989 1 1 27 CYS CA C 3.514 -3.388 1.915 1.00 . A A . 27 CYS CA 1 1 10 5990 1 1 27 CYS CB C 2.359 -3.174 0.920 1.00 . A A . 27 CYS CB 1 1 10 5991 1 1 27 CYS H H 2.038 -3.878 3.348 1.00 . A A . 27 CYS H 1 1 10 5992 1 1 27 CYS HA H 4.096 -4.192 1.467 1.00 . A A . 27 CYS HA 1 1 10 5993 1 1 27 CYS HB2 H 1.803 -2.246 1.084 1.00 . A A . 27 CYS HB2 1 1 10 5994 1 1 27 CYS HB3 H 2.813 -3.058 -0.061 1.00 . A A . 27 CYS HB3 1 1 10 5995 1 1 27 CYS N N 3.031 -3.865 3.200 1.00 . A A . 27 CYS N 1 1 10 5996 1 1 27 CYS O O 4.925 -1.755 0.988 1.00 . A A . 27 CYS O 1 1 10 5997 1 1 27 CYS SG S 1.277 -4.637 0.851 1.00 . A A . 27 CYS SG 1 1 10 5998 1 1 28 LEU C C 6.998 -1.072 4.015 1.00 . A A . 28 LEU C 1 1 10 5999 1 1 28 LEU CA C 5.732 -0.550 3.359 1.00 . A A . 28 LEU CA 1 1 10 6000 1 1 28 LEU CB C 5.135 0.539 4.245 1.00 . A A . 28 LEU CB 1 1 10 6001 1 1 28 LEU CD1 C 4.606 2.237 2.453 1.00 . A A . 28 LEU CD1 1 1 10 6002 1 1 28 LEU CD2 C 2.857 0.587 3.003 1.00 . A A . 28 LEU CD2 1 1 10 6003 1 1 28 LEU CG C 4.042 1.365 3.569 1.00 . A A . 28 LEU CG 1 1 10 6004 1 1 28 LEU H H 4.137 -1.688 4.005 1.00 . A A . 28 LEU H 1 1 10 6005 1 1 28 LEU HA H 5.999 -0.122 2.394 1.00 . A A . 28 LEU HA 1 1 10 6006 1 1 28 LEU HB2 H 4.723 0.088 5.148 1.00 . A A . 28 LEU HB2 1 1 10 6007 1 1 28 LEU HB3 H 5.931 1.216 4.561 1.00 . A A . 28 LEU HB3 1 1 10 6008 1 1 28 LEU HD11 H 5.589 2.618 2.728 1.00 . A A . 28 LEU HD11 1 1 10 6009 1 1 28 LEU HD12 H 4.687 1.626 1.556 1.00 . A A . 28 LEU HD12 1 1 10 6010 1 1 28 LEU HD13 H 3.938 3.076 2.260 1.00 . A A . 28 LEU HD13 1 1 10 6011 1 1 28 LEU HD21 H 2.553 -0.174 3.715 1.00 . A A . 28 LEU HD21 1 1 10 6012 1 1 28 LEU HD22 H 2.026 1.266 2.856 1.00 . A A . 28 LEU HD22 1 1 10 6013 1 1 28 LEU HD23 H 3.138 0.141 2.043 1.00 . A A . 28 LEU HD23 1 1 10 6014 1 1 28 LEU HG H 3.659 1.972 4.360 1.00 . A A . 28 LEU HG 1 1 10 6015 1 1 28 LEU N N 4.741 -1.597 3.195 1.00 . A A . 28 LEU N 1 1 10 6016 1 1 28 LEU O O 8.089 -0.787 3.522 1.00 . A A . 28 LEU O 1 1 10 6017 1 1 29 ALA C C 8.688 -3.334 5.295 1.00 . A A . 29 ALA C 1 1 10 6018 1 1 29 ALA CA C 8.008 -2.146 5.968 1.00 . A A . 29 ALA CA 1 1 10 6019 1 1 29 ALA CB C 7.564 -2.435 7.405 1.00 . A A . 29 ALA CB 1 1 10 6020 1 1 29 ALA H H 5.941 -1.992 5.476 1.00 . A A . 29 ALA H 1 1 10 6021 1 1 29 ALA HA H 8.727 -1.329 6.003 1.00 . A A . 29 ALA HA 1 1 10 6022 1 1 29 ALA HB1 H 8.411 -2.817 7.977 1.00 . A A . 29 ALA HB1 1 1 10 6023 1 1 29 ALA HB2 H 6.757 -3.166 7.419 1.00 . A A . 29 ALA HB2 1 1 10 6024 1 1 29 ALA HB3 H 7.217 -1.513 7.872 1.00 . A A . 29 ALA HB3 1 1 10 6025 1 1 29 ALA N N 6.867 -1.743 5.161 1.00 . A A . 29 ALA N 1 1 10 6026 1 1 29 ALA O O 9.714 -3.171 4.631 1.00 . A A . 29 ALA O 1 1 10 6027 1 1 30 GLY C C 8.178 -5.853 3.386 1.00 . A A . 30 GLY C 1 1 10 6028 1 1 30 GLY CA C 8.655 -5.724 4.821 1.00 . A A . 30 GLY CA 1 1 10 6029 1 1 30 GLY H H 7.237 -4.626 5.927 1.00 . A A . 30 GLY H 1 1 10 6030 1 1 30 GLY HA2 H 8.338 -6.595 5.394 1.00 . A A . 30 GLY HA2 1 1 10 6031 1 1 30 GLY HA3 H 9.741 -5.666 4.834 1.00 . A A . 30 GLY HA3 1 1 10 6032 1 1 30 GLY N N 8.109 -4.525 5.421 1.00 . A A . 30 GLY N 1 1 10 6033 1 1 30 GLY O O 7.495 -6.831 3.075 1.00 . A A . 30 GLY O 1 1 10 6034 1 1 31 TYR C C 8.933 -5.205 0.031 1.00 . A A . 31 TYR C 1 1 10 6035 1 1 31 TYR CA C 7.962 -4.846 1.175 1.00 . A A . 31 TYR CA 1 1 10 6036 1 1 31 TYR CB C 7.395 -3.417 1.003 1.00 . A A . 31 TYR CB 1 1 10 6037 1 1 31 TYR CD1 C 9.671 -2.358 0.455 1.00 . A A . 31 TYR CD1 1 1 10 6038 1 1 31 TYR CD2 C 7.647 -1.460 -0.532 1.00 . A A . 31 TYR CD2 1 1 10 6039 1 1 31 TYR CE1 C 10.425 -1.463 -0.328 1.00 . A A . 31 TYR CE1 1 1 10 6040 1 1 31 TYR CE2 C 8.385 -0.588 -1.341 1.00 . A A . 31 TYR CE2 1 1 10 6041 1 1 31 TYR CG C 8.267 -2.351 0.355 1.00 . A A . 31 TYR CG 1 1 10 6042 1 1 31 TYR CZ C 9.791 -0.598 -1.251 1.00 . A A . 31 TYR CZ 1 1 10 6043 1 1 31 TYR H H 9.131 -4.145 2.818 1.00 . A A . 31 TYR H 1 1 10 6044 1 1 31 TYR HA H 7.119 -5.510 1.109 1.00 . A A . 31 TYR HA 1 1 10 6045 1 1 31 TYR HB2 H 6.544 -3.555 0.347 1.00 . A A . 31 TYR HB2 1 1 10 6046 1 1 31 TYR HB3 H 7.009 -2.996 1.938 1.00 . A A . 31 TYR HB3 1 1 10 6047 1 1 31 TYR HD1 H 10.158 -3.151 1.018 1.00 . A A . 31 TYR HD1 1 1 10 6048 1 1 31 TYR HD2 H 6.584 -1.505 -0.641 1.00 . A A . 31 TYR HD2 1 1 10 6049 1 1 31 TYR HE1 H 11.496 -1.470 -0.257 1.00 . A A . 31 TYR HE1 1 1 10 6050 1 1 31 TYR HE2 H 7.860 0.120 -1.981 1.00 . A A . 31 TYR HE2 1 1 10 6051 1 1 31 TYR HH H 11.324 0.550 -1.768 1.00 . A A . 31 TYR HH 1 1 10 6052 1 1 31 TYR N N 8.534 -4.897 2.511 1.00 . A A . 31 TYR N 1 1 10 6053 1 1 31 TYR O O 8.844 -4.610 -1.045 1.00 . A A . 31 TYR O 1 1 10 6054 1 1 31 TYR OH O 10.514 0.137 -2.134 1.00 . A A . 31 TYR OH 1 1 10 6055 1 1 32 PRO C C 9.744 -7.040 -2.272 1.00 . A A . 32 PRO C 1 1 10 6056 1 1 32 PRO CA C 10.571 -6.590 -1.060 1.00 . A A . 32 PRO CA 1 1 10 6057 1 1 32 PRO CB C 11.556 -7.649 -0.573 1.00 . A A . 32 PRO CB 1 1 10 6058 1 1 32 PRO CD C 9.877 -7.252 1.129 1.00 . A A . 32 PRO CD 1 1 10 6059 1 1 32 PRO CG C 10.858 -8.299 0.620 1.00 . A A . 32 PRO CG 1 1 10 6060 1 1 32 PRO HA H 11.111 -5.667 -1.282 1.00 . A A . 32 PRO HA 1 1 10 6061 1 1 32 PRO HB2 H 11.791 -8.376 -1.350 1.00 . A A . 32 PRO HB2 1 1 10 6062 1 1 32 PRO HB3 H 12.468 -7.153 -0.236 1.00 . A A . 32 PRO HB3 1 1 10 6063 1 1 32 PRO HD2 H 8.923 -7.709 1.373 1.00 . A A . 32 PRO HD2 1 1 10 6064 1 1 32 PRO HD3 H 10.300 -6.734 1.990 1.00 . A A . 32 PRO HD3 1 1 10 6065 1 1 32 PRO HG2 H 10.321 -9.196 0.303 1.00 . A A . 32 PRO HG2 1 1 10 6066 1 1 32 PRO HG3 H 11.578 -8.518 1.401 1.00 . A A . 32 PRO HG3 1 1 10 6067 1 1 32 PRO N N 9.687 -6.311 0.056 1.00 . A A . 32 PRO N 1 1 10 6068 1 1 32 PRO O O 10.097 -6.752 -3.414 1.00 . A A . 32 PRO O 1 1 10 6069 1 1 33 ALA C C 6.495 -7.333 -3.323 1.00 . A A . 33 ALA C 1 1 10 6070 1 1 33 ALA CA C 7.696 -8.233 -3.005 1.00 . A A . 33 ALA CA 1 1 10 6071 1 1 33 ALA CB C 7.235 -9.600 -2.489 1.00 . A A . 33 ALA CB 1 1 10 6072 1 1 33 ALA H H 8.333 -7.742 -1.032 1.00 . A A . 33 ALA H 1 1 10 6073 1 1 33 ALA HA H 8.246 -8.381 -3.936 1.00 . A A . 33 ALA HA 1 1 10 6074 1 1 33 ALA HB1 H 6.488 -10.013 -3.163 1.00 . A A . 33 ALA HB1 1 1 10 6075 1 1 33 ALA HB2 H 8.084 -10.282 -2.435 1.00 . A A . 33 ALA HB2 1 1 10 6076 1 1 33 ALA HB3 H 6.794 -9.498 -1.498 1.00 . A A . 33 ALA HB3 1 1 10 6077 1 1 33 ALA N N 8.590 -7.662 -2.010 1.00 . A A . 33 ALA N 1 1 10 6078 1 1 33 ALA O O 5.672 -7.692 -4.164 1.00 . A A . 33 ALA O 1 1 10 6079 1 1 34 GLY C C 4.828 -4.871 -4.141 1.00 . A A . 34 GLY C 1 1 10 6080 1 1 34 GLY CA C 5.138 -5.374 -2.734 1.00 . A A . 34 GLY CA 1 1 10 6081 1 1 34 GLY H H 7.079 -5.881 -2.031 1.00 . A A . 34 GLY H 1 1 10 6082 1 1 34 GLY HA2 H 5.223 -4.532 -2.056 1.00 . A A . 34 GLY HA2 1 1 10 6083 1 1 34 GLY HA3 H 4.304 -5.988 -2.404 1.00 . A A . 34 GLY HA3 1 1 10 6084 1 1 34 GLY N N 6.356 -6.174 -2.671 1.00 . A A . 34 GLY N 1 1 10 6085 1 1 34 GLY O O 3.671 -4.910 -4.557 1.00 . A A . 34 GLY O 1 1 10 6086 1 1 35 CYS C C 5.251 -5.211 -7.205 1.00 . A A . 35 CYS C 1 1 10 6087 1 1 35 CYS CA C 5.759 -4.088 -6.303 1.00 . A A . 35 CYS CA 1 1 10 6088 1 1 35 CYS CB C 7.152 -3.726 -6.809 1.00 . A A . 35 CYS CB 1 1 10 6089 1 1 35 CYS H H 6.754 -4.378 -4.436 1.00 . A A . 35 CYS H 1 1 10 6090 1 1 35 CYS HA H 5.095 -3.229 -6.400 1.00 . A A . 35 CYS HA 1 1 10 6091 1 1 35 CYS HB2 H 7.734 -4.649 -6.819 1.00 . A A . 35 CYS HB2 1 1 10 6092 1 1 35 CYS HB3 H 7.080 -3.405 -7.847 1.00 . A A . 35 CYS HB3 1 1 10 6093 1 1 35 CYS N N 5.854 -4.480 -4.897 1.00 . A A . 35 CYS N 1 1 10 6094 1 1 35 CYS O O 4.926 -4.958 -8.362 1.00 . A A . 35 CYS O 1 1 10 6095 1 1 35 CYS SG S 8.003 -2.429 -5.870 1.00 . A A . 35 CYS SG 1 1 10 6096 1 1 36 SER C C 3.440 -8.117 -6.868 1.00 . A A . 36 SER C 1 1 10 6097 1 1 36 SER CA C 4.777 -7.616 -7.438 1.00 . A A . 36 SER CA 1 1 10 6098 1 1 36 SER CB C 5.884 -8.668 -7.359 1.00 . A A . 36 SER CB 1 1 10 6099 1 1 36 SER H H 5.524 -6.607 -5.758 1.00 . A A . 36 SER H 1 1 10 6100 1 1 36 SER HA H 4.656 -7.315 -8.472 1.00 . A A . 36 SER HA 1 1 10 6101 1 1 36 SER HB2 H 6.848 -8.161 -7.370 1.00 . A A . 36 SER HB2 1 1 10 6102 1 1 36 SER HB3 H 5.792 -9.218 -6.423 1.00 . A A . 36 SER HB3 1 1 10 6103 1 1 36 SER HG H 5.784 -9.035 -9.271 1.00 . A A . 36 SER HG 1 1 10 6104 1 1 36 SER N N 5.234 -6.449 -6.714 1.00 . A A . 36 SER N 1 1 10 6105 1 1 36 SER O O 2.745 -8.906 -7.503 1.00 . A A . 36 SER O 1 1 10 6106 1 1 36 SER OG O 5.839 -9.561 -8.449 1.00 . A A . 36 SER OG 1 1 10 6107 1 1 37 ASN C C 0.785 -6.966 -5.737 1.00 . A A . 37 ASN C 1 1 10 6108 1 1 37 ASN CA C 1.768 -7.908 -5.062 1.00 . A A . 37 ASN CA 1 1 10 6109 1 1 37 ASN CB C 1.832 -7.644 -3.540 1.00 . A A . 37 ASN CB 1 1 10 6110 1 1 37 ASN CG C 1.198 -8.786 -2.784 1.00 . A A . 37 ASN CG 1 1 10 6111 1 1 37 ASN H H 3.657 -6.965 -5.235 1.00 . A A . 37 ASN H 1 1 10 6112 1 1 37 ASN HA H 1.481 -8.944 -5.249 1.00 . A A . 37 ASN HA 1 1 10 6113 1 1 37 ASN HB2 H 2.854 -7.489 -3.202 1.00 . A A . 37 ASN HB2 1 1 10 6114 1 1 37 ASN HB3 H 1.310 -6.734 -3.268 1.00 . A A . 37 ASN HB3 1 1 10 6115 1 1 37 ASN HD21 H -0.594 -7.825 -2.602 1.00 . A A . 37 ASN HD21 1 1 10 6116 1 1 37 ASN HD22 H -0.576 -9.489 -2.091 1.00 . A A . 37 ASN HD22 1 1 10 6117 1 1 37 ASN N N 3.059 -7.651 -5.675 1.00 . A A . 37 ASN N 1 1 10 6118 1 1 37 ASN ND2 N -0.078 -8.678 -2.456 1.00 . A A . 37 ASN ND2 1 1 10 6119 1 1 37 ASN O O 0.744 -5.802 -5.348 1.00 . A A . 37 ASN O 1 1 10 6120 1 1 37 ASN OD1 O 1.854 -9.784 -2.488 1.00 . A A . 37 ASN OD1 1 1 10 6121 1 1 38 SER C C -1.720 -5.639 -6.673 1.00 . A A . 38 SER C 1 1 10 6122 1 1 38 SER CA C -0.804 -6.499 -7.563 1.00 . A A . 38 SER CA 1 1 10 6123 1 1 38 SER CB C -1.614 -7.349 -8.553 1.00 . A A . 38 SER CB 1 1 10 6124 1 1 38 SER H H 0.044 -8.378 -6.981 1.00 . A A . 38 SER H 1 1 10 6125 1 1 38 SER HA H -0.143 -5.827 -8.133 1.00 . A A . 38 SER HA 1 1 10 6126 1 1 38 SER HB2 H -0.957 -8.087 -9.014 1.00 . A A . 38 SER HB2 1 1 10 6127 1 1 38 SER HB3 H -2.409 -7.874 -8.024 1.00 . A A . 38 SER HB3 1 1 10 6128 1 1 38 SER HG H -1.380 -6.165 -10.057 1.00 . A A . 38 SER HG 1 1 10 6129 1 1 38 SER N N 0.040 -7.387 -6.760 1.00 . A A . 38 SER N 1 1 10 6130 1 1 38 SER O O -1.902 -4.454 -6.965 1.00 . A A . 38 SER O 1 1 10 6131 1 1 38 SER OG O -2.157 -6.550 -9.589 1.00 . A A . 38 SER OG 1 1 10 6132 1 1 39 ASP C C -2.318 -4.268 -3.958 1.00 . A A . 39 ASP C 1 1 10 6133 1 1 39 ASP CA C -3.056 -5.450 -4.600 1.00 . A A . 39 ASP CA 1 1 10 6134 1 1 39 ASP CB C -3.592 -6.406 -3.525 1.00 . A A . 39 ASP CB 1 1 10 6135 1 1 39 ASP CG C -4.361 -5.694 -2.403 1.00 . A A . 39 ASP CG 1 1 10 6136 1 1 39 ASP H H -2.067 -7.174 -5.404 1.00 . A A . 39 ASP H 1 1 10 6137 1 1 39 ASP HA H -3.908 -5.050 -5.139 1.00 . A A . 39 ASP HA 1 1 10 6138 1 1 39 ASP HB2 H -4.258 -7.124 -3.999 1.00 . A A . 39 ASP HB2 1 1 10 6139 1 1 39 ASP HB3 H -2.757 -6.960 -3.093 1.00 . A A . 39 ASP HB3 1 1 10 6140 1 1 39 ASP N N -2.223 -6.186 -5.559 1.00 . A A . 39 ASP N 1 1 10 6141 1 1 39 ASP O O -2.926 -3.225 -3.736 1.00 . A A . 39 ASP O 1 1 10 6142 1 1 39 ASP OD1 O -5.501 -5.230 -2.615 1.00 . A A . 39 ASP OD1 1 1 10 6143 1 1 39 ASP OD2 O -3.842 -5.668 -1.264 1.00 . A A . 39 ASP OD2 1 1 10 6144 1 1 40 CYS C C 0.606 -2.540 -4.220 1.00 . A A . 40 CYS C 1 1 10 6145 1 1 40 CYS CA C -0.166 -3.315 -3.154 1.00 . A A . 40 CYS CA 1 1 10 6146 1 1 40 CYS CB C 0.797 -3.894 -2.100 1.00 . A A . 40 CYS CB 1 1 10 6147 1 1 40 CYS H H -0.524 -5.160 -4.146 1.00 . A A . 40 CYS H 1 1 10 6148 1 1 40 CYS HA H -0.804 -2.590 -2.651 1.00 . A A . 40 CYS HA 1 1 10 6149 1 1 40 CYS HB2 H 1.330 -4.765 -2.492 1.00 . A A . 40 CYS HB2 1 1 10 6150 1 1 40 CYS HB3 H 1.556 -3.147 -1.845 1.00 . A A . 40 CYS HB3 1 1 10 6151 1 1 40 CYS N N -1.005 -4.375 -3.724 1.00 . A A . 40 CYS N 1 1 10 6152 1 1 40 CYS O O 1.149 -1.484 -3.919 1.00 . A A . 40 CYS O 1 1 10 6153 1 1 40 CYS SG S -0.109 -4.288 -0.582 1.00 . A A . 40 CYS SG 1 1 10 6154 1 1 41 THR C C 1.148 -1.082 -6.829 1.00 . A A . 41 THR C 1 1 10 6155 1 1 41 THR CA C 1.507 -2.526 -6.502 1.00 . A A . 41 THR CA 1 1 10 6156 1 1 41 THR CB C 1.369 -3.474 -7.692 1.00 . A A . 41 THR CB 1 1 10 6157 1 1 41 THR CG2 C 1.960 -3.003 -9.005 1.00 . A A . 41 THR CG2 1 1 10 6158 1 1 41 THR H H 0.168 -3.898 -5.641 1.00 . A A . 41 THR H 1 1 10 6159 1 1 41 THR HA H 2.542 -2.538 -6.151 1.00 . A A . 41 THR HA 1 1 10 6160 1 1 41 THR HB H 0.309 -3.648 -7.866 1.00 . A A . 41 THR HB 1 1 10 6161 1 1 41 THR HG1 H 1.783 -4.928 -6.469 1.00 . A A . 41 THR HG1 1 1 10 6162 1 1 41 THR HG21 H 1.535 -2.045 -9.298 1.00 . A A . 41 THR HG21 1 1 10 6163 1 1 41 THR HG22 H 3.041 -2.919 -8.929 1.00 . A A . 41 THR HG22 1 1 10 6164 1 1 41 THR HG23 H 1.694 -3.753 -9.742 1.00 . A A . 41 THR HG23 1 1 10 6165 1 1 41 THR N N 0.655 -3.034 -5.450 1.00 . A A . 41 THR N 1 1 10 6166 1 1 41 THR O O 2.031 -0.240 -6.760 1.00 . A A . 41 THR O 1 1 10 6167 1 1 41 THR OG1 O 1.999 -4.703 -7.392 1.00 . A A . 41 THR OG1 1 1 10 6168 1 1 42 ALA C C -0.264 1.580 -6.380 1.00 . A A . 42 ALA C 1 1 10 6169 1 1 42 ALA CA C -0.424 0.618 -7.562 1.00 . A A . 42 ALA CA 1 1 10 6170 1 1 42 ALA CB C -1.813 0.710 -8.192 1.00 . A A . 42 ALA CB 1 1 10 6171 1 1 42 ALA H H -0.839 -1.445 -7.108 1.00 . A A . 42 ALA H 1 1 10 6172 1 1 42 ALA HA H 0.290 0.928 -8.327 1.00 . A A . 42 ALA HA 1 1 10 6173 1 1 42 ALA HB1 H -1.822 0.193 -9.151 1.00 . A A . 42 ALA HB1 1 1 10 6174 1 1 42 ALA HB2 H -2.075 1.761 -8.350 1.00 . A A . 42 ALA HB2 1 1 10 6175 1 1 42 ALA HB3 H -2.543 0.256 -7.537 1.00 . A A . 42 ALA HB3 1 1 10 6176 1 1 42 ALA N N -0.105 -0.755 -7.171 1.00 . A A . 42 ALA N 1 1 10 6177 1 1 42 ALA O O 0.210 2.695 -6.578 1.00 . A A . 42 ALA O 1 1 10 6178 1 1 43 PHE C C 1.217 2.257 -3.926 1.00 . A A . 43 PHE C 1 1 10 6179 1 1 43 PHE CA C -0.270 1.921 -3.948 1.00 . A A . 43 PHE CA 1 1 10 6180 1 1 43 PHE CB C -0.713 1.155 -2.690 1.00 . A A . 43 PHE CB 1 1 10 6181 1 1 43 PHE CD1 C 1.006 1.630 -0.898 1.00 . A A . 43 PHE CD1 1 1 10 6182 1 1 43 PHE CD2 C -1.272 2.315 -0.491 1.00 . A A . 43 PHE CD2 1 1 10 6183 1 1 43 PHE CE1 C 1.396 2.134 0.347 1.00 . A A . 43 PHE CE1 1 1 10 6184 1 1 43 PHE CE2 C -0.902 2.777 0.783 1.00 . A A . 43 PHE CE2 1 1 10 6185 1 1 43 PHE CG C -0.317 1.749 -1.349 1.00 . A A . 43 PHE CG 1 1 10 6186 1 1 43 PHE CZ C 0.438 2.700 1.195 1.00 . A A . 43 PHE CZ 1 1 10 6187 1 1 43 PHE H H -0.960 0.216 -5.058 1.00 . A A . 43 PHE H 1 1 10 6188 1 1 43 PHE HA H -0.815 2.862 -4.008 1.00 . A A . 43 PHE HA 1 1 10 6189 1 1 43 PHE HB2 H -1.796 1.044 -2.731 1.00 . A A . 43 PHE HB2 1 1 10 6190 1 1 43 PHE HB3 H -0.274 0.161 -2.703 1.00 . A A . 43 PHE HB3 1 1 10 6191 1 1 43 PHE HD1 H 1.735 1.138 -1.505 1.00 . A A . 43 PHE HD1 1 1 10 6192 1 1 43 PHE HD2 H -2.295 2.386 -0.804 1.00 . A A . 43 PHE HD2 1 1 10 6193 1 1 43 PHE HE1 H 2.427 2.079 0.653 1.00 . A A . 43 PHE HE1 1 1 10 6194 1 1 43 PHE HE2 H -1.643 3.223 1.429 1.00 . A A . 43 PHE HE2 1 1 10 6195 1 1 43 PHE HZ H 0.755 3.074 2.153 1.00 . A A . 43 PHE HZ 1 1 10 6196 1 1 43 PHE N N -0.569 1.148 -5.151 1.00 . A A . 43 PHE N 1 1 10 6197 1 1 43 PHE O O 1.590 3.424 -3.843 1.00 . A A . 43 PHE O 1 1 10 6198 1 1 44 LEU C C 4.111 2.175 -5.100 1.00 . A A . 44 LEU C 1 1 10 6199 1 1 44 LEU CA C 3.516 1.460 -3.890 1.00 . A A . 44 LEU CA 1 1 10 6200 1 1 44 LEU CB C 4.209 0.119 -3.675 1.00 . A A . 44 LEU CB 1 1 10 6201 1 1 44 LEU CD1 C 4.443 -1.951 -2.355 1.00 . A A . 44 LEU CD1 1 1 10 6202 1 1 44 LEU CD2 C 4.206 0.254 -1.101 1.00 . A A . 44 LEU CD2 1 1 10 6203 1 1 44 LEU CG C 3.824 -0.558 -2.347 1.00 . A A . 44 LEU CG 1 1 10 6204 1 1 44 LEU H H 1.737 0.287 -3.898 1.00 . A A . 44 LEU H 1 1 10 6205 1 1 44 LEU HA H 3.678 2.105 -3.034 1.00 . A A . 44 LEU HA 1 1 10 6206 1 1 44 LEU HB2 H 3.945 -0.542 -4.503 1.00 . A A . 44 LEU HB2 1 1 10 6207 1 1 44 LEU HB3 H 5.284 0.283 -3.719 1.00 . A A . 44 LEU HB3 1 1 10 6208 1 1 44 LEU HD11 H 5.496 -1.894 -2.619 1.00 . A A . 44 LEU HD11 1 1 10 6209 1 1 44 LEU HD12 H 4.337 -2.428 -1.386 1.00 . A A . 44 LEU HD12 1 1 10 6210 1 1 44 LEU HD13 H 3.924 -2.548 -3.102 1.00 . A A . 44 LEU HD13 1 1 10 6211 1 1 44 LEU HD21 H 3.929 1.301 -1.176 1.00 . A A . 44 LEU HD21 1 1 10 6212 1 1 44 LEU HD22 H 3.649 -0.135 -0.251 1.00 . A A . 44 LEU HD22 1 1 10 6213 1 1 44 LEU HD23 H 5.270 0.181 -0.914 1.00 . A A . 44 LEU HD23 1 1 10 6214 1 1 44 LEU HG H 2.749 -0.704 -2.296 1.00 . A A . 44 LEU HG 1 1 10 6215 1 1 44 LEU N N 2.083 1.246 -3.985 1.00 . A A . 44 LEU N 1 1 10 6216 1 1 44 LEU O O 5.087 2.908 -4.954 1.00 . A A . 44 LEU O 1 1 10 6217 1 1 45 SER C C 3.626 4.247 -7.237 1.00 . A A . 45 SER C 1 1 10 6218 1 1 45 SER CA C 3.850 2.747 -7.476 1.00 . A A . 45 SER CA 1 1 10 6219 1 1 45 SER CB C 2.938 2.165 -8.552 1.00 . A A . 45 SER CB 1 1 10 6220 1 1 45 SER H H 2.777 1.350 -6.375 1.00 . A A . 45 SER H 1 1 10 6221 1 1 45 SER HA H 4.897 2.583 -7.737 1.00 . A A . 45 SER HA 1 1 10 6222 1 1 45 SER HB2 H 1.924 2.120 -8.173 1.00 . A A . 45 SER HB2 1 1 10 6223 1 1 45 SER HB3 H 2.914 2.805 -9.410 1.00 . A A . 45 SER HB3 1 1 10 6224 1 1 45 SER HG H 3.529 0.356 -8.146 1.00 . A A . 45 SER HG 1 1 10 6225 1 1 45 SER N N 3.522 2.024 -6.275 1.00 . A A . 45 SER N 1 1 10 6226 1 1 45 SER O O 4.468 5.049 -7.641 1.00 . A A . 45 SER O 1 1 10 6227 1 1 45 SER OG O 3.366 0.874 -8.955 1.00 . A A . 45 SER OG 1 1 10 6228 1 1 46 GLN C C 3.551 6.195 -4.912 1.00 . A A . 46 GLN C 1 1 10 6229 1 1 46 GLN CA C 2.467 6.005 -5.990 1.00 . A A . 46 GLN CA 1 1 10 6230 1 1 46 GLN CB C 1.049 6.333 -5.474 1.00 . A A . 46 GLN CB 1 1 10 6231 1 1 46 GLN CD C -0.089 6.958 -7.735 1.00 . A A . 46 GLN CD 1 1 10 6232 1 1 46 GLN CG C -0.115 6.113 -6.461 1.00 . A A . 46 GLN CG 1 1 10 6233 1 1 46 GLN H H 1.884 3.963 -6.202 1.00 . A A . 46 GLN H 1 1 10 6234 1 1 46 GLN HA H 2.688 6.702 -6.800 1.00 . A A . 46 GLN HA 1 1 10 6235 1 1 46 GLN HB2 H 0.842 5.736 -4.587 1.00 . A A . 46 GLN HB2 1 1 10 6236 1 1 46 GLN HB3 H 1.034 7.377 -5.163 1.00 . A A . 46 GLN HB3 1 1 10 6237 1 1 46 GLN HE21 H -1.342 5.673 -8.745 1.00 . A A . 46 GLN HE21 1 1 10 6238 1 1 46 GLN HE22 H -1.104 7.209 -9.479 1.00 . A A . 46 GLN HE22 1 1 10 6239 1 1 46 GLN HG2 H -0.161 5.066 -6.740 1.00 . A A . 46 GLN HG2 1 1 10 6240 1 1 46 GLN HG3 H -1.039 6.352 -5.937 1.00 . A A . 46 GLN HG3 1 1 10 6241 1 1 46 GLN N N 2.566 4.647 -6.517 1.00 . A A . 46 GLN N 1 1 10 6242 1 1 46 GLN NE2 N -0.808 6.547 -8.769 1.00 . A A . 46 GLN NE2 1 1 10 6243 1 1 46 GLN O O 4.524 6.912 -5.155 1.00 . A A . 46 GLN O 1 1 10 6244 1 1 46 GLN OE1 O 0.581 7.980 -7.840 1.00 . A A . 46 GLN OE1 1 1 10 6245 1 1 47 CYS C C 5.667 5.804 -2.641 1.00 . A A . 47 CYS C 1 1 10 6246 1 1 47 CYS CA C 4.142 5.903 -2.524 1.00 . A A . 47 CYS CA 1 1 10 6247 1 1 47 CYS CB C 3.636 5.100 -1.306 1.00 . A A . 47 CYS CB 1 1 10 6248 1 1 47 CYS H H 2.630 4.915 -3.667 1.00 . A A . 47 CYS H 1 1 10 6249 1 1 47 CYS HA H 3.899 6.953 -2.346 1.00 . A A . 47 CYS HA 1 1 10 6250 1 1 47 CYS HB2 H 2.613 4.771 -1.498 1.00 . A A . 47 CYS HB2 1 1 10 6251 1 1 47 CYS HB3 H 4.267 4.214 -1.122 1.00 . A A . 47 CYS HB3 1 1 10 6252 1 1 47 CYS N N 3.429 5.537 -3.750 1.00 . A A . 47 CYS N 1 1 10 6253 1 1 47 CYS O O 6.378 6.705 -2.199 1.00 . A A . 47 CYS O 1 1 10 6254 1 1 47 CYS SG S 3.613 6.119 0.201 1.00 . A A . 47 CYS SG 1 1 10 6255 1 1 48 TYR C C 8.131 5.015 -4.785 1.00 . A A . 48 TYR C 1 1 10 6256 1 1 48 TYR CA C 7.638 4.536 -3.419 1.00 . A A . 48 TYR CA 1 1 10 6257 1 1 48 TYR CB C 7.988 3.068 -3.244 1.00 . A A . 48 TYR CB 1 1 10 6258 1 1 48 TYR CD1 C 9.470 2.842 -1.203 1.00 . A A . 48 TYR CD1 1 1 10 6259 1 1 48 TYR CD2 C 7.103 2.305 -1.025 1.00 . A A . 48 TYR CD2 1 1 10 6260 1 1 48 TYR CE1 C 9.680 2.407 0.115 1.00 . A A . 48 TYR CE1 1 1 10 6261 1 1 48 TYR CE2 C 7.318 1.813 0.267 1.00 . A A . 48 TYR CE2 1 1 10 6262 1 1 48 TYR CG C 8.194 2.739 -1.787 1.00 . A A . 48 TYR CG 1 1 10 6263 1 1 48 TYR CZ C 8.611 1.843 0.837 1.00 . A A . 48 TYR CZ 1 1 10 6264 1 1 48 TYR H H 5.580 4.059 -3.654 1.00 . A A . 48 TYR H 1 1 10 6265 1 1 48 TYR HA H 8.197 5.032 -2.632 1.00 . A A . 48 TYR HA 1 1 10 6266 1 1 48 TYR HB2 H 7.217 2.425 -3.669 1.00 . A A . 48 TYR HB2 1 1 10 6267 1 1 48 TYR HB3 H 8.909 2.857 -3.784 1.00 . A A . 48 TYR HB3 1 1 10 6268 1 1 48 TYR HD1 H 10.309 3.203 -1.776 1.00 . A A . 48 TYR HD1 1 1 10 6269 1 1 48 TYR HD2 H 6.121 2.267 -1.467 1.00 . A A . 48 TYR HD2 1 1 10 6270 1 1 48 TYR HE1 H 10.674 2.449 0.540 1.00 . A A . 48 TYR HE1 1 1 10 6271 1 1 48 TYR HE2 H 6.489 1.354 0.761 1.00 . A A . 48 TYR HE2 1 1 10 6272 1 1 48 TYR HH H 8.538 0.436 2.202 1.00 . A A . 48 TYR HH 1 1 10 6273 1 1 48 TYR N N 6.200 4.736 -3.227 1.00 . A A . 48 TYR N 1 1 10 6274 1 1 48 TYR O O 9.339 5.121 -4.986 1.00 . A A . 48 TYR O 1 1 10 6275 1 1 48 TYR OH O 8.834 1.356 2.087 1.00 . A A . 48 TYR OH 1 1 10 6276 1 1 49 GLY C C 7.684 3.938 -7.816 1.00 . A A . 49 GLY C 1 1 10 6277 1 1 49 GLY CA C 7.568 5.317 -7.152 1.00 . A A . 49 GLY CA 1 1 10 6278 1 1 49 GLY H H 6.252 5.063 -5.513 1.00 . A A . 49 GLY H 1 1 10 6279 1 1 49 GLY HA2 H 8.518 5.838 -7.258 1.00 . A A . 49 GLY HA2 1 1 10 6280 1 1 49 GLY HA3 H 6.815 5.902 -7.673 1.00 . A A . 49 GLY HA3 1 1 10 6281 1 1 49 GLY N N 7.223 5.212 -5.741 1.00 . A A . 49 GLY N 1 1 10 6282 1 1 49 GLY O O 7.789 3.863 -9.037 1.00 . A A . 49 GLY O 1 1 10 6283 1 1 50 GLY C C 9.277 1.099 -7.462 1.00 . A A . 50 GLY C 1 1 10 6284 1 1 50 GLY CA C 7.795 1.481 -7.491 1.00 . A A . 50 GLY CA 1 1 10 6285 1 1 50 GLY H H 7.459 3.001 -6.054 1.00 . A A . 50 GLY H 1 1 10 6286 1 1 50 GLY HA2 H 7.409 1.375 -8.504 1.00 . A A . 50 GLY HA2 1 1 10 6287 1 1 50 GLY HA3 H 7.228 0.821 -6.836 1.00 . A A . 50 GLY HA3 1 1 10 6288 1 1 50 GLY N N 7.614 2.851 -7.036 1.00 . A A . 50 GLY N 1 1 10 6289 1 1 50 GLY O O 10.043 1.557 -8.309 1.00 . A A . 50 GLY O 1 1 10 6290 1 1 51 CYS C C 11.993 -0.258 -7.202 1.00 . A A . 51 CYS C 1 1 10 6291 1 1 51 CYS CA C 10.971 -0.160 -6.069 1.00 . A A . 51 CYS CA 1 1 10 6292 1 1 51 CYS CB C 10.876 -1.478 -5.284 1.00 . A A . 51 CYS CB 1 1 10 6293 1 1 51 CYS H H 8.894 -0.090 -5.896 1.00 . A A . 51 CYS H 1 1 10 6294 1 1 51 CYS HA H 11.333 0.598 -5.373 1.00 . A A . 51 CYS HA 1 1 10 6295 1 1 51 CYS HB2 H 11.900 -1.806 -5.105 1.00 . A A . 51 CYS HB2 1 1 10 6296 1 1 51 CYS HB3 H 10.426 -1.275 -4.314 1.00 . A A . 51 CYS HB3 1 1 10 6297 1 1 51 CYS N N 9.633 0.250 -6.490 1.00 . A A . 51 CYS N 1 1 10 6298 1 1 51 CYS O O 12.776 0.698 -7.362 1.00 . A A . 51 CYS O 1 1 10 6299 1 1 51 CYS OXT O 12.075 -1.298 -7.895 1.00 . A A . 51 CYS OXT 1 1 10 6300 1 1 51 CYS SG S 9.986 -2.869 -6.054 1.00 . A A . 51 CYS SG 1 1 11 6301 1 1 1 GLY C C -7.588 -6.614 -0.762 1.00 . A A . 1 GLY C 1 1 11 6302 1 1 1 GLY CA C -7.044 -7.208 -2.044 1.00 . A A . 1 GLY CA 1 1 11 6303 1 1 1 GLY H1 H -8.659 -8.421 -2.270 1.00 . A A . 1 GLY H1 1 1 11 6304 1 1 1 GLY H2 H -7.370 -8.830 -3.224 1.00 . A A . 1 GLY H2 1 1 11 6305 1 1 1 GLY H3 H -7.349 -9.174 -1.613 1.00 . A A . 1 GLY H3 1 1 11 6306 1 1 1 GLY HA2 H -7.251 -6.523 -2.863 1.00 . A A . 1 GLY HA2 1 1 11 6307 1 1 1 GLY HA3 H -5.965 -7.335 -1.962 1.00 . A A . 1 GLY HA3 1 1 11 6308 1 1 1 GLY N N -7.654 -8.510 -2.310 1.00 . A A . 1 GLY N 1 1 11 6309 1 1 1 GLY O O -8.760 -6.794 -0.431 1.00 . A A . 1 GLY O 1 1 11 6310 1 1 2 GLU C C -6.589 -3.605 0.772 1.00 . A A . 2 GLU C 1 1 11 6311 1 1 2 GLU CA C -7.035 -5.025 1.072 1.00 . A A . 2 GLU CA 1 1 11 6312 1 1 2 GLU CB C -6.387 -5.548 2.352 1.00 . A A . 2 GLU CB 1 1 11 6313 1 1 2 GLU CD C -4.411 -6.936 3.082 1.00 . A A . 2 GLU CD 1 1 11 6314 1 1 2 GLU CG C -4.871 -5.719 2.280 1.00 . A A . 2 GLU CG 1 1 11 6315 1 1 2 GLU H H -5.779 -5.840 -0.387 1.00 . A A . 2 GLU H 1 1 11 6316 1 1 2 GLU HA H -8.097 -5.024 1.250 1.00 . A A . 2 GLU HA 1 1 11 6317 1 1 2 GLU HB2 H -6.607 -4.846 3.157 1.00 . A A . 2 GLU HB2 1 1 11 6318 1 1 2 GLU HB3 H -6.833 -6.520 2.537 1.00 . A A . 2 GLU HB3 1 1 11 6319 1 1 2 GLU HG2 H -4.612 -5.850 1.237 1.00 . A A . 2 GLU HG2 1 1 11 6320 1 1 2 GLU HG3 H -4.379 -4.817 2.637 1.00 . A A . 2 GLU HG3 1 1 11 6321 1 1 2 GLU N N -6.733 -5.890 -0.055 1.00 . A A . 2 GLU N 1 1 11 6322 1 1 2 GLU O O -7.299 -2.651 1.082 1.00 . A A . 2 GLU O 1 1 11 6323 1 1 2 GLU OE1 O -4.297 -6.859 4.329 1.00 . A A . 2 GLU OE1 1 1 11 6324 1 1 2 GLU OE2 O -4.216 -8.015 2.475 1.00 . A A . 2 GLU OE2 1 1 11 6325 1 1 3 CYS C C -5.778 -1.575 -1.328 1.00 . A A . 3 CYS C 1 1 11 6326 1 1 3 CYS CA C -4.912 -2.168 -0.204 1.00 . A A . 3 CYS CA 1 1 11 6327 1 1 3 CYS CB C -3.458 -2.297 -0.609 1.00 . A A . 3 CYS CB 1 1 11 6328 1 1 3 CYS H H -4.934 -4.277 -0.225 1.00 . A A . 3 CYS H 1 1 11 6329 1 1 3 CYS HA H -4.933 -1.555 0.700 1.00 . A A . 3 CYS HA 1 1 11 6330 1 1 3 CYS HB2 H -2.926 -2.865 0.153 1.00 . A A . 3 CYS HB2 1 1 11 6331 1 1 3 CYS HB3 H -3.390 -2.831 -1.550 1.00 . A A . 3 CYS HB3 1 1 11 6332 1 1 3 CYS N N -5.422 -3.467 0.141 1.00 . A A . 3 CYS N 1 1 11 6333 1 1 3 CYS O O -6.084 -0.382 -1.321 1.00 . A A . 3 CYS O 1 1 11 6334 1 1 3 CYS SG S -2.706 -0.674 -0.744 1.00 . A A . 3 CYS SG 1 1 11 6335 1 1 4 GLU C C -8.490 -1.518 -2.643 1.00 . A A . 4 GLU C 1 1 11 6336 1 1 4 GLU CA C -7.216 -2.074 -3.286 1.00 . A A . 4 GLU CA 1 1 11 6337 1 1 4 GLU CB C -7.527 -3.297 -4.167 1.00 . A A . 4 GLU CB 1 1 11 6338 1 1 4 GLU CD C -6.622 -4.824 -5.990 1.00 . A A . 4 GLU CD 1 1 11 6339 1 1 4 GLU CG C -6.356 -3.606 -5.106 1.00 . A A . 4 GLU CG 1 1 11 6340 1 1 4 GLU H H -5.863 -3.374 -2.251 1.00 . A A . 4 GLU H 1 1 11 6341 1 1 4 GLU HA H -6.816 -1.281 -3.917 1.00 . A A . 4 GLU HA 1 1 11 6342 1 1 4 GLU HB2 H -7.732 -4.165 -3.535 1.00 . A A . 4 GLU HB2 1 1 11 6343 1 1 4 GLU HB3 H -8.408 -3.078 -4.772 1.00 . A A . 4 GLU HB3 1 1 11 6344 1 1 4 GLU HG2 H -6.166 -2.740 -5.741 1.00 . A A . 4 GLU HG2 1 1 11 6345 1 1 4 GLU HG3 H -5.462 -3.779 -4.509 1.00 . A A . 4 GLU HG3 1 1 11 6346 1 1 4 GLU N N -6.226 -2.423 -2.266 1.00 . A A . 4 GLU N 1 1 11 6347 1 1 4 GLU O O -8.956 -0.454 -3.044 1.00 . A A . 4 GLU O 1 1 11 6348 1 1 4 GLU OE1 O -7.321 -4.696 -7.019 1.00 . A A . 4 GLU OE1 1 1 11 6349 1 1 4 GLU OE2 O -6.083 -5.921 -5.712 1.00 . A A . 4 GLU OE2 1 1 11 6350 1 1 5 GLN C C -10.098 -0.359 -0.341 1.00 . A A . 5 GLN C 1 1 11 6351 1 1 5 GLN CA C -10.261 -1.745 -0.970 1.00 . A A . 5 GLN CA 1 1 11 6352 1 1 5 GLN CB C -10.728 -2.793 0.061 1.00 . A A . 5 GLN CB 1 1 11 6353 1 1 5 GLN CD C -13.232 -2.455 -0.362 1.00 . A A . 5 GLN CD 1 1 11 6354 1 1 5 GLN CG C -12.112 -2.514 0.675 1.00 . A A . 5 GLN CG 1 1 11 6355 1 1 5 GLN H H -8.605 -3.045 -1.308 1.00 . A A . 5 GLN H 1 1 11 6356 1 1 5 GLN HA H -11.011 -1.665 -1.756 1.00 . A A . 5 GLN HA 1 1 11 6357 1 1 5 GLN HB2 H -10.766 -3.769 -0.420 1.00 . A A . 5 GLN HB2 1 1 11 6358 1 1 5 GLN HB3 H -9.999 -2.851 0.870 1.00 . A A . 5 GLN HB3 1 1 11 6359 1 1 5 GLN HE21 H -12.909 -0.480 -0.764 1.00 . A A . 5 GLN HE21 1 1 11 6360 1 1 5 GLN HE22 H -14.052 -1.330 -1.805 1.00 . A A . 5 GLN HE22 1 1 11 6361 1 1 5 GLN HG2 H -12.346 -3.316 1.376 1.00 . A A . 5 GLN HG2 1 1 11 6362 1 1 5 GLN HG3 H -12.085 -1.585 1.240 1.00 . A A . 5 GLN HG3 1 1 11 6363 1 1 5 GLN N N -9.026 -2.182 -1.613 1.00 . A A . 5 GLN N 1 1 11 6364 1 1 5 GLN NE2 N -13.475 -1.300 -0.966 1.00 . A A . 5 GLN NE2 1 1 11 6365 1 1 5 GLN O O -11.065 0.409 -0.308 1.00 . A A . 5 GLN O 1 1 11 6366 1 1 5 GLN OE1 O -13.907 -3.443 -0.624 1.00 . A A . 5 GLN OE1 1 1 11 6367 1 1 6 CYS C C -8.595 2.342 -0.429 1.00 . A A . 6 CYS C 1 1 11 6368 1 1 6 CYS CA C -8.599 1.293 0.674 1.00 . A A . 6 CYS CA 1 1 11 6369 1 1 6 CYS CB C -7.261 1.287 1.401 1.00 . A A . 6 CYS CB 1 1 11 6370 1 1 6 CYS H H -8.158 -0.715 0.098 1.00 . A A . 6 CYS H 1 1 11 6371 1 1 6 CYS HA H -9.372 1.567 1.390 1.00 . A A . 6 CYS HA 1 1 11 6372 1 1 6 CYS HB2 H -7.251 0.452 2.096 1.00 . A A . 6 CYS HB2 1 1 11 6373 1 1 6 CYS HB3 H -6.438 1.168 0.696 1.00 . A A . 6 CYS HB3 1 1 11 6374 1 1 6 CYS N N -8.901 -0.028 0.149 1.00 . A A . 6 CYS N 1 1 11 6375 1 1 6 CYS O O -9.257 3.373 -0.283 1.00 . A A . 6 CYS O 1 1 11 6376 1 1 6 CYS SG S -7.039 2.822 2.321 1.00 . A A . 6 CYS SG 1 1 11 6377 1 1 7 PHE C C -9.230 3.233 -3.181 1.00 . A A . 7 PHE C 1 1 11 6378 1 1 7 PHE CA C -7.819 2.942 -2.682 1.00 . A A . 7 PHE CA 1 1 11 6379 1 1 7 PHE CB C -6.973 2.308 -3.798 1.00 . A A . 7 PHE CB 1 1 11 6380 1 1 7 PHE CD1 C -4.547 2.742 -3.259 1.00 . A A . 7 PHE CD1 1 1 11 6381 1 1 7 PHE CD2 C -5.616 4.070 -5.000 1.00 . A A . 7 PHE CD2 1 1 11 6382 1 1 7 PHE CE1 C -3.362 3.470 -3.453 1.00 . A A . 7 PHE CE1 1 1 11 6383 1 1 7 PHE CE2 C -4.427 4.799 -5.178 1.00 . A A . 7 PHE CE2 1 1 11 6384 1 1 7 PHE CG C -5.675 3.038 -4.043 1.00 . A A . 7 PHE CG 1 1 11 6385 1 1 7 PHE CZ C -3.289 4.484 -4.420 1.00 . A A . 7 PHE CZ 1 1 11 6386 1 1 7 PHE H H -7.358 1.193 -1.549 1.00 . A A . 7 PHE H 1 1 11 6387 1 1 7 PHE HA H -7.367 3.888 -2.387 1.00 . A A . 7 PHE HA 1 1 11 6388 1 1 7 PHE HB2 H -6.766 1.261 -3.575 1.00 . A A . 7 PHE HB2 1 1 11 6389 1 1 7 PHE HB3 H -7.540 2.320 -4.729 1.00 . A A . 7 PHE HB3 1 1 11 6390 1 1 7 PHE HD1 H -4.599 1.997 -2.473 1.00 . A A . 7 PHE HD1 1 1 11 6391 1 1 7 PHE HD2 H -6.499 4.342 -5.561 1.00 . A A . 7 PHE HD2 1 1 11 6392 1 1 7 PHE HE1 H -2.519 3.305 -2.807 1.00 . A A . 7 PHE HE1 1 1 11 6393 1 1 7 PHE HE2 H -4.393 5.641 -5.852 1.00 . A A . 7 PHE HE2 1 1 11 6394 1 1 7 PHE HZ H -2.381 5.064 -4.521 1.00 . A A . 7 PHE HZ 1 1 11 6395 1 1 7 PHE N N -7.869 2.070 -1.517 1.00 . A A . 7 PHE N 1 1 11 6396 1 1 7 PHE O O -9.558 4.380 -3.475 1.00 . A A . 7 PHE O 1 1 11 6397 1 1 8 SER C C -12.297 3.224 -2.972 1.00 . A A . 8 SER C 1 1 11 6398 1 1 8 SER CA C -11.406 2.275 -3.776 1.00 . A A . 8 SER CA 1 1 11 6399 1 1 8 SER CB C -11.972 0.856 -3.854 1.00 . A A . 8 SER CB 1 1 11 6400 1 1 8 SER H H -9.696 1.272 -3.036 1.00 . A A . 8 SER H 1 1 11 6401 1 1 8 SER HA H -11.318 2.676 -4.784 1.00 . A A . 8 SER HA 1 1 11 6402 1 1 8 SER HB2 H -11.179 0.187 -4.182 1.00 . A A . 8 SER HB2 1 1 11 6403 1 1 8 SER HB3 H -12.316 0.537 -2.868 1.00 . A A . 8 SER HB3 1 1 11 6404 1 1 8 SER HG H -12.724 1.222 -5.604 1.00 . A A . 8 SER HG 1 1 11 6405 1 1 8 SER N N -10.064 2.195 -3.248 1.00 . A A . 8 SER N 1 1 11 6406 1 1 8 SER O O -13.185 3.836 -3.569 1.00 . A A . 8 SER O 1 1 11 6407 1 1 8 SER OG O -13.019 0.757 -4.795 1.00 . A A . 8 SER OG 1 1 11 6408 1 1 9 ASP C C -12.056 5.820 -1.016 1.00 . A A . 9 ASP C 1 1 11 6409 1 1 9 ASP CA C -12.775 4.461 -0.903 1.00 . A A . 9 ASP CA 1 1 11 6410 1 1 9 ASP CB C -12.939 3.979 0.549 1.00 . A A . 9 ASP CB 1 1 11 6411 1 1 9 ASP CG C -14.073 4.719 1.261 1.00 . A A . 9 ASP CG 1 1 11 6412 1 1 9 ASP H H -11.256 2.985 -1.242 1.00 . A A . 9 ASP H 1 1 11 6413 1 1 9 ASP HA H -13.775 4.574 -1.325 1.00 . A A . 9 ASP HA 1 1 11 6414 1 1 9 ASP HB2 H -13.193 2.917 0.534 1.00 . A A . 9 ASP HB2 1 1 11 6415 1 1 9 ASP HB3 H -12.000 4.092 1.085 1.00 . A A . 9 ASP HB3 1 1 11 6416 1 1 9 ASP N N -12.052 3.439 -1.673 1.00 . A A . 9 ASP N 1 1 11 6417 1 1 9 ASP O O -12.070 6.653 -0.109 1.00 . A A . 9 ASP O 1 1 11 6418 1 1 9 ASP OD1 O -15.255 4.381 1.008 1.00 . A A . 9 ASP OD1 1 1 11 6419 1 1 9 ASP OD2 O -13.868 5.659 2.060 1.00 . A A . 9 ASP OD2 1 1 11 6420 1 1 10 GLY C C -9.606 7.572 -1.604 1.00 . A A . 10 GLY C 1 1 11 6421 1 1 10 GLY CA C -10.776 7.309 -2.538 1.00 . A A . 10 GLY CA 1 1 11 6422 1 1 10 GLY H H -11.452 5.357 -2.883 1.00 . A A . 10 GLY H 1 1 11 6423 1 1 10 GLY HA2 H -11.460 8.149 -2.501 1.00 . A A . 10 GLY HA2 1 1 11 6424 1 1 10 GLY HA3 H -10.386 7.217 -3.550 1.00 . A A . 10 GLY HA3 1 1 11 6425 1 1 10 GLY N N -11.502 6.099 -2.199 1.00 . A A . 10 GLY N 1 1 11 6426 1 1 10 GLY O O -9.512 8.668 -1.048 1.00 . A A . 10 GLY O 1 1 11 6427 1 1 11 GLY C C -6.283 6.654 -1.574 1.00 . A A . 11 GLY C 1 1 11 6428 1 1 11 GLY CA C -7.488 6.747 -0.646 1.00 . A A . 11 GLY CA 1 1 11 6429 1 1 11 GLY H H -8.845 5.735 -1.937 1.00 . A A . 11 GLY H 1 1 11 6430 1 1 11 GLY HA2 H -7.429 5.963 0.108 1.00 . A A . 11 GLY HA2 1 1 11 6431 1 1 11 GLY HA3 H -7.480 7.711 -0.149 1.00 . A A . 11 GLY HA3 1 1 11 6432 1 1 11 GLY N N -8.726 6.591 -1.407 1.00 . A A . 11 GLY N 1 1 11 6433 1 1 11 GLY O O -6.430 6.150 -2.689 1.00 . A A . 11 GLY O 1 1 11 6434 1 1 12 ASP C C -2.862 6.213 -0.989 1.00 . A A . 12 ASP C 1 1 11 6435 1 1 12 ASP CA C -3.862 6.932 -1.902 1.00 . A A . 12 ASP CA 1 1 11 6436 1 1 12 ASP CB C -3.280 8.218 -2.531 1.00 . A A . 12 ASP CB 1 1 11 6437 1 1 12 ASP CG C -4.149 8.949 -3.561 1.00 . A A . 12 ASP CG 1 1 11 6438 1 1 12 ASP H H -5.038 7.519 -0.216 1.00 . A A . 12 ASP H 1 1 11 6439 1 1 12 ASP HA H -4.056 6.261 -2.728 1.00 . A A . 12 ASP HA 1 1 11 6440 1 1 12 ASP HB2 H -3.051 8.915 -1.735 1.00 . A A . 12 ASP HB2 1 1 11 6441 1 1 12 ASP HB3 H -2.347 7.942 -3.014 1.00 . A A . 12 ASP HB3 1 1 11 6442 1 1 12 ASP N N -5.109 7.142 -1.151 1.00 . A A . 12 ASP N 1 1 11 6443 1 1 12 ASP O O -2.961 5.007 -0.807 1.00 . A A . 12 ASP O 1 1 11 6444 1 1 12 ASP OD1 O -5.238 9.439 -3.184 1.00 . A A . 12 ASP OD1 1 1 11 6445 1 1 12 ASP OD2 O -3.727 9.171 -4.719 1.00 . A A . 12 ASP OD2 1 1 11 6446 1 1 13 CYS C C -1.141 6.731 1.973 1.00 . A A . 13 CYS C 1 1 11 6447 1 1 13 CYS CA C -0.895 6.377 0.512 1.00 . A A . 13 CYS CA 1 1 11 6448 1 1 13 CYS CB C 0.486 6.890 0.063 1.00 . A A . 13 CYS CB 1 1 11 6449 1 1 13 CYS H H -1.945 7.938 -0.496 1.00 . A A . 13 CYS H 1 1 11 6450 1 1 13 CYS HA H -0.890 5.296 0.416 1.00 . A A . 13 CYS HA 1 1 11 6451 1 1 13 CYS HB2 H 0.492 7.979 0.057 1.00 . A A . 13 CYS HB2 1 1 11 6452 1 1 13 CYS HB3 H 1.235 6.557 0.784 1.00 . A A . 13 CYS HB3 1 1 11 6453 1 1 13 CYS N N -1.959 6.943 -0.322 1.00 . A A . 13 CYS N 1 1 11 6454 1 1 13 CYS O O -1.334 5.874 2.838 1.00 . A A . 13 CYS O 1 1 11 6455 1 1 13 CYS SG S 1.000 6.331 -1.574 1.00 . A A . 13 CYS SG 1 1 11 6456 1 1 14 THR C C -2.531 8.452 4.245 1.00 . A A . 14 THR C 1 1 11 6457 1 1 14 THR CA C -1.168 8.614 3.574 1.00 . A A . 14 THR CA 1 1 11 6458 1 1 14 THR CB C -0.727 10.070 3.409 1.00 . A A . 14 THR CB 1 1 11 6459 1 1 14 THR CG2 C -0.671 10.869 4.709 1.00 . A A . 14 THR CG2 1 1 11 6460 1 1 14 THR H H -0.999 8.683 1.488 1.00 . A A . 14 THR H 1 1 11 6461 1 1 14 THR HA H -0.443 8.094 4.198 1.00 . A A . 14 THR HA 1 1 11 6462 1 1 14 THR HB H -1.419 10.548 2.714 1.00 . A A . 14 THR HB 1 1 11 6463 1 1 14 THR HG1 H 0.754 10.852 2.368 1.00 . A A . 14 THR HG1 1 1 11 6464 1 1 14 THR HG21 H -0.039 10.363 5.436 1.00 . A A . 14 THR HG21 1 1 11 6465 1 1 14 THR HG22 H -0.260 11.854 4.508 1.00 . A A . 14 THR HG22 1 1 11 6466 1 1 14 THR HG23 H -1.670 10.989 5.124 1.00 . A A . 14 THR HG23 1 1 11 6467 1 1 14 THR N N -1.126 8.028 2.247 1.00 . A A . 14 THR N 1 1 11 6468 1 1 14 THR O O -2.615 8.582 5.468 1.00 . A A . 14 THR O 1 1 11 6469 1 1 14 THR OG1 O 0.582 10.027 2.861 1.00 . A A . 14 THR OG1 1 1 11 6470 1 1 15 THR C C -5.136 6.184 3.804 1.00 . A A . 15 THR C 1 1 11 6471 1 1 15 THR CA C -4.856 7.682 4.074 1.00 . A A . 15 THR CA 1 1 11 6472 1 1 15 THR CB C -5.911 8.674 3.537 1.00 . A A . 15 THR CB 1 1 11 6473 1 1 15 THR CG2 C -6.347 8.405 2.097 1.00 . A A . 15 THR CG2 1 1 11 6474 1 1 15 THR H H -3.471 8.182 2.497 1.00 . A A . 15 THR H 1 1 11 6475 1 1 15 THR HA H -4.830 7.809 5.154 1.00 . A A . 15 THR HA 1 1 11 6476 1 1 15 THR HB H -5.467 9.667 3.538 1.00 . A A . 15 THR HB 1 1 11 6477 1 1 15 THR HG1 H -7.732 9.216 3.927 1.00 . A A . 15 THR HG1 1 1 11 6478 1 1 15 THR HG21 H -5.488 8.183 1.468 1.00 . A A . 15 THR HG21 1 1 11 6479 1 1 15 THR HG22 H -7.035 7.566 2.070 1.00 . A A . 15 THR HG22 1 1 11 6480 1 1 15 THR HG23 H -6.867 9.274 1.698 1.00 . A A . 15 THR HG23 1 1 11 6481 1 1 15 THR N N -3.577 8.099 3.501 1.00 . A A . 15 THR N 1 1 11 6482 1 1 15 THR O O -6.291 5.776 3.698 1.00 . A A . 15 THR O 1 1 11 6483 1 1 15 THR OG1 O -7.029 8.735 4.388 1.00 . A A . 15 THR OG1 1 1 11 6484 1 1 16 CYS C C -3.082 3.117 4.319 1.00 . A A . 16 CYS C 1 1 11 6485 1 1 16 CYS CA C -4.194 3.890 3.593 1.00 . A A . 16 CYS CA 1 1 11 6486 1 1 16 CYS CB C -4.187 3.608 2.077 1.00 . A A . 16 CYS CB 1 1 11 6487 1 1 16 CYS H H -3.157 5.702 3.887 1.00 . A A . 16 CYS H 1 1 11 6488 1 1 16 CYS HA H -5.126 3.520 4.026 1.00 . A A . 16 CYS HA 1 1 11 6489 1 1 16 CYS HB2 H -3.407 4.200 1.605 1.00 . A A . 16 CYS HB2 1 1 11 6490 1 1 16 CYS HB3 H -3.957 2.557 1.913 1.00 . A A . 16 CYS HB3 1 1 11 6491 1 1 16 CYS N N -4.097 5.337 3.817 1.00 . A A . 16 CYS N 1 1 11 6492 1 1 16 CYS O O -2.780 1.975 3.963 1.00 . A A . 16 CYS O 1 1 11 6493 1 1 16 CYS SG S -5.744 3.931 1.220 1.00 . A A . 16 CYS SG 1 1 11 6494 1 1 17 PHE C C -1.518 3.134 7.574 1.00 . A A . 17 PHE C 1 1 11 6495 1 1 17 PHE CA C -1.348 3.086 6.058 1.00 . A A . 17 PHE CA 1 1 11 6496 1 1 17 PHE CB C -0.029 3.757 5.626 1.00 . A A . 17 PHE CB 1 1 11 6497 1 1 17 PHE CD1 C 1.389 1.761 6.244 1.00 . A A . 17 PHE CD1 1 1 11 6498 1 1 17 PHE CD2 C 2.190 3.961 6.868 1.00 . A A . 17 PHE CD2 1 1 11 6499 1 1 17 PHE CE1 C 2.501 1.165 6.865 1.00 . A A . 17 PHE CE1 1 1 11 6500 1 1 17 PHE CE2 C 3.320 3.368 7.466 1.00 . A A . 17 PHE CE2 1 1 11 6501 1 1 17 PHE CG C 1.215 3.154 6.256 1.00 . A A . 17 PHE CG 1 1 11 6502 1 1 17 PHE CZ C 3.474 1.972 7.470 1.00 . A A . 17 PHE CZ 1 1 11 6503 1 1 17 PHE H H -2.815 4.608 5.647 1.00 . A A . 17 PHE H 1 1 11 6504 1 1 17 PHE HA H -1.304 2.028 5.794 1.00 . A A . 17 PHE HA 1 1 11 6505 1 1 17 PHE HB2 H 0.068 3.672 4.543 1.00 . A A . 17 PHE HB2 1 1 11 6506 1 1 17 PHE HB3 H -0.076 4.820 5.871 1.00 . A A . 17 PHE HB3 1 1 11 6507 1 1 17 PHE HD1 H 0.650 1.165 5.736 1.00 . A A . 17 PHE HD1 1 1 11 6508 1 1 17 PHE HD2 H 2.066 5.034 6.900 1.00 . A A . 17 PHE HD2 1 1 11 6509 1 1 17 PHE HE1 H 2.636 0.092 6.878 1.00 . A A . 17 PHE HE1 1 1 11 6510 1 1 17 PHE HE2 H 4.076 3.977 7.939 1.00 . A A . 17 PHE HE2 1 1 11 6511 1 1 17 PHE HZ H 4.328 1.512 7.950 1.00 . A A . 17 PHE HZ 1 1 11 6512 1 1 17 PHE N N -2.456 3.710 5.340 1.00 . A A . 17 PHE N 1 1 11 6513 1 1 17 PHE O O -0.985 2.265 8.269 1.00 . A A . 17 PHE O 1 1 11 6514 1 1 18 ASN C C -1.089 4.677 10.317 1.00 . A A . 18 ASN C 1 1 11 6515 1 1 18 ASN CA C -2.392 4.526 9.506 1.00 . A A . 18 ASN CA 1 1 11 6516 1 1 18 ASN CB C -3.395 3.552 10.128 1.00 . A A . 18 ASN CB 1 1 11 6517 1 1 18 ASN CG C -3.909 3.946 11.511 1.00 . A A . 18 ASN CG 1 1 11 6518 1 1 18 ASN H H -2.622 4.803 7.436 1.00 . A A . 18 ASN H 1 1 11 6519 1 1 18 ASN HA H -2.855 5.511 9.518 1.00 . A A . 18 ASN HA 1 1 11 6520 1 1 18 ASN HB2 H -4.248 3.430 9.465 1.00 . A A . 18 ASN HB2 1 1 11 6521 1 1 18 ASN HB3 H -2.879 2.603 10.194 1.00 . A A . 18 ASN HB3 1 1 11 6522 1 1 18 ASN HD21 H -4.375 2.026 11.927 1.00 . A A . 18 ASN HD21 1 1 11 6523 1 1 18 ASN HD22 H -4.513 3.153 13.271 1.00 . A A . 18 ASN HD22 1 1 11 6524 1 1 18 ASN N N -2.203 4.156 8.096 1.00 . A A . 18 ASN N 1 1 11 6525 1 1 18 ASN ND2 N -4.368 2.978 12.282 1.00 . A A . 18 ASN ND2 1 1 11 6526 1 1 18 ASN O O -1.109 5.088 11.474 1.00 . A A . 18 ASN O 1 1 11 6527 1 1 18 ASN OD1 O -3.939 5.114 11.897 1.00 . A A . 18 ASN OD1 1 1 11 6528 1 1 19 ASN C C 1.650 2.918 10.799 1.00 . A A . 19 ASN C 1 1 11 6529 1 1 19 ASN CA C 1.401 4.314 10.237 1.00 . A A . 19 ASN CA 1 1 11 6530 1 1 19 ASN CB C 1.834 5.464 11.153 1.00 . A A . 19 ASN CB 1 1 11 6531 1 1 19 ASN CG C 3.348 5.425 11.323 1.00 . A A . 19 ASN CG 1 1 11 6532 1 1 19 ASN H H -0.048 4.047 8.766 1.00 . A A . 19 ASN H 1 1 11 6533 1 1 19 ASN HA H 2.053 4.392 9.379 1.00 . A A . 19 ASN HA 1 1 11 6534 1 1 19 ASN HB2 H 1.527 6.412 10.711 1.00 . A A . 19 ASN HB2 1 1 11 6535 1 1 19 ASN HB3 H 1.362 5.361 12.132 1.00 . A A . 19 ASN HB3 1 1 11 6536 1 1 19 ASN HD21 H 3.712 6.081 9.420 1.00 . A A . 19 ASN HD21 1 1 11 6537 1 1 19 ASN HD22 H 5.114 5.755 10.407 1.00 . A A . 19 ASN HD22 1 1 11 6538 1 1 19 ASN N N 0.061 4.447 9.684 1.00 . A A . 19 ASN N 1 1 11 6539 1 1 19 ASN ND2 N 4.105 5.755 10.290 1.00 . A A . 19 ASN ND2 1 1 11 6540 1 1 19 ASN O O 1.911 2.736 11.988 1.00 . A A . 19 ASN O 1 1 11 6541 1 1 19 ASN OD1 O 3.874 5.119 12.386 1.00 . A A . 19 ASN OD1 1 1 11 6542 1 1 20 GLY C C 0.780 -0.188 10.906 1.00 . A A . 20 GLY C 1 1 11 6543 1 1 20 GLY CA C 1.912 0.538 10.190 1.00 . A A . 20 GLY CA 1 1 11 6544 1 1 20 GLY H H 1.351 2.145 8.945 1.00 . A A . 20 GLY H 1 1 11 6545 1 1 20 GLY HA2 H 2.823 0.515 10.783 1.00 . A A . 20 GLY HA2 1 1 11 6546 1 1 20 GLY HA3 H 2.113 0.019 9.256 1.00 . A A . 20 GLY HA3 1 1 11 6547 1 1 20 GLY N N 1.568 1.925 9.908 1.00 . A A . 20 GLY N 1 1 11 6548 1 1 20 GLY O O 1.027 -1.061 11.741 1.00 . A A . 20 GLY O 1 1 11 6549 1 1 21 THR C C -2.922 0.066 10.654 1.00 . A A . 21 THR C 1 1 11 6550 1 1 21 THR CA C -1.621 -0.028 11.476 1.00 . A A . 21 THR CA 1 1 11 6551 1 1 21 THR CB C -1.592 0.997 12.633 1.00 . A A . 21 THR CB 1 1 11 6552 1 1 21 THR CG2 C -0.508 0.719 13.669 1.00 . A A . 21 THR CG2 1 1 11 6553 1 1 21 THR H H -0.561 1.011 10.005 1.00 . A A . 21 THR H 1 1 11 6554 1 1 21 THR HA H -1.565 -1.039 11.885 1.00 . A A . 21 THR HA 1 1 11 6555 1 1 21 THR HB H -2.552 0.990 13.142 1.00 . A A . 21 THR HB 1 1 11 6556 1 1 21 THR HG1 H -1.120 2.854 12.912 1.00 . A A . 21 THR HG1 1 1 11 6557 1 1 21 THR HG21 H -0.431 -0.349 13.826 1.00 . A A . 21 THR HG21 1 1 11 6558 1 1 21 THR HG22 H 0.462 1.076 13.335 1.00 . A A . 21 THR HG22 1 1 11 6559 1 1 21 THR HG23 H -0.762 1.209 14.607 1.00 . A A . 21 THR HG23 1 1 11 6560 1 1 21 THR N N -0.456 0.229 10.639 1.00 . A A . 21 THR N 1 1 11 6561 1 1 21 THR O O -3.997 0.301 11.214 1.00 . A A . 21 THR O 1 1 11 6562 1 1 21 THR OG1 O -1.313 2.294 12.154 1.00 . A A . 21 THR OG1 1 1 11 6563 1 1 22 GLY C C -3.752 -0.772 7.199 1.00 . A A . 22 GLY C 1 1 11 6564 1 1 22 GLY CA C -3.874 0.233 8.344 1.00 . A A . 22 GLY CA 1 1 11 6565 1 1 22 GLY H H -1.950 -0.310 8.921 1.00 . A A . 22 GLY H 1 1 11 6566 1 1 22 GLY HA2 H -3.785 1.243 7.953 1.00 . A A . 22 GLY HA2 1 1 11 6567 1 1 22 GLY HA3 H -4.852 0.118 8.807 1.00 . A A . 22 GLY HA3 1 1 11 6568 1 1 22 GLY N N -2.821 0.001 9.323 1.00 . A A . 22 GLY N 1 1 11 6569 1 1 22 GLY O O -2.862 -1.621 7.234 1.00 . A A . 22 GLY O 1 1 11 6570 1 1 23 PRO C C -3.684 -2.296 4.565 1.00 . A A . 23 PRO C 1 1 11 6571 1 1 23 PRO CA C -4.928 -1.820 5.304 1.00 . A A . 23 PRO CA 1 1 11 6572 1 1 23 PRO CB C -6.027 -1.326 4.356 1.00 . A A . 23 PRO CB 1 1 11 6573 1 1 23 PRO CD C -5.281 0.509 5.735 1.00 . A A . 23 PRO CD 1 1 11 6574 1 1 23 PRO CG C -5.883 0.195 4.373 1.00 . A A . 23 PRO CG 1 1 11 6575 1 1 23 PRO HA H -5.321 -2.648 5.894 1.00 . A A . 23 PRO HA 1 1 11 6576 1 1 23 PRO HB2 H -5.927 -1.751 3.355 1.00 . A A . 23 PRO HB2 1 1 11 6577 1 1 23 PRO HB3 H -7.005 -1.582 4.759 1.00 . A A . 23 PRO HB3 1 1 11 6578 1 1 23 PRO HD2 H -4.563 1.319 5.651 1.00 . A A . 23 PRO HD2 1 1 11 6579 1 1 23 PRO HD3 H -6.061 0.805 6.421 1.00 . A A . 23 PRO HD3 1 1 11 6580 1 1 23 PRO HG2 H -5.199 0.515 3.586 1.00 . A A . 23 PRO HG2 1 1 11 6581 1 1 23 PRO HG3 H -6.851 0.682 4.277 1.00 . A A . 23 PRO HG3 1 1 11 6582 1 1 23 PRO N N -4.618 -0.699 6.178 1.00 . A A . 23 PRO N 1 1 11 6583 1 1 23 PRO O O -3.326 -3.470 4.661 1.00 . A A . 23 PRO O 1 1 11 6584 1 1 24 CYS C C -0.568 -2.000 3.857 1.00 . A A . 24 CYS C 1 1 11 6585 1 1 24 CYS CA C -1.853 -1.743 3.043 1.00 . A A . 24 CYS CA 1 1 11 6586 1 1 24 CYS CB C -1.598 -0.643 2.003 1.00 . A A . 24 CYS CB 1 1 11 6587 1 1 24 CYS H H -3.309 -0.418 3.885 1.00 . A A . 24 CYS H 1 1 11 6588 1 1 24 CYS HA H -2.093 -2.663 2.507 1.00 . A A . 24 CYS HA 1 1 11 6589 1 1 24 CYS HB2 H -1.065 0.178 2.472 1.00 . A A . 24 CYS HB2 1 1 11 6590 1 1 24 CYS HB3 H -0.974 -1.075 1.226 1.00 . A A . 24 CYS HB3 1 1 11 6591 1 1 24 CYS N N -2.997 -1.386 3.872 1.00 . A A . 24 CYS N 1 1 11 6592 1 1 24 CYS O O 0.495 -2.121 3.257 1.00 . A A . 24 CYS O 1 1 11 6593 1 1 24 CYS SG S -2.998 0.072 1.129 1.00 . A A . 24 CYS SG 1 1 11 6594 1 1 25 ALA C C 1.786 -2.661 5.767 1.00 . A A . 25 ALA C 1 1 11 6595 1 1 25 ALA CA C 0.573 -1.777 6.034 1.00 . A A . 25 ALA CA 1 1 11 6596 1 1 25 ALA CB C 0.196 -1.795 7.512 1.00 . A A . 25 ALA CB 1 1 11 6597 1 1 25 ALA H H -1.504 -1.999 5.650 1.00 . A A . 25 ALA H 1 1 11 6598 1 1 25 ALA HA H 0.907 -0.784 5.791 1.00 . A A . 25 ALA HA 1 1 11 6599 1 1 25 ALA HB1 H -0.332 -2.720 7.739 1.00 . A A . 25 ALA HB1 1 1 11 6600 1 1 25 ALA HB2 H -0.435 -0.933 7.733 1.00 . A A . 25 ALA HB2 1 1 11 6601 1 1 25 ALA HB3 H 1.101 -1.754 8.115 1.00 . A A . 25 ALA HB3 1 1 11 6602 1 1 25 ALA N N -0.600 -2.017 5.196 1.00 . A A . 25 ALA N 1 1 11 6603 1 1 25 ALA O O 2.896 -2.128 5.673 1.00 . A A . 25 ALA O 1 1 11 6604 1 1 26 ASN C C 3.507 -4.493 4.110 1.00 . A A . 26 ASN C 1 1 11 6605 1 1 26 ASN CA C 2.725 -4.875 5.374 1.00 . A A . 26 ASN CA 1 1 11 6606 1 1 26 ASN CB C 2.266 -6.341 5.282 1.00 . A A . 26 ASN CB 1 1 11 6607 1 1 26 ASN CG C 1.612 -6.678 3.942 1.00 . A A . 26 ASN CG 1 1 11 6608 1 1 26 ASN H H 0.667 -4.344 5.754 1.00 . A A . 26 ASN H 1 1 11 6609 1 1 26 ASN HA H 3.405 -4.768 6.221 1.00 . A A . 26 ASN HA 1 1 11 6610 1 1 26 ASN HB2 H 3.157 -6.964 5.380 1.00 . A A . 26 ASN HB2 1 1 11 6611 1 1 26 ASN HB3 H 1.606 -6.582 6.116 1.00 . A A . 26 ASN HB3 1 1 11 6612 1 1 26 ASN HD21 H -0.312 -6.205 4.560 1.00 . A A . 26 ASN HD21 1 1 11 6613 1 1 26 ASN HD22 H -0.088 -6.672 2.890 1.00 . A A . 26 ASN HD22 1 1 11 6614 1 1 26 ASN N N 1.597 -3.973 5.622 1.00 . A A . 26 ASN N 1 1 11 6615 1 1 26 ASN ND2 N 0.307 -6.500 3.806 1.00 . A A . 26 ASN ND2 1 1 11 6616 1 1 26 ASN O O 4.708 -4.756 4.030 1.00 . A A . 26 ASN O 1 1 11 6617 1 1 26 ASN OD1 O 2.260 -7.120 3.003 1.00 . A A . 26 ASN OD1 1 1 11 6618 1 1 27 CYS C C 4.446 -2.277 2.070 1.00 . A A . 27 CYS C 1 1 11 6619 1 1 27 CYS CA C 3.413 -3.388 1.895 1.00 . A A . 27 CYS CA 1 1 11 6620 1 1 27 CYS CB C 2.314 -3.016 0.894 1.00 . A A . 27 CYS CB 1 1 11 6621 1 1 27 CYS H H 1.891 -3.524 3.356 1.00 . A A . 27 CYS H 1 1 11 6622 1 1 27 CYS HA H 3.914 -4.229 1.426 1.00 . A A . 27 CYS HA 1 1 11 6623 1 1 27 CYS HB2 H 1.844 -2.061 1.134 1.00 . A A . 27 CYS HB2 1 1 11 6624 1 1 27 CYS HB3 H 2.786 -2.879 -0.075 1.00 . A A . 27 CYS HB3 1 1 11 6625 1 1 27 CYS N N 2.844 -3.817 3.163 1.00 . A A . 27 CYS N 1 1 11 6626 1 1 27 CYS O O 4.991 -1.828 1.076 1.00 . A A . 27 CYS O 1 1 11 6627 1 1 27 CYS SG S 1.083 -4.341 0.744 1.00 . A A . 27 CYS SG 1 1 11 6628 1 1 28 LEU C C 6.911 -1.288 4.190 1.00 . A A . 28 LEU C 1 1 11 6629 1 1 28 LEU CA C 5.694 -0.711 3.490 1.00 . A A . 28 LEU CA 1 1 11 6630 1 1 28 LEU CB C 5.048 0.369 4.361 1.00 . A A . 28 LEU CB 1 1 11 6631 1 1 28 LEU CD1 C 4.520 2.133 2.631 1.00 . A A . 28 LEU CD1 1 1 11 6632 1 1 28 LEU CD2 C 2.813 0.396 3.025 1.00 . A A . 28 LEU CD2 1 1 11 6633 1 1 28 LEU CG C 3.945 1.187 3.682 1.00 . A A . 28 LEU CG 1 1 11 6634 1 1 28 LEU H H 4.052 -1.888 4.030 1.00 . A A . 28 LEU H 1 1 11 6635 1 1 28 LEU HA H 6.011 -0.270 2.545 1.00 . A A . 28 LEU HA 1 1 11 6636 1 1 28 LEU HB2 H 4.629 -0.087 5.258 1.00 . A A . 28 LEU HB2 1 1 11 6637 1 1 28 LEU HB3 H 5.826 1.056 4.697 1.00 . A A . 28 LEU HB3 1 1 11 6638 1 1 28 LEU HD11 H 5.426 2.619 2.997 1.00 . A A . 28 LEU HD11 1 1 11 6639 1 1 28 LEU HD12 H 4.743 1.561 1.733 1.00 . A A . 28 LEU HD12 1 1 11 6640 1 1 28 LEU HD13 H 3.794 2.903 2.386 1.00 . A A . 28 LEU HD13 1 1 11 6641 1 1 28 LEU HD21 H 2.512 -0.426 3.668 1.00 . A A . 28 LEU HD21 1 1 11 6642 1 1 28 LEU HD22 H 1.952 1.039 2.894 1.00 . A A . 28 LEU HD22 1 1 11 6643 1 1 28 LEU HD23 H 3.142 0.014 2.051 1.00 . A A . 28 LEU HD23 1 1 11 6644 1 1 28 LEU HG H 3.498 1.747 4.482 1.00 . A A . 28 LEU HG 1 1 11 6645 1 1 28 LEU N N 4.719 -1.766 3.275 1.00 . A A . 28 LEU N 1 1 11 6646 1 1 28 LEU O O 8.030 -1.195 3.681 1.00 . A A . 28 LEU O 1 1 11 6647 1 1 29 ALA C C 8.545 -3.363 6.066 1.00 . A A . 29 ALA C 1 1 11 6648 1 1 29 ALA CA C 7.725 -2.117 6.366 1.00 . A A . 29 ALA CA 1 1 11 6649 1 1 29 ALA CB C 7.064 -2.254 7.732 1.00 . A A . 29 ALA CB 1 1 11 6650 1 1 29 ALA H H 5.730 -1.932 5.689 1.00 . A A . 29 ALA H 1 1 11 6651 1 1 29 ALA HA H 8.408 -1.267 6.394 1.00 . A A . 29 ALA HA 1 1 11 6652 1 1 29 ALA HB1 H 7.827 -2.327 8.505 1.00 . A A . 29 ALA HB1 1 1 11 6653 1 1 29 ALA HB2 H 6.430 -3.142 7.754 1.00 . A A . 29 ALA HB2 1 1 11 6654 1 1 29 ALA HB3 H 6.464 -1.369 7.911 1.00 . A A . 29 ALA HB3 1 1 11 6655 1 1 29 ALA N N 6.688 -1.846 5.381 1.00 . A A . 29 ALA N 1 1 11 6656 1 1 29 ALA O O 9.549 -3.601 6.740 1.00 . A A . 29 ALA O 1 1 11 6657 1 1 30 GLY C C 8.295 -5.608 3.251 1.00 . A A . 30 GLY C 1 1 11 6658 1 1 30 GLY CA C 8.895 -5.286 4.595 1.00 . A A . 30 GLY CA 1 1 11 6659 1 1 30 GLY H H 7.282 -3.933 4.597 1.00 . A A . 30 GLY H 1 1 11 6660 1 1 30 GLY HA2 H 8.788 -6.133 5.268 1.00 . A A . 30 GLY HA2 1 1 11 6661 1 1 30 GLY HA3 H 9.949 -5.024 4.489 1.00 . A A . 30 GLY HA3 1 1 11 6662 1 1 30 GLY N N 8.133 -4.164 5.094 1.00 . A A . 30 GLY N 1 1 11 6663 1 1 30 GLY O O 7.468 -6.518 3.166 1.00 . A A . 30 GLY O 1 1 11 6664 1 1 31 TYR C C 8.714 -5.429 -0.236 1.00 . A A . 31 TYR C 1 1 11 6665 1 1 31 TYR CA C 7.908 -4.894 0.966 1.00 . A A . 31 TYR CA 1 1 11 6666 1 1 31 TYR CB C 7.420 -3.450 0.762 1.00 . A A . 31 TYR CB 1 1 11 6667 1 1 31 TYR CD1 C 9.661 -2.576 -0.092 1.00 . A A . 31 TYR CD1 1 1 11 6668 1 1 31 TYR CD2 C 7.612 -1.475 -0.766 1.00 . A A . 31 TYR CD2 1 1 11 6669 1 1 31 TYR CE1 C 10.378 -1.691 -0.908 1.00 . A A . 31 TYR CE1 1 1 11 6670 1 1 31 TYR CE2 C 8.320 -0.527 -1.520 1.00 . A A . 31 TYR CE2 1 1 11 6671 1 1 31 TYR CG C 8.261 -2.501 -0.068 1.00 . A A . 31 TYR CG 1 1 11 6672 1 1 31 TYR CZ C 9.724 -0.647 -1.604 1.00 . A A . 31 TYR CZ 1 1 11 6673 1 1 31 TYR H H 9.308 -4.068 2.371 1.00 . A A . 31 TYR H 1 1 11 6674 1 1 31 TYR HA H 7.029 -5.500 1.071 1.00 . A A . 31 TYR HA 1 1 11 6675 1 1 31 TYR HB2 H 6.492 -3.572 0.217 1.00 . A A . 31 TYR HB2 1 1 11 6676 1 1 31 TYR HB3 H 7.166 -2.952 1.702 1.00 . A A . 31 TYR HB3 1 1 11 6677 1 1 31 TYR HD1 H 10.157 -3.411 0.390 1.00 . A A . 31 TYR HD1 1 1 11 6678 1 1 31 TYR HD2 H 6.546 -1.430 -0.699 1.00 . A A . 31 TYR HD2 1 1 11 6679 1 1 31 TYR HE1 H 11.431 -1.854 -1.004 1.00 . A A . 31 TYR HE1 1 1 11 6680 1 1 31 TYR HE2 H 7.777 0.287 -2.004 1.00 . A A . 31 TYR HE2 1 1 11 6681 1 1 31 TYR HH H 9.917 0.926 -2.732 1.00 . A A . 31 TYR HH 1 1 11 6682 1 1 31 TYR N N 8.642 -4.820 2.225 1.00 . A A . 31 TYR N 1 1 11 6683 1 1 31 TYR O O 8.535 -4.959 -1.363 1.00 . A A . 31 TYR O 1 1 11 6684 1 1 31 TYR OH O 10.456 0.221 -2.354 1.00 . A A . 31 TYR OH 1 1 11 6685 1 1 32 PRO C C 9.309 -7.860 -2.229 1.00 . A A . 32 PRO C 1 1 11 6686 1 1 32 PRO CA C 10.198 -7.057 -1.260 1.00 . A A . 32 PRO CA 1 1 11 6687 1 1 32 PRO CB C 11.291 -7.933 -0.642 1.00 . A A . 32 PRO CB 1 1 11 6688 1 1 32 PRO CD C 9.748 -7.318 1.054 1.00 . A A . 32 PRO CD 1 1 11 6689 1 1 32 PRO CG C 10.618 -8.485 0.611 1.00 . A A . 32 PRO CG 1 1 11 6690 1 1 32 PRO HA H 10.647 -6.174 -1.748 1.00 . A A . 32 PRO HA 1 1 11 6691 1 1 32 PRO HB2 H 11.625 -8.726 -1.314 1.00 . A A . 32 PRO HB2 1 1 11 6692 1 1 32 PRO HB3 H 12.128 -7.302 -0.346 1.00 . A A . 32 PRO HB3 1 1 11 6693 1 1 32 PRO HD2 H 8.846 -7.671 1.539 1.00 . A A . 32 PRO HD2 1 1 11 6694 1 1 32 PRO HD3 H 10.316 -6.680 1.729 1.00 . A A . 32 PRO HD3 1 1 11 6695 1 1 32 PRO HG2 H 9.983 -9.334 0.351 1.00 . A A . 32 PRO HG2 1 1 11 6696 1 1 32 PRO HG3 H 11.349 -8.730 1.384 1.00 . A A . 32 PRO HG3 1 1 11 6697 1 1 32 PRO N N 9.416 -6.571 -0.138 1.00 . A A . 32 PRO N 1 1 11 6698 1 1 32 PRO O O 9.797 -8.366 -3.243 1.00 . A A . 32 PRO O 1 1 11 6699 1 1 33 ALA C C 6.048 -7.534 -3.331 1.00 . A A . 33 ALA C 1 1 11 6700 1 1 33 ALA CA C 7.021 -8.602 -2.824 1.00 . A A . 33 ALA CA 1 1 11 6701 1 1 33 ALA CB C 6.254 -9.724 -2.114 1.00 . A A . 33 ALA CB 1 1 11 6702 1 1 33 ALA H H 7.677 -7.715 -1.021 1.00 . A A . 33 ALA H 1 1 11 6703 1 1 33 ALA HA H 7.514 -9.017 -3.701 1.00 . A A . 33 ALA HA 1 1 11 6704 1 1 33 ALA HB1 H 5.531 -10.169 -2.795 1.00 . A A . 33 ALA HB1 1 1 11 6705 1 1 33 ALA HB2 H 6.940 -10.494 -1.759 1.00 . A A . 33 ALA HB2 1 1 11 6706 1 1 33 ALA HB3 H 5.700 -9.310 -1.273 1.00 . A A . 33 ALA HB3 1 1 11 6707 1 1 33 ALA N N 8.019 -8.047 -1.917 1.00 . A A . 33 ALA N 1 1 11 6708 1 1 33 ALA O O 5.267 -7.822 -4.235 1.00 . A A . 33 ALA O 1 1 11 6709 1 1 34 GLY C C 4.899 -4.814 -4.365 1.00 . A A . 34 GLY C 1 1 11 6710 1 1 34 GLY CA C 5.014 -5.339 -2.944 1.00 . A A . 34 GLY CA 1 1 11 6711 1 1 34 GLY H H 6.760 -6.107 -2.068 1.00 . A A . 34 GLY H 1 1 11 6712 1 1 34 GLY HA2 H 5.209 -4.509 -2.269 1.00 . A A . 34 GLY HA2 1 1 11 6713 1 1 34 GLY HA3 H 4.065 -5.783 -2.656 1.00 . A A . 34 GLY HA3 1 1 11 6714 1 1 34 GLY N N 6.072 -6.322 -2.774 1.00 . A A . 34 GLY N 1 1 11 6715 1 1 34 GLY O O 3.792 -4.585 -4.841 1.00 . A A . 34 GLY O 1 1 11 6716 1 1 35 CYS C C 5.413 -5.260 -7.362 1.00 . A A . 35 CYS C 1 1 11 6717 1 1 35 CYS CA C 6.042 -4.209 -6.448 1.00 . A A . 35 CYS CA 1 1 11 6718 1 1 35 CYS CB C 7.498 -4.006 -6.870 1.00 . A A . 35 CYS CB 1 1 11 6719 1 1 35 CYS H H 6.911 -4.842 -4.599 1.00 . A A . 35 CYS H 1 1 11 6720 1 1 35 CYS HA H 5.486 -3.275 -6.529 1.00 . A A . 35 CYS HA 1 1 11 6721 1 1 35 CYS HB2 H 7.998 -4.975 -6.785 1.00 . A A . 35 CYS HB2 1 1 11 6722 1 1 35 CYS HB3 H 7.524 -3.698 -7.917 1.00 . A A . 35 CYS HB3 1 1 11 6723 1 1 35 CYS N N 6.025 -4.646 -5.056 1.00 . A A . 35 CYS N 1 1 11 6724 1 1 35 CYS O O 4.871 -4.960 -8.426 1.00 . A A . 35 CYS O 1 1 11 6725 1 1 35 CYS SG S 8.353 -2.762 -5.864 1.00 . A A . 35 CYS SG 1 1 11 6726 1 1 36 SER C C 3.591 -7.937 -7.323 1.00 . A A . 36 SER C 1 1 11 6727 1 1 36 SER CA C 5.062 -7.679 -7.691 1.00 . A A . 36 SER CA 1 1 11 6728 1 1 36 SER CB C 6.058 -8.787 -7.338 1.00 . A A . 36 SER CB 1 1 11 6729 1 1 36 SER H H 6.048 -6.695 -6.115 1.00 . A A . 36 SER H 1 1 11 6730 1 1 36 SER HA H 5.120 -7.496 -8.763 1.00 . A A . 36 SER HA 1 1 11 6731 1 1 36 SER HB2 H 7.013 -8.534 -7.802 1.00 . A A . 36 SER HB2 1 1 11 6732 1 1 36 SER HB3 H 6.231 -8.781 -6.265 1.00 . A A . 36 SER HB3 1 1 11 6733 1 1 36 SER HG H 6.441 -10.364 -8.349 1.00 . A A . 36 SER HG 1 1 11 6734 1 1 36 SER N N 5.546 -6.523 -6.977 1.00 . A A . 36 SER N 1 1 11 6735 1 1 36 SER O O 2.826 -8.339 -8.200 1.00 . A A . 36 SER O 1 1 11 6736 1 1 36 SER OG O 5.705 -10.088 -7.766 1.00 . A A . 36 SER OG 1 1 11 6737 1 1 37 ASN C C 0.885 -6.797 -6.084 1.00 . A A . 37 ASN C 1 1 11 6738 1 1 37 ASN CA C 1.833 -7.864 -5.551 1.00 . A A . 37 ASN CA 1 1 11 6739 1 1 37 ASN CB C 1.844 -7.778 -4.004 1.00 . A A . 37 ASN CB 1 1 11 6740 1 1 37 ASN CG C 1.742 -9.128 -3.334 1.00 . A A . 37 ASN CG 1 1 11 6741 1 1 37 ASN H H 3.859 -7.241 -5.460 1.00 . A A . 37 ASN H 1 1 11 6742 1 1 37 ASN HA H 1.478 -8.847 -5.860 1.00 . A A . 37 ASN HA 1 1 11 6743 1 1 37 ASN HB2 H 2.707 -7.227 -3.641 1.00 . A A . 37 ASN HB2 1 1 11 6744 1 1 37 ASN HB3 H 0.982 -7.211 -3.651 1.00 . A A . 37 ASN HB3 1 1 11 6745 1 1 37 ASN HD21 H -0.198 -9.213 -3.850 1.00 . A A . 37 ASN HD21 1 1 11 6746 1 1 37 ASN HD22 H 0.361 -10.492 -2.776 1.00 . A A . 37 ASN HD22 1 1 11 6747 1 1 37 ASN N N 3.170 -7.629 -6.093 1.00 . A A . 37 ASN N 1 1 11 6748 1 1 37 ASN ND2 N 0.546 -9.682 -3.348 1.00 . A A . 37 ASN ND2 1 1 11 6749 1 1 37 ASN O O 0.813 -5.720 -5.501 1.00 . A A . 37 ASN O 1 1 11 6750 1 1 37 ASN OD1 O 2.694 -9.664 -2.773 1.00 . A A . 37 ASN OD1 1 1 11 6751 1 1 38 SER C C -1.732 -5.401 -6.807 1.00 . A A . 38 SER C 1 1 11 6752 1 1 38 SER CA C -0.771 -6.108 -7.789 1.00 . A A . 38 SER CA 1 1 11 6753 1 1 38 SER CB C -1.515 -6.816 -8.927 1.00 . A A . 38 SER CB 1 1 11 6754 1 1 38 SER H H 0.172 -7.998 -7.555 1.00 . A A . 38 SER H 1 1 11 6755 1 1 38 SER HA H -0.159 -5.334 -8.271 1.00 . A A . 38 SER HA 1 1 11 6756 1 1 38 SER HB2 H -2.280 -6.151 -9.331 1.00 . A A . 38 SER HB2 1 1 11 6757 1 1 38 SER HB3 H -0.801 -7.054 -9.718 1.00 . A A . 38 SER HB3 1 1 11 6758 1 1 38 SER HG H -2.958 -7.779 -8.046 1.00 . A A . 38 SER HG 1 1 11 6759 1 1 38 SER N N 0.116 -7.080 -7.137 1.00 . A A . 38 SER N 1 1 11 6760 1 1 38 SER O O -2.144 -4.272 -7.071 1.00 . A A . 38 SER O 1 1 11 6761 1 1 38 SER OG O -2.116 -8.018 -8.482 1.00 . A A . 38 SER OG 1 1 11 6762 1 1 39 ASP C C -2.209 -4.195 -4.020 1.00 . A A . 39 ASP C 1 1 11 6763 1 1 39 ASP CA C -2.874 -5.442 -4.592 1.00 . A A . 39 ASP CA 1 1 11 6764 1 1 39 ASP CB C -3.114 -6.494 -3.496 1.00 . A A . 39 ASP CB 1 1 11 6765 1 1 39 ASP CG C -3.684 -5.973 -2.160 1.00 . A A . 39 ASP CG 1 1 11 6766 1 1 39 ASP H H -1.711 -6.965 -5.529 1.00 . A A . 39 ASP H 1 1 11 6767 1 1 39 ASP HA H -3.839 -5.150 -4.994 1.00 . A A . 39 ASP HA 1 1 11 6768 1 1 39 ASP HB2 H -3.808 -7.238 -3.891 1.00 . A A . 39 ASP HB2 1 1 11 6769 1 1 39 ASP HB3 H -2.164 -7.002 -3.291 1.00 . A A . 39 ASP HB3 1 1 11 6770 1 1 39 ASP N N -2.066 -6.029 -5.668 1.00 . A A . 39 ASP N 1 1 11 6771 1 1 39 ASP O O -2.890 -3.208 -3.755 1.00 . A A . 39 ASP O 1 1 11 6772 1 1 39 ASP OD1 O -4.729 -5.285 -2.106 1.00 . A A . 39 ASP OD1 1 1 11 6773 1 1 39 ASP OD2 O -3.179 -6.450 -1.117 1.00 . A A . 39 ASP OD2 1 1 11 6774 1 1 40 CYS C C 0.775 -2.413 -4.407 1.00 . A A . 40 CYS C 1 1 11 6775 1 1 40 CYS CA C -0.064 -3.129 -3.356 1.00 . A A . 40 CYS CA 1 1 11 6776 1 1 40 CYS CB C 0.792 -3.692 -2.219 1.00 . A A . 40 CYS CB 1 1 11 6777 1 1 40 CYS H H -0.370 -4.947 -4.363 1.00 . A A . 40 CYS H 1 1 11 6778 1 1 40 CYS HA H -0.717 -2.369 -2.930 1.00 . A A . 40 CYS HA 1 1 11 6779 1 1 40 CYS HB2 H 1.140 -4.696 -2.480 1.00 . A A . 40 CYS HB2 1 1 11 6780 1 1 40 CYS HB3 H 1.685 -3.074 -2.074 1.00 . A A . 40 CYS HB3 1 1 11 6781 1 1 40 CYS N N -0.881 -4.197 -3.911 1.00 . A A . 40 CYS N 1 1 11 6782 1 1 40 CYS O O 1.302 -1.349 -4.104 1.00 . A A . 40 CYS O 1 1 11 6783 1 1 40 CYS SG S -0.179 -3.688 -0.687 1.00 . A A . 40 CYS SG 1 1 11 6784 1 1 41 THR C C 1.265 -0.883 -6.923 1.00 . A A . 41 THR C 1 1 11 6785 1 1 41 THR CA C 1.644 -2.341 -6.693 1.00 . A A . 41 THR CA 1 1 11 6786 1 1 41 THR CB C 1.418 -3.185 -7.946 1.00 . A A . 41 THR CB 1 1 11 6787 1 1 41 THR CG2 C 1.946 -2.620 -9.252 1.00 . A A . 41 THR CG2 1 1 11 6788 1 1 41 THR H H 0.561 -3.877 -5.797 1.00 . A A . 41 THR H 1 1 11 6789 1 1 41 THR HA H 2.689 -2.398 -6.384 1.00 . A A . 41 THR HA 1 1 11 6790 1 1 41 THR HB H 0.345 -3.317 -8.071 1.00 . A A . 41 THR HB 1 1 11 6791 1 1 41 THR HG1 H 2.414 -4.708 -8.619 1.00 . A A . 41 THR HG1 1 1 11 6792 1 1 41 THR HG21 H 1.541 -1.622 -9.433 1.00 . A A . 41 THR HG21 1 1 11 6793 1 1 41 THR HG22 H 3.033 -2.568 -9.224 1.00 . A A . 41 THR HG22 1 1 11 6794 1 1 41 THR HG23 H 1.601 -3.302 -10.029 1.00 . A A . 41 THR HG23 1 1 11 6795 1 1 41 THR N N 0.868 -2.927 -5.627 1.00 . A A . 41 THR N 1 1 11 6796 1 1 41 THR O O 2.158 -0.048 -6.896 1.00 . A A . 41 THR O 1 1 11 6797 1 1 41 THR OG1 O 2.015 -4.446 -7.781 1.00 . A A . 41 THR OG1 1 1 11 6798 1 1 42 ALA C C -0.248 1.753 -6.371 1.00 . A A . 42 ALA C 1 1 11 6799 1 1 42 ALA CA C -0.428 0.787 -7.540 1.00 . A A . 42 ALA CA 1 1 11 6800 1 1 42 ALA CB C -1.891 0.777 -7.996 1.00 . A A . 42 ALA CB 1 1 11 6801 1 1 42 ALA H H -0.727 -1.265 -7.027 1.00 . A A . 42 ALA H 1 1 11 6802 1 1 42 ALA HA H 0.203 1.141 -8.364 1.00 . A A . 42 ALA HA 1 1 11 6803 1 1 42 ALA HB1 H -2.016 0.091 -8.834 1.00 . A A . 42 ALA HB1 1 1 11 6804 1 1 42 ALA HB2 H -2.544 0.477 -7.180 1.00 . A A . 42 ALA HB2 1 1 11 6805 1 1 42 ALA HB3 H -2.169 1.783 -8.309 1.00 . A A . 42 ALA HB3 1 1 11 6806 1 1 42 ALA N N -0.010 -0.565 -7.175 1.00 . A A . 42 ALA N 1 1 11 6807 1 1 42 ALA O O 0.163 2.891 -6.588 1.00 . A A . 42 ALA O 1 1 11 6808 1 1 43 PHE C C 1.290 2.344 -3.936 1.00 . A A . 43 PHE C 1 1 11 6809 1 1 43 PHE CA C -0.201 2.022 -3.924 1.00 . A A . 43 PHE CA 1 1 11 6810 1 1 43 PHE CB C -0.650 1.185 -2.710 1.00 . A A . 43 PHE CB 1 1 11 6811 1 1 43 PHE CD1 C 1.007 1.437 -0.841 1.00 . A A . 43 PHE CD1 1 1 11 6812 1 1 43 PHE CD2 C -1.195 2.367 -0.497 1.00 . A A . 43 PHE CD2 1 1 11 6813 1 1 43 PHE CE1 C 1.409 1.897 0.418 1.00 . A A . 43 PHE CE1 1 1 11 6814 1 1 43 PHE CE2 C -0.809 2.780 0.791 1.00 . A A . 43 PHE CE2 1 1 11 6815 1 1 43 PHE CG C -0.276 1.706 -1.334 1.00 . A A . 43 PHE CG 1 1 11 6816 1 1 43 PHE CZ C 0.501 2.577 1.241 1.00 . A A . 43 PHE CZ 1 1 11 6817 1 1 43 PHE H H -0.867 0.346 -5.070 1.00 . A A . 43 PHE H 1 1 11 6818 1 1 43 PHE HA H -0.733 2.971 -3.933 1.00 . A A . 43 PHE HA 1 1 11 6819 1 1 43 PHE HB2 H -1.731 1.065 -2.767 1.00 . A A . 43 PHE HB2 1 1 11 6820 1 1 43 PHE HB3 H -0.210 0.192 -2.786 1.00 . A A . 43 PHE HB3 1 1 11 6821 1 1 43 PHE HD1 H 1.694 0.890 -1.450 1.00 . A A . 43 PHE HD1 1 1 11 6822 1 1 43 PHE HD2 H -2.211 2.539 -0.813 1.00 . A A . 43 PHE HD2 1 1 11 6823 1 1 43 PHE HE1 H 2.424 1.741 0.731 1.00 . A A . 43 PHE HE1 1 1 11 6824 1 1 43 PHE HE2 H -1.515 3.274 1.433 1.00 . A A . 43 PHE HE2 1 1 11 6825 1 1 43 PHE HZ H 0.802 2.927 2.214 1.00 . A A . 43 PHE HZ 1 1 11 6826 1 1 43 PHE N N -0.516 1.297 -5.146 1.00 . A A . 43 PHE N 1 1 11 6827 1 1 43 PHE O O 1.680 3.503 -3.984 1.00 . A A . 43 PHE O 1 1 11 6828 1 1 44 LEU C C 4.213 2.261 -5.011 1.00 . A A . 44 LEU C 1 1 11 6829 1 1 44 LEU CA C 3.584 1.527 -3.824 1.00 . A A . 44 LEU CA 1 1 11 6830 1 1 44 LEU CB C 4.251 0.171 -3.626 1.00 . A A . 44 LEU CB 1 1 11 6831 1 1 44 LEU CD1 C 4.542 -1.946 -2.434 1.00 . A A . 44 LEU CD1 1 1 11 6832 1 1 44 LEU CD2 C 4.262 0.218 -1.084 1.00 . A A . 44 LEU CD2 1 1 11 6833 1 1 44 LEU CG C 3.879 -0.571 -2.342 1.00 . A A . 44 LEU CG 1 1 11 6834 1 1 44 LEU H H 1.784 0.382 -3.884 1.00 . A A . 44 LEU H 1 1 11 6835 1 1 44 LEU HA H 3.740 2.150 -2.950 1.00 . A A . 44 LEU HA 1 1 11 6836 1 1 44 LEU HB2 H 3.983 -0.466 -4.469 1.00 . A A . 44 LEU HB2 1 1 11 6837 1 1 44 LEU HB3 H 5.323 0.336 -3.637 1.00 . A A . 44 LEU HB3 1 1 11 6838 1 1 44 LEU HD11 H 5.600 -1.859 -2.689 1.00 . A A . 44 LEU HD11 1 1 11 6839 1 1 44 LEU HD12 H 4.416 -2.490 -1.499 1.00 . A A . 44 LEU HD12 1 1 11 6840 1 1 44 LEU HD13 H 4.051 -2.500 -3.234 1.00 . A A . 44 LEU HD13 1 1 11 6841 1 1 44 LEU HD21 H 3.892 1.237 -1.119 1.00 . A A . 44 LEU HD21 1 1 11 6842 1 1 44 LEU HD22 H 3.788 -0.252 -0.226 1.00 . A A . 44 LEU HD22 1 1 11 6843 1 1 44 LEU HD23 H 5.338 0.253 -0.966 1.00 . A A . 44 LEU HD23 1 1 11 6844 1 1 44 LEU HG H 2.806 -0.736 -2.303 1.00 . A A . 44 LEU HG 1 1 11 6845 1 1 44 LEU N N 2.150 1.330 -3.944 1.00 . A A . 44 LEU N 1 1 11 6846 1 1 44 LEU O O 5.169 3.011 -4.826 1.00 . A A . 44 LEU O 1 1 11 6847 1 1 45 SER C C 3.832 4.410 -7.022 1.00 . A A . 45 SER C 1 1 11 6848 1 1 45 SER CA C 3.954 2.918 -7.378 1.00 . A A . 45 SER CA 1 1 11 6849 1 1 45 SER CB C 2.987 2.463 -8.487 1.00 . A A . 45 SER CB 1 1 11 6850 1 1 45 SER H H 2.900 1.460 -6.330 1.00 . A A . 45 SER H 1 1 11 6851 1 1 45 SER HA H 4.980 2.733 -7.692 1.00 . A A . 45 SER HA 1 1 11 6852 1 1 45 SER HB2 H 2.042 2.168 -8.043 1.00 . A A . 45 SER HB2 1 1 11 6853 1 1 45 SER HB3 H 2.749 3.266 -9.155 1.00 . A A . 45 SER HB3 1 1 11 6854 1 1 45 SER HG H 2.870 1.260 -10.000 1.00 . A A . 45 SER HG 1 1 11 6855 1 1 45 SER N N 3.665 2.112 -6.210 1.00 . A A . 45 SER N 1 1 11 6856 1 1 45 SER O O 4.695 5.199 -7.399 1.00 . A A . 45 SER O 1 1 11 6857 1 1 45 SER OG O 3.495 1.390 -9.268 1.00 . A A . 45 SER OG 1 1 11 6858 1 1 46 GLN C C 3.425 6.526 -4.532 1.00 . A A . 46 GLN C 1 1 11 6859 1 1 46 GLN CA C 2.625 6.165 -5.784 1.00 . A A . 46 GLN CA 1 1 11 6860 1 1 46 GLN CB C 1.138 6.381 -5.492 1.00 . A A . 46 GLN CB 1 1 11 6861 1 1 46 GLN CD C -1.134 6.712 -6.602 1.00 . A A . 46 GLN CD 1 1 11 6862 1 1 46 GLN CG C 0.323 6.326 -6.786 1.00 . A A . 46 GLN CG 1 1 11 6863 1 1 46 GLN H H 2.157 4.105 -5.912 1.00 . A A . 46 GLN H 1 1 11 6864 1 1 46 GLN HA H 2.932 6.853 -6.578 1.00 . A A . 46 GLN HA 1 1 11 6865 1 1 46 GLN HB2 H 0.756 5.642 -4.790 1.00 . A A . 46 GLN HB2 1 1 11 6866 1 1 46 GLN HB3 H 1.041 7.360 -5.029 1.00 . A A . 46 GLN HB3 1 1 11 6867 1 1 46 GLN HE21 H -1.623 5.934 -8.412 1.00 . A A . 46 GLN HE21 1 1 11 6868 1 1 46 GLN HE22 H -2.906 6.793 -7.543 1.00 . A A . 46 GLN HE22 1 1 11 6869 1 1 46 GLN HG2 H 0.762 7.016 -7.492 1.00 . A A . 46 GLN HG2 1 1 11 6870 1 1 46 GLN HG3 H 0.374 5.327 -7.215 1.00 . A A . 46 GLN HG3 1 1 11 6871 1 1 46 GLN N N 2.828 4.795 -6.233 1.00 . A A . 46 GLN N 1 1 11 6872 1 1 46 GLN NE2 N -1.963 6.427 -7.590 1.00 . A A . 46 GLN NE2 1 1 11 6873 1 1 46 GLN O O 3.790 7.690 -4.384 1.00 . A A . 46 GLN O 1 1 11 6874 1 1 46 GLN OE1 O -1.528 7.270 -5.583 1.00 . A A . 46 GLN OE1 1 1 11 6875 1 1 47 CYS C C 5.801 5.837 -2.356 1.00 . A A . 47 CYS C 1 1 11 6876 1 1 47 CYS CA C 4.273 5.921 -2.309 1.00 . A A . 47 CYS CA 1 1 11 6877 1 1 47 CYS CB C 3.766 5.050 -1.144 1.00 . A A . 47 CYS CB 1 1 11 6878 1 1 47 CYS H H 3.095 4.745 -3.707 1.00 . A A . 47 CYS H 1 1 11 6879 1 1 47 CYS HA H 4.013 6.951 -2.062 1.00 . A A . 47 CYS HA 1 1 11 6880 1 1 47 CYS HB2 H 4.367 4.134 -1.055 1.00 . A A . 47 CYS HB2 1 1 11 6881 1 1 47 CYS HB3 H 3.936 5.622 -0.231 1.00 . A A . 47 CYS HB3 1 1 11 6882 1 1 47 CYS N N 3.627 5.599 -3.590 1.00 . A A . 47 CYS N 1 1 11 6883 1 1 47 CYS O O 6.446 6.521 -1.563 1.00 . A A . 47 CYS O 1 1 11 6884 1 1 47 CYS SG S 2.009 4.610 -1.184 1.00 . A A . 47 CYS SG 1 1 11 6885 1 1 48 TYR C C 8.324 4.936 -4.754 1.00 . A A . 48 TYR C 1 1 11 6886 1 1 48 TYR CA C 7.772 4.649 -3.356 1.00 . A A . 48 TYR CA 1 1 11 6887 1 1 48 TYR CB C 8.008 3.172 -3.052 1.00 . A A . 48 TYR CB 1 1 11 6888 1 1 48 TYR CD1 C 9.499 2.943 -1.017 1.00 . A A . 48 TYR CD1 1 1 11 6889 1 1 48 TYR CD2 C 7.138 2.374 -0.842 1.00 . A A . 48 TYR CD2 1 1 11 6890 1 1 48 TYR CE1 C 9.719 2.448 0.280 1.00 . A A . 48 TYR CE1 1 1 11 6891 1 1 48 TYR CE2 C 7.369 1.795 0.413 1.00 . A A . 48 TYR CE2 1 1 11 6892 1 1 48 TYR CG C 8.215 2.866 -1.590 1.00 . A A . 48 TYR CG 1 1 11 6893 1 1 48 TYR CZ C 8.662 1.825 0.982 1.00 . A A . 48 TYR CZ 1 1 11 6894 1 1 48 TYR H H 5.725 4.472 -3.835 1.00 . A A . 48 TYR H 1 1 11 6895 1 1 48 TYR HA H 8.359 5.175 -2.613 1.00 . A A . 48 TYR HA 1 1 11 6896 1 1 48 TYR HB2 H 7.188 2.569 -3.442 1.00 . A A . 48 TYR HB2 1 1 11 6897 1 1 48 TYR HB3 H 8.904 2.845 -3.581 1.00 . A A . 48 TYR HB3 1 1 11 6898 1 1 48 TYR HD1 H 10.325 3.358 -1.584 1.00 . A A . 48 TYR HD1 1 1 11 6899 1 1 48 TYR HD2 H 6.154 2.339 -1.287 1.00 . A A . 48 TYR HD2 1 1 11 6900 1 1 48 TYR HE1 H 10.712 2.498 0.701 1.00 . A A . 48 TYR HE1 1 1 11 6901 1 1 48 TYR HE2 H 6.550 1.292 0.888 1.00 . A A . 48 TYR HE2 1 1 11 6902 1 1 48 TYR HH H 8.361 0.474 2.347 1.00 . A A . 48 TYR HH 1 1 11 6903 1 1 48 TYR N N 6.351 4.983 -3.226 1.00 . A A . 48 TYR N 1 1 11 6904 1 1 48 TYR O O 9.542 4.954 -4.924 1.00 . A A . 48 TYR O 1 1 11 6905 1 1 48 TYR OH O 8.899 1.267 2.205 1.00 . A A . 48 TYR OH 1 1 11 6906 1 1 49 GLY C C 8.173 3.813 -7.807 1.00 . A A . 49 GLY C 1 1 11 6907 1 1 49 GLY CA C 7.900 5.178 -7.170 1.00 . A A . 49 GLY CA 1 1 11 6908 1 1 49 GLY H H 6.482 5.062 -5.591 1.00 . A A . 49 GLY H 1 1 11 6909 1 1 49 GLY HA2 H 8.802 5.781 -7.235 1.00 . A A . 49 GLY HA2 1 1 11 6910 1 1 49 GLY HA3 H 7.125 5.678 -7.746 1.00 . A A . 49 GLY HA3 1 1 11 6911 1 1 49 GLY N N 7.475 5.082 -5.775 1.00 . A A . 49 GLY N 1 1 11 6912 1 1 49 GLY O O 8.668 3.752 -8.933 1.00 . A A . 49 GLY O 1 1 11 6913 1 1 50 GLY C C 9.570 0.990 -7.386 1.00 . A A . 50 GLY C 1 1 11 6914 1 1 50 GLY CA C 8.104 1.362 -7.559 1.00 . A A . 50 GLY CA 1 1 11 6915 1 1 50 GLY H H 7.456 2.843 -6.187 1.00 . A A . 50 GLY H 1 1 11 6916 1 1 50 GLY HA2 H 7.831 1.266 -8.608 1.00 . A A . 50 GLY HA2 1 1 11 6917 1 1 50 GLY HA3 H 7.491 0.692 -6.965 1.00 . A A . 50 GLY HA3 1 1 11 6918 1 1 50 GLY N N 7.857 2.719 -7.105 1.00 . A A . 50 GLY N 1 1 11 6919 1 1 50 GLY O O 10.427 1.534 -8.079 1.00 . A A . 50 GLY O 1 1 11 6920 1 1 51 CYS C C 12.193 -0.368 -7.067 1.00 . A A . 51 CYS C 1 1 11 6921 1 1 51 CYS CA C 11.150 -0.331 -5.965 1.00 . A A . 51 CYS CA 1 1 11 6922 1 1 51 CYS CB C 11.092 -1.671 -5.212 1.00 . A A . 51 CYS CB 1 1 11 6923 1 1 51 CYS H H 9.048 -0.197 -5.863 1.00 . A A . 51 CYS H 1 1 11 6924 1 1 51 CYS HA H 11.478 0.411 -5.241 1.00 . A A . 51 CYS HA 1 1 11 6925 1 1 51 CYS HB2 H 12.119 -1.949 -4.966 1.00 . A A . 51 CYS HB2 1 1 11 6926 1 1 51 CYS HB3 H 10.558 -1.536 -4.272 1.00 . A A . 51 CYS HB3 1 1 11 6927 1 1 51 CYS N N 9.834 0.086 -6.435 1.00 . A A . 51 CYS N 1 1 11 6928 1 1 51 CYS O O 11.996 -1.064 -8.093 1.00 . A A . 51 CYS O 1 1 11 6929 1 1 51 CYS OXT O 13.288 0.182 -6.817 1.00 . A A . 51 CYS OXT 1 1 11 6930 1 1 51 CYS SG S 10.351 -3.087 -6.064 1.00 . A A . 51 CYS SG 1 1 12 6931 1 1 1 GLY C C -7.902 -6.432 0.116 1.00 . A A . 1 GLY C 1 1 12 6932 1 1 1 GLY CA C -7.238 -7.602 -0.580 1.00 . A A . 1 GLY CA 1 1 12 6933 1 1 1 GLY H1 H -8.942 -8.083 -1.591 1.00 . A A . 1 GLY H1 1 1 12 6934 1 1 1 GLY H2 H -7.879 -7.184 -2.463 1.00 . A A . 1 GLY H2 1 1 12 6935 1 1 1 GLY H3 H -7.571 -8.784 -2.210 1.00 . A A . 1 GLY H3 1 1 12 6936 1 1 1 GLY HA2 H -6.212 -7.339 -0.832 1.00 . A A . 1 GLY HA2 1 1 12 6937 1 1 1 GLY HA3 H -7.239 -8.462 0.088 1.00 . A A . 1 GLY HA3 1 1 12 6938 1 1 1 GLY N N -7.964 -7.947 -1.806 1.00 . A A . 1 GLY N 1 1 12 6939 1 1 1 GLY O O -8.915 -5.898 -0.342 1.00 . A A . 1 GLY O 1 1 12 6940 1 1 2 GLU C C -7.246 -3.563 1.346 1.00 . A A . 2 GLU C 1 1 12 6941 1 1 2 GLU CA C -7.786 -4.847 1.984 1.00 . A A . 2 GLU CA 1 1 12 6942 1 1 2 GLU CB C -7.436 -4.936 3.480 1.00 . A A . 2 GLU CB 1 1 12 6943 1 1 2 GLU CD C -5.466 -5.331 5.122 1.00 . A A . 2 GLU CD 1 1 12 6944 1 1 2 GLU CG C -5.942 -5.180 3.673 1.00 . A A . 2 GLU CG 1 1 12 6945 1 1 2 GLU H H -6.471 -6.443 1.543 1.00 . A A . 2 GLU H 1 1 12 6946 1 1 2 GLU HA H -8.857 -4.812 1.938 1.00 . A A . 2 GLU HA 1 1 12 6947 1 1 2 GLU HB2 H -7.718 -4.002 3.966 1.00 . A A . 2 GLU HB2 1 1 12 6948 1 1 2 GLU HB3 H -7.997 -5.756 3.927 1.00 . A A . 2 GLU HB3 1 1 12 6949 1 1 2 GLU HG2 H -5.716 -6.077 3.118 1.00 . A A . 2 GLU HG2 1 1 12 6950 1 1 2 GLU HG3 H -5.413 -4.361 3.209 1.00 . A A . 2 GLU HG3 1 1 12 6951 1 1 2 GLU N N -7.357 -6.032 1.259 1.00 . A A . 2 GLU N 1 1 12 6952 1 1 2 GLU O O -7.881 -2.514 1.482 1.00 . A A . 2 GLU O 1 1 12 6953 1 1 2 GLU OE1 O -6.283 -5.138 6.056 1.00 . A A . 2 GLU OE1 1 1 12 6954 1 1 2 GLU OE2 O -4.263 -5.611 5.333 1.00 . A A . 2 GLU OE2 1 1 12 6955 1 1 3 CYS C C -6.222 -1.786 -0.944 1.00 . A A . 3 CYS C 1 1 12 6956 1 1 3 CYS CA C -5.420 -2.418 0.185 1.00 . A A . 3 CYS CA 1 1 12 6957 1 1 3 CYS CB C -3.976 -2.687 -0.238 1.00 . A A . 3 CYS CB 1 1 12 6958 1 1 3 CYS H H -5.604 -4.507 0.602 1.00 . A A . 3 CYS H 1 1 12 6959 1 1 3 CYS HA H -5.383 -1.702 1.002 1.00 . A A . 3 CYS HA 1 1 12 6960 1 1 3 CYS HB2 H -3.439 -3.112 0.608 1.00 . A A . 3 CYS HB2 1 1 12 6961 1 1 3 CYS HB3 H -3.956 -3.396 -1.065 1.00 . A A . 3 CYS HB3 1 1 12 6962 1 1 3 CYS N N -6.084 -3.616 0.682 1.00 . A A . 3 CYS N 1 1 12 6963 1 1 3 CYS O O -6.566 -0.607 -0.844 1.00 . A A . 3 CYS O 1 1 12 6964 1 1 3 CYS SG S -3.127 -1.173 -0.761 1.00 . A A . 3 CYS SG 1 1 12 6965 1 1 4 GLU C C -8.681 -1.477 -2.634 1.00 . A A . 4 GLU C 1 1 12 6966 1 1 4 GLU CA C -7.322 -2.002 -3.108 1.00 . A A . 4 GLU CA 1 1 12 6967 1 1 4 GLU CB C -7.459 -3.007 -4.266 1.00 . A A . 4 GLU CB 1 1 12 6968 1 1 4 GLU CD C -6.076 -4.143 -6.133 1.00 . A A . 4 GLU CD 1 1 12 6969 1 1 4 GLU CG C -6.072 -3.363 -4.815 1.00 . A A . 4 GLU CG 1 1 12 6970 1 1 4 GLU H H -6.184 -3.490 -2.053 1.00 . A A . 4 GLU H 1 1 12 6971 1 1 4 GLU HA H -6.763 -1.146 -3.486 1.00 . A A . 4 GLU HA 1 1 12 6972 1 1 4 GLU HB2 H -7.970 -3.906 -3.916 1.00 . A A . 4 GLU HB2 1 1 12 6973 1 1 4 GLU HB3 H -8.045 -2.544 -5.062 1.00 . A A . 4 GLU HB3 1 1 12 6974 1 1 4 GLU HG2 H -5.499 -2.443 -4.957 1.00 . A A . 4 GLU HG2 1 1 12 6975 1 1 4 GLU HG3 H -5.565 -3.970 -4.065 1.00 . A A . 4 GLU HG3 1 1 12 6976 1 1 4 GLU N N -6.564 -2.552 -1.984 1.00 . A A . 4 GLU N 1 1 12 6977 1 1 4 GLU O O -9.137 -0.466 -3.153 1.00 . A A . 4 GLU O 1 1 12 6978 1 1 4 GLU OE1 O -6.619 -5.275 -6.168 1.00 . A A . 4 GLU OE1 1 1 12 6979 1 1 4 GLU OE2 O -5.379 -3.712 -7.082 1.00 . A A . 4 GLU OE2 1 1 12 6980 1 1 5 GLN C C -10.398 -0.301 -0.253 1.00 . A A . 5 GLN C 1 1 12 6981 1 1 5 GLN CA C -10.545 -1.615 -1.026 1.00 . A A . 5 GLN CA 1 1 12 6982 1 1 5 GLN CB C -11.097 -2.727 -0.106 1.00 . A A . 5 GLN CB 1 1 12 6983 1 1 5 GLN CD C -13.418 -2.712 -1.095 1.00 . A A . 5 GLN CD 1 1 12 6984 1 1 5 GLN CG C -12.600 -2.595 0.187 1.00 . A A . 5 GLN CG 1 1 12 6985 1 1 5 GLN H H -8.830 -2.880 -1.190 1.00 . A A . 5 GLN H 1 1 12 6986 1 1 5 GLN HA H -11.230 -1.393 -1.848 1.00 . A A . 5 GLN HA 1 1 12 6987 1 1 5 GLN HB2 H -10.914 -3.705 -0.557 1.00 . A A . 5 GLN HB2 1 1 12 6988 1 1 5 GLN HB3 H -10.553 -2.710 0.837 1.00 . A A . 5 GLN HB3 1 1 12 6989 1 1 5 GLN HE21 H -13.890 -0.722 -1.119 1.00 . A A . 5 GLN HE21 1 1 12 6990 1 1 5 GLN HE22 H -14.393 -1.660 -2.523 1.00 . A A . 5 GLN HE22 1 1 12 6991 1 1 5 GLN HG2 H -12.893 -3.403 0.857 1.00 . A A . 5 GLN HG2 1 1 12 6992 1 1 5 GLN HG3 H -12.812 -1.651 0.694 1.00 . A A . 5 GLN HG3 1 1 12 6993 1 1 5 GLN N N -9.285 -2.079 -1.603 1.00 . A A . 5 GLN N 1 1 12 6994 1 1 5 GLN NE2 N -13.969 -1.621 -1.596 1.00 . A A . 5 GLN NE2 1 1 12 6995 1 1 5 GLN O O -11.397 0.373 -0.010 1.00 . A A . 5 GLN O 1 1 12 6996 1 1 5 GLN OE1 O -13.545 -3.801 -1.652 1.00 . A A . 5 GLN OE1 1 1 12 6997 1 1 6 CYS C C -8.726 2.344 -0.501 1.00 . A A . 6 CYS C 1 1 12 6998 1 1 6 CYS CA C -8.907 1.397 0.679 1.00 . A A . 6 CYS CA 1 1 12 6999 1 1 6 CYS CB C -7.662 1.310 1.559 1.00 . A A . 6 CYS CB 1 1 12 7000 1 1 6 CYS H H -8.402 -0.521 -0.075 1.00 . A A . 6 CYS H 1 1 12 7001 1 1 6 CYS HA H -9.745 1.757 1.281 1.00 . A A . 6 CYS HA 1 1 12 7002 1 1 6 CYS HB2 H -7.770 0.447 2.207 1.00 . A A . 6 CYS HB2 1 1 12 7003 1 1 6 CYS HB3 H -6.778 1.149 0.943 1.00 . A A . 6 CYS HB3 1 1 12 7004 1 1 6 CYS N N -9.191 0.069 0.163 1.00 . A A . 6 CYS N 1 1 12 7005 1 1 6 CYS O O -9.367 3.387 -0.570 1.00 . A A . 6 CYS O 1 1 12 7006 1 1 6 CYS SG S -7.398 2.762 2.591 1.00 . A A . 6 CYS SG 1 1 12 7007 1 1 7 PHE C C -8.892 3.076 -3.452 1.00 . A A . 7 PHE C 1 1 12 7008 1 1 7 PHE CA C -7.624 2.724 -2.667 1.00 . A A . 7 PHE CA 1 1 12 7009 1 1 7 PHE CB C -6.634 1.947 -3.539 1.00 . A A . 7 PHE CB 1 1 12 7010 1 1 7 PHE CD1 C -4.436 2.911 -2.793 1.00 . A A . 7 PHE CD1 1 1 12 7011 1 1 7 PHE CD2 C -5.127 3.248 -5.105 1.00 . A A . 7 PHE CD2 1 1 12 7012 1 1 7 PHE CE1 C -3.255 3.616 -3.053 1.00 . A A . 7 PHE CE1 1 1 12 7013 1 1 7 PHE CE2 C -3.933 3.935 -5.364 1.00 . A A . 7 PHE CE2 1 1 12 7014 1 1 7 PHE CG C -5.370 2.715 -3.825 1.00 . A A . 7 PHE CG 1 1 12 7015 1 1 7 PHE CZ C -2.994 4.117 -4.338 1.00 . A A . 7 PHE CZ 1 1 12 7016 1 1 7 PHE H H -7.440 1.049 -1.366 1.00 . A A . 7 PHE H 1 1 12 7017 1 1 7 PHE HA H -7.161 3.661 -2.355 1.00 . A A . 7 PHE HA 1 1 12 7018 1 1 7 PHE HB2 H -6.344 1.018 -3.050 1.00 . A A . 7 PHE HB2 1 1 12 7019 1 1 7 PHE HB3 H -7.120 1.672 -4.473 1.00 . A A . 7 PHE HB3 1 1 12 7020 1 1 7 PHE HD1 H -4.617 2.544 -1.794 1.00 . A A . 7 PHE HD1 1 1 12 7021 1 1 7 PHE HD2 H -5.854 3.166 -5.896 1.00 . A A . 7 PHE HD2 1 1 12 7022 1 1 7 PHE HE1 H -2.534 3.772 -2.268 1.00 . A A . 7 PHE HE1 1 1 12 7023 1 1 7 PHE HE2 H -3.748 4.344 -6.344 1.00 . A A . 7 PHE HE2 1 1 12 7024 1 1 7 PHE HZ H -2.076 4.653 -4.529 1.00 . A A . 7 PHE HZ 1 1 12 7025 1 1 7 PHE N N -7.900 1.948 -1.470 1.00 . A A . 7 PHE N 1 1 12 7026 1 1 7 PHE O O -8.963 4.155 -4.034 1.00 . A A . 7 PHE O 1 1 12 7027 1 1 8 SER C C -11.946 3.558 -3.496 1.00 . A A . 8 SER C 1 1 12 7028 1 1 8 SER CA C -11.165 2.408 -4.143 1.00 . A A . 8 SER CA 1 1 12 7029 1 1 8 SER CB C -11.974 1.100 -4.126 1.00 . A A . 8 SER CB 1 1 12 7030 1 1 8 SER H H -9.722 1.282 -3.062 1.00 . A A . 8 SER H 1 1 12 7031 1 1 8 SER HA H -10.953 2.689 -5.173 1.00 . A A . 8 SER HA 1 1 12 7032 1 1 8 SER HB2 H -11.337 0.262 -3.848 1.00 . A A . 8 SER HB2 1 1 12 7033 1 1 8 SER HB3 H -12.787 1.169 -3.400 1.00 . A A . 8 SER HB3 1 1 12 7034 1 1 8 SER HG H -11.739 0.791 -6.025 1.00 . A A . 8 SER HG 1 1 12 7035 1 1 8 SER N N -9.888 2.189 -3.480 1.00 . A A . 8 SER N 1 1 12 7036 1 1 8 SER O O -12.785 4.182 -4.151 1.00 . A A . 8 SER O 1 1 12 7037 1 1 8 SER OG O -12.494 0.816 -5.405 1.00 . A A . 8 SER OG 1 1 12 7038 1 1 9 ASP C C -11.256 6.236 -1.640 1.00 . A A . 9 ASP C 1 1 12 7039 1 1 9 ASP CA C -12.234 5.050 -1.558 1.00 . A A . 9 ASP CA 1 1 12 7040 1 1 9 ASP CB C -12.626 4.662 -0.127 1.00 . A A . 9 ASP CB 1 1 12 7041 1 1 9 ASP CG C -13.786 5.511 0.417 1.00 . A A . 9 ASP CG 1 1 12 7042 1 1 9 ASP H H -10.983 3.323 -1.725 1.00 . A A . 9 ASP H 1 1 12 7043 1 1 9 ASP HA H -13.151 5.351 -2.067 1.00 . A A . 9 ASP HA 1 1 12 7044 1 1 9 ASP HB2 H -12.965 3.624 -0.154 1.00 . A A . 9 ASP HB2 1 1 12 7045 1 1 9 ASP HB3 H -11.761 4.708 0.542 1.00 . A A . 9 ASP HB3 1 1 12 7046 1 1 9 ASP N N -11.676 3.873 -2.231 1.00 . A A . 9 ASP N 1 1 12 7047 1 1 9 ASP O O -11.125 7.042 -0.718 1.00 . A A . 9 ASP O 1 1 12 7048 1 1 9 ASP OD1 O -13.885 6.718 0.107 1.00 . A A . 9 ASP OD1 1 1 12 7049 1 1 9 ASP OD2 O -14.629 4.912 1.126 1.00 . A A . 9 ASP OD2 1 1 12 7050 1 1 10 GLY C C -8.441 7.541 -2.250 1.00 . A A . 10 GLY C 1 1 12 7051 1 1 10 GLY CA C -9.725 7.527 -3.076 1.00 . A A . 10 GLY CA 1 1 12 7052 1 1 10 GLY H H -10.636 5.654 -3.483 1.00 . A A . 10 GLY H 1 1 12 7053 1 1 10 GLY HA2 H -10.280 8.448 -2.890 1.00 . A A . 10 GLY HA2 1 1 12 7054 1 1 10 GLY HA3 H -9.453 7.493 -4.129 1.00 . A A . 10 GLY HA3 1 1 12 7055 1 1 10 GLY N N -10.576 6.383 -2.782 1.00 . A A . 10 GLY N 1 1 12 7056 1 1 10 GLY O O -7.878 8.618 -2.023 1.00 . A A . 10 GLY O 1 1 12 7057 1 1 11 GLY C C -5.551 6.594 -1.972 1.00 . A A . 11 GLY C 1 1 12 7058 1 1 11 GLY CA C -6.731 6.261 -1.052 1.00 . A A . 11 GLY CA 1 1 12 7059 1 1 11 GLY H H -8.527 5.552 -1.947 1.00 . A A . 11 GLY H 1 1 12 7060 1 1 11 GLY HA2 H -6.638 5.237 -0.687 1.00 . A A . 11 GLY HA2 1 1 12 7061 1 1 11 GLY HA3 H -6.750 6.944 -0.203 1.00 . A A . 11 GLY HA3 1 1 12 7062 1 1 11 GLY N N -7.987 6.384 -1.768 1.00 . A A . 11 GLY N 1 1 12 7063 1 1 11 GLY O O -5.628 6.403 -3.188 1.00 . A A . 11 GLY O 1 1 12 7064 1 1 12 ASP C C -2.010 6.562 -1.587 1.00 . A A . 12 ASP C 1 1 12 7065 1 1 12 ASP CA C -3.199 7.340 -2.124 1.00 . A A . 12 ASP CA 1 1 12 7066 1 1 12 ASP CB C -2.846 8.834 -2.026 1.00 . A A . 12 ASP CB 1 1 12 7067 1 1 12 ASP CG C -2.548 9.442 -3.386 1.00 . A A . 12 ASP CG 1 1 12 7068 1 1 12 ASP H H -4.479 7.252 -0.384 1.00 . A A . 12 ASP H 1 1 12 7069 1 1 12 ASP HA H -3.339 7.033 -3.165 1.00 . A A . 12 ASP HA 1 1 12 7070 1 1 12 ASP HB2 H -3.616 9.359 -1.465 1.00 . A A . 12 ASP HB2 1 1 12 7071 1 1 12 ASP HB3 H -1.943 8.988 -1.438 1.00 . A A . 12 ASP HB3 1 1 12 7072 1 1 12 ASP N N -4.444 7.071 -1.390 1.00 . A A . 12 ASP N 1 1 12 7073 1 1 12 ASP O O -1.300 5.862 -2.305 1.00 . A A . 12 ASP O 1 1 12 7074 1 1 12 ASP OD1 O -1.742 8.858 -4.146 1.00 . A A . 12 ASP OD1 1 1 12 7075 1 1 12 ASP OD2 O -3.054 10.555 -3.646 1.00 . A A . 12 ASP OD2 1 1 12 7076 1 1 13 CYS C C -1.122 6.324 1.947 1.00 . A A . 13 CYS C 1 1 12 7077 1 1 13 CYS CA C -0.781 6.049 0.492 1.00 . A A . 13 CYS CA 1 1 12 7078 1 1 13 CYS CB C 0.669 6.446 0.178 1.00 . A A . 13 CYS CB 1 1 12 7079 1 1 13 CYS H H -2.350 7.448 0.141 1.00 . A A . 13 CYS H 1 1 12 7080 1 1 13 CYS HA H -0.899 4.992 0.272 1.00 . A A . 13 CYS HA 1 1 12 7081 1 1 13 CYS HB2 H 0.874 6.198 -0.865 1.00 . A A . 13 CYS HB2 1 1 12 7082 1 1 13 CYS HB3 H 0.799 7.522 0.309 1.00 . A A . 13 CYS HB3 1 1 12 7083 1 1 13 CYS N N -1.733 6.784 -0.311 1.00 . A A . 13 CYS N 1 1 12 7084 1 1 13 CYS O O -1.450 5.408 2.703 1.00 . A A . 13 CYS O 1 1 12 7085 1 1 13 CYS SG S 1.863 5.564 1.215 1.00 . A A . 13 CYS SG 1 1 12 7086 1 1 14 THR C C -2.433 7.561 4.344 1.00 . A A . 14 THR C 1 1 12 7087 1 1 14 THR CA C -1.132 8.041 3.700 1.00 . A A . 14 THR CA 1 1 12 7088 1 1 14 THR CB C -0.933 9.567 3.725 1.00 . A A . 14 THR CB 1 1 12 7089 1 1 14 THR CG2 C -0.775 10.084 5.153 1.00 . A A . 14 THR CG2 1 1 12 7090 1 1 14 THR H H -0.804 8.318 1.651 1.00 . A A . 14 THR H 1 1 12 7091 1 1 14 THR HA H -0.306 7.579 4.244 1.00 . A A . 14 THR HA 1 1 12 7092 1 1 14 THR HB H -1.789 10.057 3.260 1.00 . A A . 14 THR HB 1 1 12 7093 1 1 14 THR HG1 H 0.498 10.785 3.177 1.00 . A A . 14 THR HG1 1 1 12 7094 1 1 14 THR HG21 H 0.054 9.580 5.648 1.00 . A A . 14 THR HG21 1 1 12 7095 1 1 14 THR HG22 H -0.599 11.160 5.143 1.00 . A A . 14 THR HG22 1 1 12 7096 1 1 14 THR HG23 H -1.686 9.895 5.714 1.00 . A A . 14 THR HG23 1 1 12 7097 1 1 14 THR N N -1.060 7.601 2.321 1.00 . A A . 14 THR N 1 1 12 7098 1 1 14 THR O O -2.404 6.940 5.412 1.00 . A A . 14 THR O 1 1 12 7099 1 1 14 THR OG1 O 0.241 9.869 2.985 1.00 . A A . 14 THR OG1 1 1 12 7100 1 1 15 THR C C -5.210 5.912 4.126 1.00 . A A . 15 THR C 1 1 12 7101 1 1 15 THR CA C -4.854 7.410 4.292 1.00 . A A . 15 THR CA 1 1 12 7102 1 1 15 THR CB C -5.849 8.387 3.615 1.00 . A A . 15 THR CB 1 1 12 7103 1 1 15 THR CG2 C -6.394 7.988 2.244 1.00 . A A . 15 THR CG2 1 1 12 7104 1 1 15 THR H H -3.587 8.117 2.741 1.00 . A A . 15 THR H 1 1 12 7105 1 1 15 THR HA H -4.809 7.658 5.353 1.00 . A A . 15 THR HA 1 1 12 7106 1 1 15 THR HB H -5.301 9.300 3.378 1.00 . A A . 15 THR HB 1 1 12 7107 1 1 15 THR HG1 H -7.734 8.710 4.019 1.00 . A A . 15 THR HG1 1 1 12 7108 1 1 15 THR HG21 H -6.745 6.962 2.233 1.00 . A A . 15 THR HG21 1 1 12 7109 1 1 15 THR HG22 H -7.219 8.631 1.959 1.00 . A A . 15 THR HG22 1 1 12 7110 1 1 15 THR HG23 H -5.619 8.122 1.494 1.00 . A A . 15 THR HG23 1 1 12 7111 1 1 15 THR N N -3.576 7.726 3.673 1.00 . A A . 15 THR N 1 1 12 7112 1 1 15 THR O O -6.373 5.527 4.231 1.00 . A A . 15 THR O 1 1 12 7113 1 1 15 THR OG1 O -6.887 8.723 4.515 1.00 . A A . 15 THR OG1 1 1 12 7114 1 1 16 CYS C C -3.040 2.913 4.612 1.00 . A A . 16 CYS C 1 1 12 7115 1 1 16 CYS CA C -4.290 3.571 4.012 1.00 . A A . 16 CYS CA 1 1 12 7116 1 1 16 CYS CB C -4.398 3.171 2.528 1.00 . A A . 16 CYS CB 1 1 12 7117 1 1 16 CYS H H -3.272 5.426 4.058 1.00 . A A . 16 CYS H 1 1 12 7118 1 1 16 CYS HA H -5.160 3.182 4.559 1.00 . A A . 16 CYS HA 1 1 12 7119 1 1 16 CYS HB2 H -3.542 3.592 2.013 1.00 . A A . 16 CYS HB2 1 1 12 7120 1 1 16 CYS HB3 H -4.319 2.087 2.451 1.00 . A A . 16 CYS HB3 1 1 12 7121 1 1 16 CYS N N -4.203 5.030 4.127 1.00 . A A . 16 CYS N 1 1 12 7122 1 1 16 CYS O O -2.947 1.685 4.595 1.00 . A A . 16 CYS O 1 1 12 7123 1 1 16 CYS SG S -5.884 3.699 1.632 1.00 . A A . 16 CYS SG 1 1 12 7124 1 1 17 PHE C C -1.305 2.907 7.328 1.00 . A A . 17 PHE C 1 1 12 7125 1 1 17 PHE CA C -0.944 3.127 5.858 1.00 . A A . 17 PHE CA 1 1 12 7126 1 1 17 PHE CB C 0.294 4.027 5.697 1.00 . A A . 17 PHE CB 1 1 12 7127 1 1 17 PHE CD1 C 1.886 2.117 6.090 1.00 . A A . 17 PHE CD1 1 1 12 7128 1 1 17 PHE CD2 C 2.262 4.164 7.318 1.00 . A A . 17 PHE CD2 1 1 12 7129 1 1 17 PHE CE1 C 2.916 1.476 6.791 1.00 . A A . 17 PHE CE1 1 1 12 7130 1 1 17 PHE CE2 C 3.318 3.540 8.008 1.00 . A A . 17 PHE CE2 1 1 12 7131 1 1 17 PHE CG C 1.526 3.444 6.363 1.00 . A A . 17 PHE CG 1 1 12 7132 1 1 17 PHE CZ C 3.649 2.199 7.733 1.00 . A A . 17 PHE CZ 1 1 12 7133 1 1 17 PHE H H -2.140 4.690 5.089 1.00 . A A . 17 PHE H 1 1 12 7134 1 1 17 PHE HA H -0.713 2.150 5.438 1.00 . A A . 17 PHE HA 1 1 12 7135 1 1 17 PHE HB2 H 0.508 4.151 4.635 1.00 . A A . 17 PHE HB2 1 1 12 7136 1 1 17 PHE HB3 H 0.081 5.011 6.113 1.00 . A A . 17 PHE HB3 1 1 12 7137 1 1 17 PHE HD1 H 1.360 1.585 5.328 1.00 . A A . 17 PHE HD1 1 1 12 7138 1 1 17 PHE HD2 H 1.990 5.180 7.561 1.00 . A A . 17 PHE HD2 1 1 12 7139 1 1 17 PHE HE1 H 3.145 0.431 6.618 1.00 . A A . 17 PHE HE1 1 1 12 7140 1 1 17 PHE HE2 H 3.829 4.086 8.789 1.00 . A A . 17 PHE HE2 1 1 12 7141 1 1 17 PHE HZ H 4.454 1.682 8.223 1.00 . A A . 17 PHE HZ 1 1 12 7142 1 1 17 PHE N N -2.074 3.683 5.128 1.00 . A A . 17 PHE N 1 1 12 7143 1 1 17 PHE O O -0.843 1.937 7.930 1.00 . A A . 17 PHE O 1 1 12 7144 1 1 18 ASN C C -1.481 3.494 10.251 1.00 . A A . 18 ASN C 1 1 12 7145 1 1 18 ASN CA C -2.627 3.777 9.277 1.00 . A A . 18 ASN CA 1 1 12 7146 1 1 18 ASN CB C -3.754 2.773 9.423 1.00 . A A . 18 ASN CB 1 1 12 7147 1 1 18 ASN CG C -4.648 3.054 10.625 1.00 . A A . 18 ASN CG 1 1 12 7148 1 1 18 ASN H H -2.457 4.568 7.341 1.00 . A A . 18 ASN H 1 1 12 7149 1 1 18 ASN HA H -3.018 4.770 9.496 1.00 . A A . 18 ASN HA 1 1 12 7150 1 1 18 ASN HB2 H -4.365 2.761 8.520 1.00 . A A . 18 ASN HB2 1 1 12 7151 1 1 18 ASN HB3 H -3.232 1.834 9.539 1.00 . A A . 18 ASN HB3 1 1 12 7152 1 1 18 ASN HD21 H -6.260 2.086 9.796 1.00 . A A . 18 ASN HD21 1 1 12 7153 1 1 18 ASN HD22 H -6.526 2.867 11.336 1.00 . A A . 18 ASN HD22 1 1 12 7154 1 1 18 ASN N N -2.166 3.768 7.888 1.00 . A A . 18 ASN N 1 1 12 7155 1 1 18 ASN ND2 N -5.914 2.689 10.537 1.00 . A A . 18 ASN ND2 1 1 12 7156 1 1 18 ASN O O -1.501 2.557 11.055 1.00 . A A . 18 ASN O 1 1 12 7157 1 1 18 ASN OD1 O -4.254 3.678 11.603 1.00 . A A . 18 ASN OD1 1 1 12 7158 1 1 19 ASN C C 1.373 2.674 10.881 1.00 . A A . 19 ASN C 1 1 12 7159 1 1 19 ASN CA C 0.927 4.100 10.544 1.00 . A A . 19 ASN CA 1 1 12 7160 1 1 19 ASN CB C 1.265 5.154 11.606 1.00 . A A . 19 ASN CB 1 1 12 7161 1 1 19 ASN CG C 2.774 5.338 11.686 1.00 . A A . 19 ASN CG 1 1 12 7162 1 1 19 ASN H H -0.497 4.970 9.328 1.00 . A A . 19 ASN H 1 1 12 7163 1 1 19 ASN HA H 1.483 4.350 9.664 1.00 . A A . 19 ASN HA 1 1 12 7164 1 1 19 ASN HB2 H 0.822 6.113 11.337 1.00 . A A . 19 ASN HB2 1 1 12 7165 1 1 19 ASN HB3 H 0.856 4.847 12.568 1.00 . A A . 19 ASN HB3 1 1 12 7166 1 1 19 ASN HD21 H 2.846 4.379 13.461 1.00 . A A . 19 ASN HD21 1 1 12 7167 1 1 19 ASN HD22 H 4.405 4.825 12.793 1.00 . A A . 19 ASN HD22 1 1 12 7168 1 1 19 ASN N N -0.420 4.262 10.052 1.00 . A A . 19 ASN N 1 1 12 7169 1 1 19 ASN ND2 N 3.387 4.924 12.782 1.00 . A A . 19 ASN ND2 1 1 12 7170 1 1 19 ASN O O 1.868 2.412 11.974 1.00 . A A . 19 ASN O 1 1 12 7171 1 1 19 ASN OD1 O 3.377 5.869 10.752 1.00 . A A . 19 ASN OD1 1 1 12 7172 1 1 20 GLY C C 0.704 -0.608 10.526 1.00 . A A . 20 GLY C 1 1 12 7173 1 1 20 GLY CA C 1.744 0.393 10.024 1.00 . A A . 20 GLY CA 1 1 12 7174 1 1 20 GLY H H 0.792 1.997 9.056 1.00 . A A . 20 GLY H 1 1 12 7175 1 1 20 GLY HA2 H 2.617 0.383 10.664 1.00 . A A . 20 GLY HA2 1 1 12 7176 1 1 20 GLY HA3 H 2.071 0.083 9.037 1.00 . A A . 20 GLY HA3 1 1 12 7177 1 1 20 GLY N N 1.246 1.754 9.924 1.00 . A A . 20 GLY N 1 1 12 7178 1 1 20 GLY O O 1.025 -1.780 10.712 1.00 . A A . 20 GLY O 1 1 12 7179 1 1 21 THR C C -2.907 -0.630 10.332 1.00 . A A . 21 THR C 1 1 12 7180 1 1 21 THR CA C -1.675 -0.960 11.182 1.00 . A A . 21 THR CA 1 1 12 7181 1 1 21 THR CB C -1.868 -0.670 12.683 1.00 . A A . 21 THR CB 1 1 12 7182 1 1 21 THR CG2 C -0.958 -1.558 13.520 1.00 . A A . 21 THR CG2 1 1 12 7183 1 1 21 THR H H -0.750 0.785 10.481 1.00 . A A . 21 THR H 1 1 12 7184 1 1 21 THR HA H -1.480 -2.028 11.055 1.00 . A A . 21 THR HA 1 1 12 7185 1 1 21 THR HB H -2.895 -0.894 12.971 1.00 . A A . 21 THR HB 1 1 12 7186 1 1 21 THR HG1 H -1.618 1.253 12.260 1.00 . A A . 21 THR HG1 1 1 12 7187 1 1 21 THR HG21 H 0.080 -1.375 13.242 1.00 . A A . 21 THR HG21 1 1 12 7188 1 1 21 THR HG22 H -1.105 -1.348 14.580 1.00 . A A . 21 THR HG22 1 1 12 7189 1 1 21 THR HG23 H -1.197 -2.604 13.339 1.00 . A A . 21 THR HG23 1 1 12 7190 1 1 21 THR N N -0.547 -0.183 10.683 1.00 . A A . 21 THR N 1 1 12 7191 1 1 21 THR O O -3.941 -0.194 10.839 1.00 . A A . 21 THR O 1 1 12 7192 1 1 21 THR OG1 O -1.562 0.675 13.048 1.00 . A A . 21 THR OG1 1 1 12 7193 1 1 22 GLY C C -3.644 -1.240 6.780 1.00 . A A . 22 GLY C 1 1 12 7194 1 1 22 GLY CA C -3.720 -0.339 8.004 1.00 . A A . 22 GLY CA 1 1 12 7195 1 1 22 GLY H H -1.865 -1.070 8.676 1.00 . A A . 22 GLY H 1 1 12 7196 1 1 22 GLY HA2 H -3.510 0.678 7.682 1.00 . A A . 22 GLY HA2 1 1 12 7197 1 1 22 GLY HA3 H -4.725 -0.395 8.427 1.00 . A A . 22 GLY HA3 1 1 12 7198 1 1 22 GLY N N -2.744 -0.718 9.014 1.00 . A A . 22 GLY N 1 1 12 7199 1 1 22 GLY O O -2.809 -2.146 6.719 1.00 . A A . 22 GLY O 1 1 12 7200 1 1 23 PRO C C -3.602 -2.111 3.734 1.00 . A A . 23 PRO C 1 1 12 7201 1 1 23 PRO CA C -4.761 -1.964 4.721 1.00 . A A . 23 PRO CA 1 1 12 7202 1 1 23 PRO CB C -6.029 -1.466 4.040 1.00 . A A . 23 PRO CB 1 1 12 7203 1 1 23 PRO CD C -5.393 0.145 5.672 1.00 . A A . 23 PRO CD 1 1 12 7204 1 1 23 PRO CG C -6.017 0.036 4.290 1.00 . A A . 23 PRO CG 1 1 12 7205 1 1 23 PRO HA H -4.949 -2.927 5.180 1.00 . A A . 23 PRO HA 1 1 12 7206 1 1 23 PRO HB2 H -6.026 -1.686 2.982 1.00 . A A . 23 PRO HB2 1 1 12 7207 1 1 23 PRO HB3 H -6.892 -1.918 4.522 1.00 . A A . 23 PRO HB3 1 1 12 7208 1 1 23 PRO HD2 H -4.875 1.090 5.793 1.00 . A A . 23 PRO HD2 1 1 12 7209 1 1 23 PRO HD3 H -6.167 0.096 6.423 1.00 . A A . 23 PRO HD3 1 1 12 7210 1 1 23 PRO HG2 H -5.383 0.525 3.553 1.00 . A A . 23 PRO HG2 1 1 12 7211 1 1 23 PRO HG3 H -7.020 0.450 4.279 1.00 . A A . 23 PRO HG3 1 1 12 7212 1 1 23 PRO N N -4.503 -1.000 5.781 1.00 . A A . 23 PRO N 1 1 12 7213 1 1 23 PRO O O -3.345 -3.196 3.214 1.00 . A A . 23 PRO O 1 1 12 7214 1 1 24 CYS C C -0.586 -0.697 4.011 1.00 . A A . 24 CYS C 1 1 12 7215 1 1 24 CYS CA C -1.532 -1.155 2.920 1.00 . A A . 24 CYS CA 1 1 12 7216 1 1 24 CYS CB C -1.414 -0.354 1.619 1.00 . A A . 24 CYS CB 1 1 12 7217 1 1 24 CYS H H -3.075 -0.187 4.006 1.00 . A A . 24 CYS H 1 1 12 7218 1 1 24 CYS HA H -1.287 -2.193 2.692 1.00 . A A . 24 CYS HA 1 1 12 7219 1 1 24 CYS HB2 H -2.231 0.361 1.541 1.00 . A A . 24 CYS HB2 1 1 12 7220 1 1 24 CYS HB3 H -0.486 0.211 1.653 1.00 . A A . 24 CYS HB3 1 1 12 7221 1 1 24 CYS N N -2.853 -1.044 3.503 1.00 . A A . 24 CYS N 1 1 12 7222 1 1 24 CYS O O -0.023 0.384 3.926 1.00 . A A . 24 CYS O 1 1 12 7223 1 1 24 CYS SG S -1.295 -1.303 0.091 1.00 . A A . 24 CYS SG 1 1 12 7224 1 1 25 ALA C C 1.777 -2.301 5.712 1.00 . A A . 25 ALA C 1 1 12 7225 1 1 25 ALA CA C 0.652 -1.340 6.017 1.00 . A A . 25 ALA CA 1 1 12 7226 1 1 25 ALA CB C 0.174 -1.562 7.438 1.00 . A A . 25 ALA CB 1 1 12 7227 1 1 25 ALA H H -1.006 -2.339 5.122 1.00 . A A . 25 ALA H 1 1 12 7228 1 1 25 ALA HA H 1.043 -0.333 5.966 1.00 . A A . 25 ALA HA 1 1 12 7229 1 1 25 ALA HB1 H -0.389 -2.490 7.524 1.00 . A A . 25 ALA HB1 1 1 12 7230 1 1 25 ALA HB2 H -0.423 -0.703 7.729 1.00 . A A . 25 ALA HB2 1 1 12 7231 1 1 25 ALA HB3 H 1.057 -1.630 8.067 1.00 . A A . 25 ALA HB3 1 1 12 7232 1 1 25 ALA N N -0.420 -1.514 5.051 1.00 . A A . 25 ALA N 1 1 12 7233 1 1 25 ALA O O 2.927 -1.887 5.567 1.00 . A A . 25 ALA O 1 1 12 7234 1 1 26 ASN C C 3.243 -4.375 4.115 1.00 . A A . 26 ASN C 1 1 12 7235 1 1 26 ASN CA C 2.446 -4.612 5.400 1.00 . A A . 26 ASN CA 1 1 12 7236 1 1 26 ASN CB C 1.817 -6.010 5.390 1.00 . A A . 26 ASN CB 1 1 12 7237 1 1 26 ASN CG C 1.100 -6.324 4.084 1.00 . A A . 26 ASN CG 1 1 12 7238 1 1 26 ASN H H 0.475 -3.856 5.767 1.00 . A A . 26 ASN H 1 1 12 7239 1 1 26 ASN HA H 3.126 -4.525 6.247 1.00 . A A . 26 ASN HA 1 1 12 7240 1 1 26 ASN HB2 H 2.625 -6.733 5.521 1.00 . A A . 26 ASN HB2 1 1 12 7241 1 1 26 ASN HB3 H 1.133 -6.126 6.227 1.00 . A A . 26 ASN HB3 1 1 12 7242 1 1 26 ASN HD21 H -0.657 -5.402 4.644 1.00 . A A . 26 ASN HD21 1 1 12 7243 1 1 26 ASN HD22 H -0.632 -6.035 3.034 1.00 . A A . 26 ASN HD22 1 1 12 7244 1 1 26 ASN N N 1.437 -3.586 5.605 1.00 . A A . 26 ASN N 1 1 12 7245 1 1 26 ASN ND2 N -0.125 -5.862 3.903 1.00 . A A . 26 ASN ND2 1 1 12 7246 1 1 26 ASN O O 4.431 -4.686 4.063 1.00 . A A . 26 ASN O 1 1 12 7247 1 1 26 ASN OD1 O 1.649 -7.011 3.231 1.00 . A A . 26 ASN OD1 1 1 12 7248 1 1 27 CYS C C 4.302 -2.346 1.953 1.00 . A A . 27 CYS C 1 1 12 7249 1 1 27 CYS CA C 3.228 -3.433 1.839 1.00 . A A . 27 CYS CA 1 1 12 7250 1 1 27 CYS CB C 2.164 -3.169 0.769 1.00 . A A . 27 CYS CB 1 1 12 7251 1 1 27 CYS H H 1.629 -3.551 3.239 1.00 . A A . 27 CYS H 1 1 12 7252 1 1 27 CYS HA H 3.740 -4.318 1.463 1.00 . A A . 27 CYS HA 1 1 12 7253 1 1 27 CYS HB2 H 1.592 -2.257 0.948 1.00 . A A . 27 CYS HB2 1 1 12 7254 1 1 27 CYS HB3 H 2.689 -3.018 -0.171 1.00 . A A . 27 CYS HB3 1 1 12 7255 1 1 27 CYS N N 2.605 -3.767 3.110 1.00 . A A . 27 CYS N 1 1 12 7256 1 1 27 CYS O O 4.879 -2.022 0.929 1.00 . A A . 27 CYS O 1 1 12 7257 1 1 27 CYS SG S 1.130 -4.662 0.600 1.00 . A A . 27 CYS SG 1 1 12 7258 1 1 28 LEU C C 6.810 -1.387 4.119 1.00 . A A . 28 LEU C 1 1 12 7259 1 1 28 LEU CA C 5.655 -0.794 3.319 1.00 . A A . 28 LEU CA 1 1 12 7260 1 1 28 LEU CB C 5.112 0.375 4.146 1.00 . A A . 28 LEU CB 1 1 12 7261 1 1 28 LEU CD1 C 4.598 2.189 2.423 1.00 . A A . 28 LEU CD1 1 1 12 7262 1 1 28 LEU CD2 C 2.857 0.546 2.987 1.00 . A A . 28 LEU CD2 1 1 12 7263 1 1 28 LEU CG C 4.066 1.279 3.514 1.00 . A A . 28 LEU CG 1 1 12 7264 1 1 28 LEU H H 3.945 -1.800 3.909 1.00 . A A . 28 LEU H 1 1 12 7265 1 1 28 LEU HA H 6.021 -0.430 2.357 1.00 . A A . 28 LEU HA 1 1 12 7266 1 1 28 LEU HB2 H 4.683 -0.014 5.072 1.00 . A A . 28 LEU HB2 1 1 12 7267 1 1 28 LEU HB3 H 5.950 1.006 4.416 1.00 . A A . 28 LEU HB3 1 1 12 7268 1 1 28 LEU HD11 H 5.586 2.558 2.690 1.00 . A A . 28 LEU HD11 1 1 12 7269 1 1 28 LEU HD12 H 4.649 1.623 1.497 1.00 . A A . 28 LEU HD12 1 1 12 7270 1 1 28 LEU HD13 H 3.933 3.039 2.280 1.00 . A A . 28 LEU HD13 1 1 12 7271 1 1 28 LEU HD21 H 2.541 -0.171 3.737 1.00 . A A . 28 LEU HD21 1 1 12 7272 1 1 28 LEU HD22 H 2.060 1.264 2.864 1.00 . A A . 28 LEU HD22 1 1 12 7273 1 1 28 LEU HD23 H 3.097 0.077 2.028 1.00 . A A . 28 LEU HD23 1 1 12 7274 1 1 28 LEU HG H 3.724 1.876 4.331 1.00 . A A . 28 LEU HG 1 1 12 7275 1 1 28 LEU N N 4.594 -1.771 3.129 1.00 . A A . 28 LEU N 1 1 12 7276 1 1 28 LEU O O 7.961 -1.327 3.696 1.00 . A A . 28 LEU O 1 1 12 7277 1 1 29 ALA C C 8.530 -3.092 6.132 1.00 . A A . 29 ALA C 1 1 12 7278 1 1 29 ALA CA C 7.513 -1.976 6.395 1.00 . A A . 29 ALA CA 1 1 12 7279 1 1 29 ALA CB C 6.824 -2.151 7.752 1.00 . A A . 29 ALA CB 1 1 12 7280 1 1 29 ALA H H 5.538 -1.943 5.602 1.00 . A A . 29 ALA H 1 1 12 7281 1 1 29 ALA HA H 8.072 -1.040 6.429 1.00 . A A . 29 ALA HA 1 1 12 7282 1 1 29 ALA HB1 H 7.569 -2.174 8.546 1.00 . A A . 29 ALA HB1 1 1 12 7283 1 1 29 ALA HB2 H 6.266 -3.083 7.770 1.00 . A A . 29 ALA HB2 1 1 12 7284 1 1 29 ALA HB3 H 6.142 -1.321 7.937 1.00 . A A . 29 ALA HB3 1 1 12 7285 1 1 29 ALA N N 6.510 -1.858 5.338 1.00 . A A . 29 ALA N 1 1 12 7286 1 1 29 ALA O O 9.572 -3.133 6.782 1.00 . A A . 29 ALA O 1 1 12 7287 1 1 30 GLY C C 8.558 -5.291 3.267 1.00 . A A . 30 GLY C 1 1 12 7288 1 1 30 GLY CA C 9.201 -4.894 4.583 1.00 . A A . 30 GLY CA 1 1 12 7289 1 1 30 GLY H H 7.367 -3.875 4.695 1.00 . A A . 30 GLY H 1 1 12 7290 1 1 30 GLY HA2 H 9.318 -5.770 5.221 1.00 . A A . 30 GLY HA2 1 1 12 7291 1 1 30 GLY HA3 H 10.165 -4.407 4.417 1.00 . A A . 30 GLY HA3 1 1 12 7292 1 1 30 GLY N N 8.255 -3.969 5.172 1.00 . A A . 30 GLY N 1 1 12 7293 1 1 30 GLY O O 7.682 -6.160 3.273 1.00 . A A . 30 GLY O 1 1 12 7294 1 1 31 TYR C C 9.088 -5.006 -0.298 1.00 . A A . 31 TYR C 1 1 12 7295 1 1 31 TYR CA C 8.195 -4.691 0.912 1.00 . A A . 31 TYR CA 1 1 12 7296 1 1 31 TYR CB C 7.512 -3.317 0.740 1.00 . A A . 31 TYR CB 1 1 12 7297 1 1 31 TYR CD1 C 9.753 -2.135 0.309 1.00 . A A . 31 TYR CD1 1 1 12 7298 1 1 31 TYR CD2 C 7.722 -1.220 -0.636 1.00 . A A . 31 TYR CD2 1 1 12 7299 1 1 31 TYR CE1 C 10.497 -1.116 -0.306 1.00 . A A . 31 TYR CE1 1 1 12 7300 1 1 31 TYR CE2 C 8.445 -0.190 -1.264 1.00 . A A . 31 TYR CE2 1 1 12 7301 1 1 31 TYR CG C 8.352 -2.172 0.178 1.00 . A A . 31 TYR CG 1 1 12 7302 1 1 31 TYR CZ C 9.847 -0.138 -1.095 1.00 . A A . 31 TYR CZ 1 1 12 7303 1 1 31 TYR H H 9.702 -3.967 2.241 1.00 . A A . 31 TYR H 1 1 12 7304 1 1 31 TYR HA H 7.430 -5.455 0.961 1.00 . A A . 31 TYR HA 1 1 12 7305 1 1 31 TYR HB2 H 6.695 -3.488 0.038 1.00 . A A . 31 TYR HB2 1 1 12 7306 1 1 31 TYR HB3 H 7.077 -2.963 1.679 1.00 . A A . 31 TYR HB3 1 1 12 7307 1 1 31 TYR HD1 H 10.268 -2.945 0.802 1.00 . A A . 31 TYR HD1 1 1 12 7308 1 1 31 TYR HD2 H 6.662 -1.311 -0.753 1.00 . A A . 31 TYR HD2 1 1 12 7309 1 1 31 TYR HE1 H 11.573 -1.107 -0.202 1.00 . A A . 31 TYR HE1 1 1 12 7310 1 1 31 TYR HE2 H 7.919 0.562 -1.861 1.00 . A A . 31 TYR HE2 1 1 12 7311 1 1 31 TYR HH H 11.459 0.439 -1.980 1.00 . A A . 31 TYR HH 1 1 12 7312 1 1 31 TYR N N 8.915 -4.603 2.178 1.00 . A A . 31 TYR N 1 1 12 7313 1 1 31 TYR O O 8.875 -4.451 -1.380 1.00 . A A . 31 TYR O 1 1 12 7314 1 1 31 TYR OH O 10.581 0.792 -1.757 1.00 . A A . 31 TYR OH 1 1 12 7315 1 1 32 PRO C C 10.121 -6.808 -2.579 1.00 . A A . 32 PRO C 1 1 12 7316 1 1 32 PRO CA C 10.873 -6.253 -1.361 1.00 . A A . 32 PRO CA 1 1 12 7317 1 1 32 PRO CB C 11.911 -7.234 -0.819 1.00 . A A . 32 PRO CB 1 1 12 7318 1 1 32 PRO CD C 10.165 -6.983 0.821 1.00 . A A . 32 PRO CD 1 1 12 7319 1 1 32 PRO CG C 11.181 -7.985 0.296 1.00 . A A . 32 PRO CG 1 1 12 7320 1 1 32 PRO HA H 11.344 -5.298 -1.604 1.00 . A A . 32 PRO HA 1 1 12 7321 1 1 32 PRO HB2 H 12.278 -7.908 -1.593 1.00 . A A . 32 PRO HB2 1 1 12 7322 1 1 32 PRO HB3 H 12.743 -6.684 -0.389 1.00 . A A . 32 PRO HB3 1 1 12 7323 1 1 32 PRO HD2 H 9.240 -7.480 1.111 1.00 . A A . 32 PRO HD2 1 1 12 7324 1 1 32 PRO HD3 H 10.593 -6.467 1.677 1.00 . A A . 32 PRO HD3 1 1 12 7325 1 1 32 PRO HG2 H 10.672 -8.858 -0.113 1.00 . A A . 32 PRO HG2 1 1 12 7326 1 1 32 PRO HG3 H 11.868 -8.261 1.092 1.00 . A A . 32 PRO HG3 1 1 12 7327 1 1 32 PRO N N 9.941 -6.039 -0.260 1.00 . A A . 32 PRO N 1 1 12 7328 1 1 32 PRO O O 10.419 -6.486 -3.732 1.00 . A A . 32 PRO O 1 1 12 7329 1 1 33 ALA C C 6.863 -7.446 -3.382 1.00 . A A . 33 ALA C 1 1 12 7330 1 1 33 ALA CA C 8.172 -8.234 -3.210 1.00 . A A . 33 ALA CA 1 1 12 7331 1 1 33 ALA CB C 7.886 -9.625 -2.646 1.00 . A A . 33 ALA CB 1 1 12 7332 1 1 33 ALA H H 8.921 -7.784 -1.315 1.00 . A A . 33 ALA H 1 1 12 7333 1 1 33 ALA HA H 8.647 -8.348 -4.188 1.00 . A A . 33 ALA HA 1 1 12 7334 1 1 33 ALA HB1 H 7.256 -10.171 -3.344 1.00 . A A . 33 ALA HB1 1 1 12 7335 1 1 33 ALA HB2 H 8.818 -10.178 -2.513 1.00 . A A . 33 ALA HB2 1 1 12 7336 1 1 33 ALA HB3 H 7.378 -9.530 -1.684 1.00 . A A . 33 ALA HB3 1 1 12 7337 1 1 33 ALA N N 9.084 -7.592 -2.291 1.00 . A A . 33 ALA N 1 1 12 7338 1 1 33 ALA O O 5.956 -7.931 -4.059 1.00 . A A . 33 ALA O 1 1 12 7339 1 1 34 GLY C C 5.057 -5.055 -4.159 1.00 . A A . 34 GLY C 1 1 12 7340 1 1 34 GLY CA C 5.409 -5.584 -2.765 1.00 . A A . 34 GLY CA 1 1 12 7341 1 1 34 GLY H H 7.470 -5.866 -2.242 1.00 . A A . 34 GLY H 1 1 12 7342 1 1 34 GLY HA2 H 5.406 -4.765 -2.054 1.00 . A A . 34 GLY HA2 1 1 12 7343 1 1 34 GLY HA3 H 4.633 -6.286 -2.467 1.00 . A A . 34 GLY HA3 1 1 12 7344 1 1 34 GLY N N 6.693 -6.284 -2.740 1.00 . A A . 34 GLY N 1 1 12 7345 1 1 34 GLY O O 3.880 -4.994 -4.499 1.00 . A A . 34 GLY O 1 1 12 7346 1 1 35 CYS C C 5.347 -5.585 -7.234 1.00 . A A . 35 CYS C 1 1 12 7347 1 1 35 CYS CA C 5.925 -4.425 -6.404 1.00 . A A . 35 CYS CA 1 1 12 7348 1 1 35 CYS CB C 7.315 -4.103 -6.968 1.00 . A A . 35 CYS CB 1 1 12 7349 1 1 35 CYS H H 6.998 -4.768 -4.614 1.00 . A A . 35 CYS H 1 1 12 7350 1 1 35 CYS HA H 5.272 -3.552 -6.489 1.00 . A A . 35 CYS HA 1 1 12 7351 1 1 35 CYS HB2 H 7.758 -5.056 -7.263 1.00 . A A . 35 CYS HB2 1 1 12 7352 1 1 35 CYS HB3 H 7.208 -3.494 -7.868 1.00 . A A . 35 CYS HB3 1 1 12 7353 1 1 35 CYS N N 6.062 -4.767 -4.987 1.00 . A A . 35 CYS N 1 1 12 7354 1 1 35 CYS O O 4.969 -5.397 -8.387 1.00 . A A . 35 CYS O 1 1 12 7355 1 1 35 CYS SG S 8.468 -3.310 -5.816 1.00 . A A . 35 CYS SG 1 1 12 7356 1 1 36 SER C C 3.483 -8.380 -6.547 1.00 . A A . 36 SER C 1 1 12 7357 1 1 36 SER CA C 4.807 -8.023 -7.242 1.00 . A A . 36 SER CA 1 1 12 7358 1 1 36 SER CB C 5.848 -9.140 -7.087 1.00 . A A . 36 SER CB 1 1 12 7359 1 1 36 SER H H 5.729 -6.894 -5.746 1.00 . A A . 36 SER H 1 1 12 7360 1 1 36 SER HA H 4.595 -7.879 -8.302 1.00 . A A . 36 SER HA 1 1 12 7361 1 1 36 SER HB2 H 6.470 -8.938 -6.214 1.00 . A A . 36 SER HB2 1 1 12 7362 1 1 36 SER HB3 H 5.353 -10.103 -6.960 1.00 . A A . 36 SER HB3 1 1 12 7363 1 1 36 SER HG H 6.284 -9.845 -8.828 1.00 . A A . 36 SER HG 1 1 12 7364 1 1 36 SER N N 5.356 -6.797 -6.680 1.00 . A A . 36 SER N 1 1 12 7365 1 1 36 SER O O 2.881 -9.403 -6.875 1.00 . A A . 36 SER O 1 1 12 7366 1 1 36 SER OG O 6.704 -9.215 -8.209 1.00 . A A . 36 SER OG 1 1 12 7367 1 1 37 ASN C C 0.860 -6.599 -5.814 1.00 . A A . 37 ASN C 1 1 12 7368 1 1 37 ASN CA C 1.653 -7.664 -5.071 1.00 . A A . 37 ASN CA 1 1 12 7369 1 1 37 ASN CB C 1.607 -7.457 -3.535 1.00 . A A . 37 ASN CB 1 1 12 7370 1 1 37 ASN CG C 0.814 -8.575 -2.868 1.00 . A A . 37 ASN CG 1 1 12 7371 1 1 37 ASN H H 3.488 -6.699 -5.404 1.00 . A A . 37 ASN H 1 1 12 7372 1 1 37 ASN HA H 1.232 -8.642 -5.294 1.00 . A A . 37 ASN HA 1 1 12 7373 1 1 37 ASN HB2 H 2.610 -7.376 -3.113 1.00 . A A . 37 ASN HB2 1 1 12 7374 1 1 37 ASN HB3 H 1.123 -6.520 -3.281 1.00 . A A . 37 ASN HB3 1 1 12 7375 1 1 37 ASN HD21 H -0.580 -7.300 -2.101 1.00 . A A . 37 ASN HD21 1 1 12 7376 1 1 37 ASN HD22 H -0.842 -9.003 -1.804 1.00 . A A . 37 ASN HD22 1 1 12 7377 1 1 37 ASN N N 3.007 -7.572 -5.594 1.00 . A A . 37 ASN N 1 1 12 7378 1 1 37 ASN ND2 N -0.288 -8.258 -2.210 1.00 . A A . 37 ASN ND2 1 1 12 7379 1 1 37 ASN O O 0.861 -5.455 -5.369 1.00 . A A . 37 ASN O 1 1 12 7380 1 1 37 ASN OD1 O 1.176 -9.742 -2.959 1.00 . A A . 37 ASN OD1 1 1 12 7381 1 1 38 SER C C -1.654 -5.260 -6.734 1.00 . A A . 38 SER C 1 1 12 7382 1 1 38 SER CA C -0.629 -5.939 -7.656 1.00 . A A . 38 SER CA 1 1 12 7383 1 1 38 SER CB C -1.305 -6.590 -8.843 1.00 . A A . 38 SER CB 1 1 12 7384 1 1 38 SER H H 0.262 -7.849 -7.305 1.00 . A A . 38 SER H 1 1 12 7385 1 1 38 SER HA H 0.005 -5.187 -8.100 1.00 . A A . 38 SER HA 1 1 12 7386 1 1 38 SER HB2 H -1.755 -7.513 -8.508 1.00 . A A . 38 SER HB2 1 1 12 7387 1 1 38 SER HB3 H -2.076 -5.923 -9.228 1.00 . A A . 38 SER HB3 1 1 12 7388 1 1 38 SER HG H 0.167 -7.628 -9.624 1.00 . A A . 38 SER HG 1 1 12 7389 1 1 38 SER N N 0.212 -6.909 -6.940 1.00 . A A . 38 SER N 1 1 12 7390 1 1 38 SER O O -1.926 -4.069 -6.894 1.00 . A A . 38 SER O 1 1 12 7391 1 1 38 SER OG O -0.357 -6.835 -9.863 1.00 . A A . 38 SER OG 1 1 12 7392 1 1 39 ASP C C -2.408 -4.206 -3.956 1.00 . A A . 39 ASP C 1 1 12 7393 1 1 39 ASP CA C -2.993 -5.453 -4.637 1.00 . A A . 39 ASP CA 1 1 12 7394 1 1 39 ASP CB C -3.219 -6.566 -3.603 1.00 . A A . 39 ASP CB 1 1 12 7395 1 1 39 ASP CG C -4.530 -6.445 -2.822 1.00 . A A . 39 ASP CG 1 1 12 7396 1 1 39 ASP H H -1.838 -6.942 -5.638 1.00 . A A . 39 ASP H 1 1 12 7397 1 1 39 ASP HA H -3.948 -5.204 -5.089 1.00 . A A . 39 ASP HA 1 1 12 7398 1 1 39 ASP HB2 H -3.225 -7.525 -4.118 1.00 . A A . 39 ASP HB2 1 1 12 7399 1 1 39 ASP HB3 H -2.382 -6.594 -2.907 1.00 . A A . 39 ASP HB3 1 1 12 7400 1 1 39 ASP N N -2.115 -5.967 -5.695 1.00 . A A . 39 ASP N 1 1 12 7401 1 1 39 ASP O O -3.130 -3.296 -3.559 1.00 . A A . 39 ASP O 1 1 12 7402 1 1 39 ASP OD1 O -4.609 -5.659 -1.856 1.00 . A A . 39 ASP OD1 1 1 12 7403 1 1 39 ASP OD2 O -5.446 -7.267 -3.088 1.00 . A A . 39 ASP OD2 1 1 12 7404 1 1 40 CYS C C 0.513 -2.270 -4.313 1.00 . A A . 40 CYS C 1 1 12 7405 1 1 40 CYS CA C -0.284 -3.070 -3.278 1.00 . A A . 40 CYS CA 1 1 12 7406 1 1 40 CYS CB C 0.651 -3.704 -2.232 1.00 . A A . 40 CYS CB 1 1 12 7407 1 1 40 CYS H H -0.548 -4.856 -4.353 1.00 . A A . 40 CYS H 1 1 12 7408 1 1 40 CYS HA H -0.946 -2.370 -2.767 1.00 . A A . 40 CYS HA 1 1 12 7409 1 1 40 CYS HB2 H 1.222 -4.526 -2.675 1.00 . A A . 40 CYS HB2 1 1 12 7410 1 1 40 CYS HB3 H 1.377 -2.968 -1.876 1.00 . A A . 40 CYS HB3 1 1 12 7411 1 1 40 CYS N N -1.078 -4.135 -3.878 1.00 . A A . 40 CYS N 1 1 12 7412 1 1 40 CYS O O 1.191 -1.321 -3.937 1.00 . A A . 40 CYS O 1 1 12 7413 1 1 40 CYS SG S -0.283 -4.284 -0.797 1.00 . A A . 40 CYS SG 1 1 12 7414 1 1 41 THR C C 1.066 -0.645 -6.943 1.00 . A A . 41 THR C 1 1 12 7415 1 1 41 THR CA C 1.415 -2.082 -6.567 1.00 . A A . 41 THR CA 1 1 12 7416 1 1 41 THR CB C 1.450 -3.037 -7.755 1.00 . A A . 41 THR CB 1 1 12 7417 1 1 41 THR CG2 C 2.186 -2.576 -8.995 1.00 . A A . 41 THR CG2 1 1 12 7418 1 1 41 THR H H -0.132 -3.364 -5.910 1.00 . A A . 41 THR H 1 1 12 7419 1 1 41 THR HA H 2.410 -2.064 -6.116 1.00 . A A . 41 THR HA 1 1 12 7420 1 1 41 THR HB H 0.418 -3.235 -8.043 1.00 . A A . 41 THR HB 1 1 12 7421 1 1 41 THR HG1 H 1.729 -4.501 -6.489 1.00 . A A . 41 THR HG1 1 1 12 7422 1 1 41 THR HG21 H 1.726 -1.667 -9.375 1.00 . A A . 41 THR HG21 1 1 12 7423 1 1 41 THR HG22 H 3.238 -2.404 -8.763 1.00 . A A . 41 THR HG22 1 1 12 7424 1 1 41 THR HG23 H 2.086 -3.366 -9.740 1.00 . A A . 41 THR HG23 1 1 12 7425 1 1 41 THR N N 0.483 -2.626 -5.595 1.00 . A A . 41 THR N 1 1 12 7426 1 1 41 THR O O 1.990 0.158 -6.997 1.00 . A A . 41 THR O 1 1 12 7427 1 1 41 THR OG1 O 2.107 -4.216 -7.337 1.00 . A A . 41 THR OG1 1 1 12 7428 1 1 42 ALA C C -0.201 1.987 -6.226 1.00 . A A . 42 ALA C 1 1 12 7429 1 1 42 ALA CA C -0.542 1.120 -7.434 1.00 . A A . 42 ALA CA 1 1 12 7430 1 1 42 ALA CB C -2.019 1.281 -7.793 1.00 . A A . 42 ALA CB 1 1 12 7431 1 1 42 ALA H H -0.955 -0.942 -7.002 1.00 . A A . 42 ALA H 1 1 12 7432 1 1 42 ALA HA H 0.052 1.449 -8.288 1.00 . A A . 42 ALA HA 1 1 12 7433 1 1 42 ALA HB1 H -2.246 0.703 -8.686 1.00 . A A . 42 ALA HB1 1 1 12 7434 1 1 42 ALA HB2 H -2.649 0.950 -6.969 1.00 . A A . 42 ALA HB2 1 1 12 7435 1 1 42 ALA HB3 H -2.220 2.339 -7.976 1.00 . A A . 42 ALA HB3 1 1 12 7436 1 1 42 ALA N N -0.207 -0.276 -7.141 1.00 . A A . 42 ALA N 1 1 12 7437 1 1 42 ALA O O 0.414 3.045 -6.370 1.00 . A A . 42 ALA O 1 1 12 7438 1 1 43 PHE C C 1.284 2.403 -3.742 1.00 . A A . 43 PHE C 1 1 12 7439 1 1 43 PHE CA C -0.216 2.122 -3.770 1.00 . A A . 43 PHE CA 1 1 12 7440 1 1 43 PHE CB C -0.708 1.248 -2.603 1.00 . A A . 43 PHE CB 1 1 12 7441 1 1 43 PHE CD1 C 0.996 1.661 -0.806 1.00 . A A . 43 PHE CD1 1 1 12 7442 1 1 43 PHE CD2 C -1.306 2.244 -0.321 1.00 . A A . 43 PHE CD2 1 1 12 7443 1 1 43 PHE CE1 C 1.403 2.152 0.434 1.00 . A A . 43 PHE CE1 1 1 12 7444 1 1 43 PHE CE2 C -0.905 2.671 0.960 1.00 . A A . 43 PHE CE2 1 1 12 7445 1 1 43 PHE CG C -0.342 1.749 -1.220 1.00 . A A . 43 PHE CG 1 1 12 7446 1 1 43 PHE CZ C 0.448 2.650 1.324 1.00 . A A . 43 PHE CZ 1 1 12 7447 1 1 43 PHE H H -1.065 0.619 -5.032 1.00 . A A . 43 PHE H 1 1 12 7448 1 1 43 PHE HA H -0.714 3.085 -3.708 1.00 . A A . 43 PHE HA 1 1 12 7449 1 1 43 PHE HB2 H -1.791 1.125 -2.676 1.00 . A A . 43 PHE HB2 1 1 12 7450 1 1 43 PHE HB3 H -0.255 0.269 -2.705 1.00 . A A . 43 PHE HB3 1 1 12 7451 1 1 43 PHE HD1 H 1.727 1.216 -1.449 1.00 . A A . 43 PHE HD1 1 1 12 7452 1 1 43 PHE HD2 H -2.350 2.259 -0.598 1.00 . A A . 43 PHE HD2 1 1 12 7453 1 1 43 PHE HE1 H 2.446 2.120 0.702 1.00 . A A . 43 PHE HE1 1 1 12 7454 1 1 43 PHE HE2 H -1.618 3.020 1.684 1.00 . A A . 43 PHE HE2 1 1 12 7455 1 1 43 PHE HZ H 0.772 2.985 2.295 1.00 . A A . 43 PHE HZ 1 1 12 7456 1 1 43 PHE N N -0.566 1.500 -5.035 1.00 . A A . 43 PHE N 1 1 12 7457 1 1 43 PHE O O 1.681 3.542 -3.510 1.00 . A A . 43 PHE O 1 1 12 7458 1 1 44 LEU C C 4.184 2.352 -4.971 1.00 . A A . 44 LEU C 1 1 12 7459 1 1 44 LEU CA C 3.571 1.586 -3.802 1.00 . A A . 44 LEU CA 1 1 12 7460 1 1 44 LEU CB C 4.287 0.247 -3.625 1.00 . A A . 44 LEU CB 1 1 12 7461 1 1 44 LEU CD1 C 4.519 -1.914 -2.440 1.00 . A A . 44 LEU CD1 1 1 12 7462 1 1 44 LEU CD2 C 4.193 0.226 -1.048 1.00 . A A . 44 LEU CD2 1 1 12 7463 1 1 44 LEU CG C 3.881 -0.522 -2.356 1.00 . A A . 44 LEU CG 1 1 12 7464 1 1 44 LEU H H 1.785 0.431 -3.945 1.00 . A A . 44 LEU H 1 1 12 7465 1 1 44 LEU HA H 3.720 2.185 -2.912 1.00 . A A . 44 LEU HA 1 1 12 7466 1 1 44 LEU HB2 H 4.103 -0.376 -4.500 1.00 . A A . 44 LEU HB2 1 1 12 7467 1 1 44 LEU HB3 H 5.350 0.450 -3.598 1.00 . A A . 44 LEU HB3 1 1 12 7468 1 1 44 LEU HD11 H 5.592 -1.829 -2.611 1.00 . A A . 44 LEU HD11 1 1 12 7469 1 1 44 LEU HD12 H 4.335 -2.477 -1.530 1.00 . A A . 44 LEU HD12 1 1 12 7470 1 1 44 LEU HD13 H 4.086 -2.457 -3.285 1.00 . A A . 44 LEU HD13 1 1 12 7471 1 1 44 LEU HD21 H 3.870 1.262 -1.074 1.00 . A A . 44 LEU HD21 1 1 12 7472 1 1 44 LEU HD22 H 3.649 -0.241 -0.230 1.00 . A A . 44 LEU HD22 1 1 12 7473 1 1 44 LEU HD23 H 5.253 0.206 -0.840 1.00 . A A . 44 LEU HD23 1 1 12 7474 1 1 44 LEU HG H 2.809 -0.667 -2.344 1.00 . A A . 44 LEU HG 1 1 12 7475 1 1 44 LEU N N 2.136 1.389 -3.930 1.00 . A A . 44 LEU N 1 1 12 7476 1 1 44 LEU O O 5.161 3.070 -4.762 1.00 . A A . 44 LEU O 1 1 12 7477 1 1 45 SER C C 3.875 4.524 -6.963 1.00 . A A . 45 SER C 1 1 12 7478 1 1 45 SER CA C 3.996 3.048 -7.328 1.00 . A A . 45 SER CA 1 1 12 7479 1 1 45 SER CB C 3.120 2.692 -8.534 1.00 . A A . 45 SER CB 1 1 12 7480 1 1 45 SER H H 2.879 1.557 -6.274 1.00 . A A . 45 SER H 1 1 12 7481 1 1 45 SER HA H 5.027 2.840 -7.590 1.00 . A A . 45 SER HA 1 1 12 7482 1 1 45 SER HB2 H 2.998 1.616 -8.601 1.00 . A A . 45 SER HB2 1 1 12 7483 1 1 45 SER HB3 H 2.135 3.142 -8.436 1.00 . A A . 45 SER HB3 1 1 12 7484 1 1 45 SER HG H 3.057 2.977 -10.448 1.00 . A A . 45 SER HG 1 1 12 7485 1 1 45 SER N N 3.627 2.235 -6.174 1.00 . A A . 45 SER N 1 1 12 7486 1 1 45 SER O O 4.779 5.310 -7.251 1.00 . A A . 45 SER O 1 1 12 7487 1 1 45 SER OG O 3.722 3.121 -9.734 1.00 . A A . 45 SER OG 1 1 12 7488 1 1 46 GLN C C 3.432 6.551 -4.623 1.00 . A A . 46 GLN C 1 1 12 7489 1 1 46 GLN CA C 2.536 6.240 -5.833 1.00 . A A . 46 GLN CA 1 1 12 7490 1 1 46 GLN CB C 1.019 6.411 -5.598 1.00 . A A . 46 GLN CB 1 1 12 7491 1 1 46 GLN CD C -1.231 6.049 -6.880 1.00 . A A . 46 GLN CD 1 1 12 7492 1 1 46 GLN CG C 0.270 6.320 -6.942 1.00 . A A . 46 GLN CG 1 1 12 7493 1 1 46 GLN H H 2.074 4.184 -6.101 1.00 . A A . 46 GLN H 1 1 12 7494 1 1 46 GLN HA H 2.828 6.922 -6.635 1.00 . A A . 46 GLN HA 1 1 12 7495 1 1 46 GLN HB2 H 0.653 5.648 -4.903 1.00 . A A . 46 GLN HB2 1 1 12 7496 1 1 46 GLN HB3 H 0.837 7.405 -5.198 1.00 . A A . 46 GLN HB3 1 1 12 7497 1 1 46 GLN HE21 H -1.620 7.415 -5.399 1.00 . A A . 46 GLN HE21 1 1 12 7498 1 1 46 GLN HE22 H -3.006 6.603 -6.048 1.00 . A A . 46 GLN HE22 1 1 12 7499 1 1 46 GLN HG2 H 0.417 7.247 -7.490 1.00 . A A . 46 GLN HG2 1 1 12 7500 1 1 46 GLN HG3 H 0.707 5.517 -7.534 1.00 . A A . 46 GLN HG3 1 1 12 7501 1 1 46 GLN N N 2.789 4.885 -6.280 1.00 . A A . 46 GLN N 1 1 12 7502 1 1 46 GLN NE2 N -1.994 6.733 -6.048 1.00 . A A . 46 GLN NE2 1 1 12 7503 1 1 46 GLN O O 4.180 7.531 -4.660 1.00 . A A . 46 GLN O 1 1 12 7504 1 1 46 GLN OE1 O -1.730 5.245 -7.667 1.00 . A A . 46 GLN OE1 1 1 12 7505 1 1 47 CYS C C 5.630 6.095 -2.477 1.00 . A A . 47 CYS C 1 1 12 7506 1 1 47 CYS CA C 4.106 6.058 -2.317 1.00 . A A . 47 CYS CA 1 1 12 7507 1 1 47 CYS CB C 3.706 5.110 -1.173 1.00 . A A . 47 CYS CB 1 1 12 7508 1 1 47 CYS H H 2.778 4.941 -3.582 1.00 . A A . 47 CYS H 1 1 12 7509 1 1 47 CYS HA H 3.780 7.061 -2.036 1.00 . A A . 47 CYS HA 1 1 12 7510 1 1 47 CYS HB2 H 2.710 4.711 -1.365 1.00 . A A . 47 CYS HB2 1 1 12 7511 1 1 47 CYS HB3 H 4.411 4.270 -1.093 1.00 . A A . 47 CYS HB3 1 1 12 7512 1 1 47 CYS N N 3.405 5.739 -3.560 1.00 . A A . 47 CYS N 1 1 12 7513 1 1 47 CYS O O 6.271 7.008 -1.953 1.00 . A A . 47 CYS O 1 1 12 7514 1 1 47 CYS SG S 3.668 5.996 0.410 1.00 . A A . 47 CYS SG 1 1 12 7515 1 1 48 TYR C C 8.139 5.299 -4.687 1.00 . A A . 48 TYR C 1 1 12 7516 1 1 48 TYR CA C 7.651 4.914 -3.294 1.00 . A A . 48 TYR CA 1 1 12 7517 1 1 48 TYR CB C 8.031 3.488 -2.935 1.00 . A A . 48 TYR CB 1 1 12 7518 1 1 48 TYR CD1 C 9.047 3.820 -0.642 1.00 . A A . 48 TYR CD1 1 1 12 7519 1 1 48 TYR CD2 C 7.015 2.514 -0.850 1.00 . A A . 48 TYR CD2 1 1 12 7520 1 1 48 TYR CE1 C 9.134 3.497 0.722 1.00 . A A . 48 TYR CE1 1 1 12 7521 1 1 48 TYR CE2 C 7.172 2.086 0.474 1.00 . A A . 48 TYR CE2 1 1 12 7522 1 1 48 TYR CG C 8.019 3.286 -1.438 1.00 . A A . 48 TYR CG 1 1 12 7523 1 1 48 TYR CZ C 8.212 2.587 1.281 1.00 . A A . 48 TYR CZ 1 1 12 7524 1 1 48 TYR H H 5.617 4.438 -3.631 1.00 . A A . 48 TYR H 1 1 12 7525 1 1 48 TYR HA H 8.180 5.480 -2.545 1.00 . A A . 48 TYR HA 1 1 12 7526 1 1 48 TYR HB2 H 7.371 2.774 -3.427 1.00 . A A . 48 TYR HB2 1 1 12 7527 1 1 48 TYR HB3 H 9.043 3.291 -3.288 1.00 . A A . 48 TYR HB3 1 1 12 7528 1 1 48 TYR HD1 H 9.801 4.449 -1.093 1.00 . A A . 48 TYR HD1 1 1 12 7529 1 1 48 TYR HD2 H 6.224 2.116 -1.466 1.00 . A A . 48 TYR HD2 1 1 12 7530 1 1 48 TYR HE1 H 9.941 3.915 1.307 1.00 . A A . 48 TYR HE1 1 1 12 7531 1 1 48 TYR HE2 H 6.521 1.322 0.843 1.00 . A A . 48 TYR HE2 1 1 12 7532 1 1 48 TYR HH H 8.869 2.840 3.060 1.00 . A A . 48 TYR HH 1 1 12 7533 1 1 48 TYR N N 6.212 5.107 -3.159 1.00 . A A . 48 TYR N 1 1 12 7534 1 1 48 TYR O O 9.070 6.094 -4.826 1.00 . A A . 48 TYR O 1 1 12 7535 1 1 48 TYR OH O 8.310 2.206 2.583 1.00 . A A . 48 TYR OH 1 1 12 7536 1 1 49 GLY C C 7.681 3.396 -7.762 1.00 . A A . 49 GLY C 1 1 12 7537 1 1 49 GLY CA C 7.996 4.733 -7.088 1.00 . A A . 49 GLY CA 1 1 12 7538 1 1 49 GLY H H 6.677 4.190 -5.525 1.00 . A A . 49 GLY H 1 1 12 7539 1 1 49 GLY HA2 H 9.076 4.883 -7.099 1.00 . A A . 49 GLY HA2 1 1 12 7540 1 1 49 GLY HA3 H 7.518 5.543 -7.639 1.00 . A A . 49 GLY HA3 1 1 12 7541 1 1 49 GLY N N 7.511 4.735 -5.714 1.00 . A A . 49 GLY N 1 1 12 7542 1 1 49 GLY O O 7.579 3.342 -8.991 1.00 . A A . 49 GLY O 1 1 12 7543 1 1 50 GLY C C 8.176 0.150 -7.678 1.00 . A A . 50 GLY C 1 1 12 7544 1 1 50 GLY CA C 6.982 1.040 -7.380 1.00 . A A . 50 GLY CA 1 1 12 7545 1 1 50 GLY H H 7.630 2.479 -5.976 1.00 . A A . 50 GLY H 1 1 12 7546 1 1 50 GLY HA2 H 6.364 1.122 -8.276 1.00 . A A . 50 GLY HA2 1 1 12 7547 1 1 50 GLY HA3 H 6.394 0.593 -6.577 1.00 . A A . 50 GLY HA3 1 1 12 7548 1 1 50 GLY N N 7.435 2.353 -6.956 1.00 . A A . 50 GLY N 1 1 12 7549 1 1 50 GLY O O 8.320 -0.302 -8.816 1.00 . A A . 50 GLY O 1 1 12 7550 1 1 51 CYS C C 11.279 0.581 -6.822 1.00 . A A . 51 CYS C 1 1 12 7551 1 1 51 CYS CA C 10.333 -0.596 -6.586 1.00 . A A . 51 CYS CA 1 1 12 7552 1 1 51 CYS CB C 10.600 -1.826 -7.476 1.00 . A A . 51 CYS CB 1 1 12 7553 1 1 51 CYS H H 8.747 0.441 -5.802 1.00 . A A . 51 CYS H 1 1 12 7554 1 1 51 CYS HA H 10.532 -0.907 -5.560 1.00 . A A . 51 CYS HA 1 1 12 7555 1 1 51 CYS HB2 H 10.064 -1.756 -8.415 1.00 . A A . 51 CYS HB2 1 1 12 7556 1 1 51 CYS HB3 H 11.655 -1.813 -7.739 1.00 . A A . 51 CYS HB3 1 1 12 7557 1 1 51 CYS N N 8.962 -0.104 -6.627 1.00 . A A . 51 CYS N 1 1 12 7558 1 1 51 CYS O O 12.498 0.323 -6.934 1.00 . A A . 51 CYS O 1 1 12 7559 1 1 51 CYS OXT O 10.822 1.743 -6.727 1.00 . A A . 51 CYS OXT 1 1 12 7560 1 1 51 CYS SG S 10.293 -3.441 -6.702 1.00 . A A . 51 CYS SG 1 1 13 7561 1 1 1 GLY C C -8.283 -5.728 -0.742 1.00 . A A . 1 GLY C 1 1 13 7562 1 1 1 GLY CA C -8.054 -6.982 -1.540 1.00 . A A . 1 GLY CA 1 1 13 7563 1 1 1 GLY H1 H -10.032 -7.145 -1.970 1.00 . A A . 1 GLY H1 1 1 13 7564 1 1 1 GLY H2 H -9.157 -6.375 -3.129 1.00 . A A . 1 GLY H2 1 1 13 7565 1 1 1 GLY H3 H -9.051 -8.017 -2.981 1.00 . A A . 1 GLY H3 1 1 13 7566 1 1 1 GLY HA2 H -7.117 -6.895 -2.086 1.00 . A A . 1 GLY HA2 1 1 13 7567 1 1 1 GLY HA3 H -8.012 -7.841 -0.872 1.00 . A A . 1 GLY HA3 1 1 13 7568 1 1 1 GLY N N -9.159 -7.147 -2.480 1.00 . A A . 1 GLY N 1 1 13 7569 1 1 1 GLY O O -8.699 -4.708 -1.292 1.00 . A A . 1 GLY O 1 1 13 7570 1 1 2 GLU C C -7.511 -3.427 1.037 1.00 . A A . 2 GLU C 1 1 13 7571 1 1 2 GLU CA C -8.198 -4.714 1.507 1.00 . A A . 2 GLU CA 1 1 13 7572 1 1 2 GLU CB C -7.811 -5.143 2.919 1.00 . A A . 2 GLU CB 1 1 13 7573 1 1 2 GLU CD C -6.785 -7.518 2.997 1.00 . A A . 2 GLU CD 1 1 13 7574 1 1 2 GLU CG C -6.550 -5.992 2.985 1.00 . A A . 2 GLU CG 1 1 13 7575 1 1 2 GLU H H -7.740 -6.692 0.959 1.00 . A A . 2 GLU H 1 1 13 7576 1 1 2 GLU HA H -9.235 -4.505 1.612 1.00 . A A . 2 GLU HA 1 1 13 7577 1 1 2 GLU HB2 H -7.648 -4.233 3.496 1.00 . A A . 2 GLU HB2 1 1 13 7578 1 1 2 GLU HB3 H -8.635 -5.689 3.378 1.00 . A A . 2 GLU HB3 1 1 13 7579 1 1 2 GLU HG2 H -5.915 -5.715 2.151 1.00 . A A . 2 GLU HG2 1 1 13 7580 1 1 2 GLU HG3 H -6.064 -5.690 3.897 1.00 . A A . 2 GLU HG3 1 1 13 7581 1 1 2 GLU N N -8.041 -5.806 0.560 1.00 . A A . 2 GLU N 1 1 13 7582 1 1 2 GLU O O -8.081 -2.341 1.167 1.00 . A A . 2 GLU O 1 1 13 7583 1 1 2 GLU OE1 O -7.466 -8.041 2.079 1.00 . A A . 2 GLU OE1 1 1 13 7584 1 1 2 GLU OE2 O -6.266 -8.204 3.907 1.00 . A A . 2 GLU OE2 1 1 13 7585 1 1 3 CYS C C -6.365 -1.812 -1.324 1.00 . A A . 3 CYS C 1 1 13 7586 1 1 3 CYS CA C -5.627 -2.407 -0.126 1.00 . A A . 3 CYS CA 1 1 13 7587 1 1 3 CYS CB C -4.274 -2.897 -0.602 1.00 . A A . 3 CYS CB 1 1 13 7588 1 1 3 CYS H H -5.881 -4.423 0.255 1.00 . A A . 3 CYS H 1 1 13 7589 1 1 3 CYS HA H -5.510 -1.650 0.650 1.00 . A A . 3 CYS HA 1 1 13 7590 1 1 3 CYS HB2 H -4.394 -3.823 -1.162 1.00 . A A . 3 CYS HB2 1 1 13 7591 1 1 3 CYS HB3 H -3.915 -2.163 -1.301 1.00 . A A . 3 CYS HB3 1 1 13 7592 1 1 3 CYS N N -6.326 -3.535 0.429 1.00 . A A . 3 CYS N 1 1 13 7593 1 1 3 CYS O O -6.517 -0.592 -1.395 1.00 . A A . 3 CYS O 1 1 13 7594 1 1 3 CYS SG S -2.997 -3.129 0.632 1.00 . A A . 3 CYS SG 1 1 13 7595 1 1 4 GLU C C -8.761 -1.503 -3.108 1.00 . A A . 4 GLU C 1 1 13 7596 1 1 4 GLU CA C -7.483 -2.260 -3.484 1.00 . A A . 4 GLU CA 1 1 13 7597 1 1 4 GLU CB C -7.837 -3.493 -4.336 1.00 . A A . 4 GLU CB 1 1 13 7598 1 1 4 GLU CD C -7.000 -5.593 -5.561 1.00 . A A . 4 GLU CD 1 1 13 7599 1 1 4 GLU CG C -6.619 -4.298 -4.827 1.00 . A A . 4 GLU CG 1 1 13 7600 1 1 4 GLU H H -6.592 -3.646 -2.141 1.00 . A A . 4 GLU H 1 1 13 7601 1 1 4 GLU HA H -6.840 -1.596 -4.064 1.00 . A A . 4 GLU HA 1 1 13 7602 1 1 4 GLU HB2 H -8.481 -4.151 -3.755 1.00 . A A . 4 GLU HB2 1 1 13 7603 1 1 4 GLU HB3 H -8.412 -3.159 -5.200 1.00 . A A . 4 GLU HB3 1 1 13 7604 1 1 4 GLU HG2 H -6.005 -3.678 -5.478 1.00 . A A . 4 GLU HG2 1 1 13 7605 1 1 4 GLU HG3 H -6.013 -4.566 -3.966 1.00 . A A . 4 GLU HG3 1 1 13 7606 1 1 4 GLU N N -6.775 -2.658 -2.273 1.00 . A A . 4 GLU N 1 1 13 7607 1 1 4 GLU O O -9.070 -0.466 -3.699 1.00 . A A . 4 GLU O 1 1 13 7608 1 1 4 GLU OE1 O -8.204 -5.826 -5.827 1.00 . A A . 4 GLU OE1 1 1 13 7609 1 1 4 GLU OE2 O -6.111 -6.442 -5.813 1.00 . A A . 4 GLU OE2 1 1 13 7610 1 1 5 GLN C C -10.430 -0.026 -1.037 1.00 . A A . 5 GLN C 1 1 13 7611 1 1 5 GLN CA C -10.725 -1.406 -1.639 1.00 . A A . 5 GLN CA 1 1 13 7612 1 1 5 GLN CB C -11.428 -2.368 -0.661 1.00 . A A . 5 GLN CB 1 1 13 7613 1 1 5 GLN CD C -13.514 -0.944 -0.225 1.00 . A A . 5 GLN CD 1 1 13 7614 1 1 5 GLN CG C -12.959 -2.264 -0.740 1.00 . A A . 5 GLN CG 1 1 13 7615 1 1 5 GLN H H -9.164 -2.865 -1.675 1.00 . A A . 5 GLN H 1 1 13 7616 1 1 5 GLN HA H -11.364 -1.269 -2.513 1.00 . A A . 5 GLN HA 1 1 13 7617 1 1 5 GLN HB2 H -11.171 -3.394 -0.929 1.00 . A A . 5 GLN HB2 1 1 13 7618 1 1 5 GLN HB3 H -11.084 -2.196 0.360 1.00 . A A . 5 GLN HB3 1 1 13 7619 1 1 5 GLN HE21 H -13.836 -0.259 -2.106 1.00 . A A . 5 GLN HE21 1 1 13 7620 1 1 5 GLN HE22 H -14.231 0.849 -0.790 1.00 . A A . 5 GLN HE22 1 1 13 7621 1 1 5 GLN HG2 H -13.273 -2.425 -1.770 1.00 . A A . 5 GLN HG2 1 1 13 7622 1 1 5 GLN HG3 H -13.400 -3.063 -0.150 1.00 . A A . 5 GLN HG3 1 1 13 7623 1 1 5 GLN N N -9.491 -2.009 -2.112 1.00 . A A . 5 GLN N 1 1 13 7624 1 1 5 GLN NE2 N -13.904 -0.052 -1.115 1.00 . A A . 5 GLN NE2 1 1 13 7625 1 1 5 GLN O O -11.102 0.941 -1.390 1.00 . A A . 5 GLN O 1 1 13 7626 1 1 5 GLN OE1 O -13.618 -0.731 0.983 1.00 . A A . 5 GLN OE1 1 1 13 7627 1 1 6 CYS C C -8.697 2.412 -0.705 1.00 . A A . 6 CYS C 1 1 13 7628 1 1 6 CYS CA C -8.978 1.366 0.381 1.00 . A A . 6 CYS CA 1 1 13 7629 1 1 6 CYS CB C -7.739 1.167 1.264 1.00 . A A . 6 CYS CB 1 1 13 7630 1 1 6 CYS H H -8.875 -0.745 0.056 1.00 . A A . 6 CYS H 1 1 13 7631 1 1 6 CYS HA H -9.797 1.729 1.004 1.00 . A A . 6 CYS HA 1 1 13 7632 1 1 6 CYS HB2 H -7.772 0.177 1.710 1.00 . A A . 6 CYS HB2 1 1 13 7633 1 1 6 CYS HB3 H -6.845 1.211 0.645 1.00 . A A . 6 CYS HB3 1 1 13 7634 1 1 6 CYS N N -9.392 0.089 -0.197 1.00 . A A . 6 CYS N 1 1 13 7635 1 1 6 CYS O O -9.031 3.585 -0.536 1.00 . A A . 6 CYS O 1 1 13 7636 1 1 6 CYS SG S -7.585 2.388 2.595 1.00 . A A . 6 CYS SG 1 1 13 7637 1 1 7 PHE C C -9.143 3.326 -3.642 1.00 . A A . 7 PHE C 1 1 13 7638 1 1 7 PHE CA C -7.857 2.840 -2.983 1.00 . A A . 7 PHE CA 1 1 13 7639 1 1 7 PHE CB C -6.989 2.094 -4.002 1.00 . A A . 7 PHE CB 1 1 13 7640 1 1 7 PHE CD1 C -4.592 2.535 -3.394 1.00 . A A . 7 PHE CD1 1 1 13 7641 1 1 7 PHE CD2 C -5.578 3.785 -5.234 1.00 . A A . 7 PHE CD2 1 1 13 7642 1 1 7 PHE CE1 C -3.387 3.224 -3.590 1.00 . A A . 7 PHE CE1 1 1 13 7643 1 1 7 PHE CE2 C -4.375 4.482 -5.412 1.00 . A A . 7 PHE CE2 1 1 13 7644 1 1 7 PHE CG C -5.684 2.805 -4.232 1.00 . A A . 7 PHE CG 1 1 13 7645 1 1 7 PHE CZ C -3.269 4.202 -4.591 1.00 . A A . 7 PHE CZ 1 1 13 7646 1 1 7 PHE H H -7.856 1.010 -1.892 1.00 . A A . 7 PHE H 1 1 13 7647 1 1 7 PHE HA H -7.314 3.722 -2.635 1.00 . A A . 7 PHE HA 1 1 13 7648 1 1 7 PHE HB2 H -6.780 1.078 -3.664 1.00 . A A . 7 PHE HB2 1 1 13 7649 1 1 7 PHE HB3 H -7.513 2.008 -4.955 1.00 . A A . 7 PHE HB3 1 1 13 7650 1 1 7 PHE HD1 H -4.695 1.839 -2.571 1.00 . A A . 7 PHE HD1 1 1 13 7651 1 1 7 PHE HD2 H -6.430 4.048 -5.846 1.00 . A A . 7 PHE HD2 1 1 13 7652 1 1 7 PHE HE1 H -2.563 3.054 -2.920 1.00 . A A . 7 PHE HE1 1 1 13 7653 1 1 7 PHE HE2 H -4.343 5.264 -6.154 1.00 . A A . 7 PHE HE2 1 1 13 7654 1 1 7 PHE HZ H -2.348 4.769 -4.680 1.00 . A A . 7 PHE HZ 1 1 13 7655 1 1 7 PHE N N -8.118 1.985 -1.832 1.00 . A A . 7 PHE N 1 1 13 7656 1 1 7 PHE O O -9.247 4.511 -3.963 1.00 . A A . 7 PHE O 1 1 13 7657 1 1 8 SER C C -12.007 3.902 -3.409 1.00 . A A . 8 SER C 1 1 13 7658 1 1 8 SER CA C -11.455 2.787 -4.299 1.00 . A A . 8 SER CA 1 1 13 7659 1 1 8 SER CB C -12.376 1.554 -4.275 1.00 . A A . 8 SER CB 1 1 13 7660 1 1 8 SER H H -9.956 1.475 -3.533 1.00 . A A . 8 SER H 1 1 13 7661 1 1 8 SER HA H -11.370 3.166 -5.319 1.00 . A A . 8 SER HA 1 1 13 7662 1 1 8 SER HB2 H -11.809 0.668 -3.981 1.00 . A A . 8 SER HB2 1 1 13 7663 1 1 8 SER HB3 H -13.176 1.704 -3.548 1.00 . A A . 8 SER HB3 1 1 13 7664 1 1 8 SER HG H -13.923 1.218 -5.445 1.00 . A A . 8 SER HG 1 1 13 7665 1 1 8 SER N N -10.120 2.429 -3.831 1.00 . A A . 8 SER N 1 1 13 7666 1 1 8 SER O O -12.524 4.903 -3.907 1.00 . A A . 8 SER O 1 1 13 7667 1 1 8 SER OG O -12.954 1.327 -5.548 1.00 . A A . 8 SER OG 1 1 13 7668 1 1 9 ASP C C -11.456 5.924 -0.913 1.00 . A A . 9 ASP C 1 1 13 7669 1 1 9 ASP CA C -12.348 4.679 -1.080 1.00 . A A . 9 ASP CA 1 1 13 7670 1 1 9 ASP CB C -12.482 3.887 0.228 1.00 . A A . 9 ASP CB 1 1 13 7671 1 1 9 ASP CG C -13.601 4.406 1.125 1.00 . A A . 9 ASP CG 1 1 13 7672 1 1 9 ASP H H -11.370 2.928 -1.760 1.00 . A A . 9 ASP H 1 1 13 7673 1 1 9 ASP HA H -13.341 5.009 -1.390 1.00 . A A . 9 ASP HA 1 1 13 7674 1 1 9 ASP HB2 H -12.716 2.847 -0.008 1.00 . A A . 9 ASP HB2 1 1 13 7675 1 1 9 ASP HB3 H -11.538 3.887 0.775 1.00 . A A . 9 ASP HB3 1 1 13 7676 1 1 9 ASP N N -11.836 3.766 -2.095 1.00 . A A . 9 ASP N 1 1 13 7677 1 1 9 ASP O O -11.247 6.427 0.195 1.00 . A A . 9 ASP O 1 1 13 7678 1 1 9 ASP OD1 O -14.126 5.524 0.932 1.00 . A A . 9 ASP OD1 1 1 13 7679 1 1 9 ASP OD2 O -14.046 3.601 1.976 1.00 . A A . 9 ASP OD2 1 1 13 7680 1 1 10 GLY C C -8.736 7.593 -1.544 1.00 . A A . 10 GLY C 1 1 13 7681 1 1 10 GLY CA C -10.162 7.681 -2.095 1.00 . A A . 10 GLY CA 1 1 13 7682 1 1 10 GLY H H -11.083 5.934 -2.885 1.00 . A A . 10 GLY H 1 1 13 7683 1 1 10 GLY HA2 H -10.699 8.455 -1.546 1.00 . A A . 10 GLY HA2 1 1 13 7684 1 1 10 GLY HA3 H -10.105 7.981 -3.141 1.00 . A A . 10 GLY HA3 1 1 13 7685 1 1 10 GLY N N -10.919 6.438 -2.021 1.00 . A A . 10 GLY N 1 1 13 7686 1 1 10 GLY O O -8.138 8.642 -1.272 1.00 . A A . 10 GLY O 1 1 13 7687 1 1 11 GLY C C -5.778 6.565 -1.719 1.00 . A A . 11 GLY C 1 1 13 7688 1 1 11 GLY CA C -6.899 6.136 -0.780 1.00 . A A . 11 GLY CA 1 1 13 7689 1 1 11 GLY H H -8.760 5.568 -1.610 1.00 . A A . 11 GLY H 1 1 13 7690 1 1 11 GLY HA2 H -6.791 5.069 -0.593 1.00 . A A . 11 GLY HA2 1 1 13 7691 1 1 11 GLY HA3 H -6.828 6.665 0.166 1.00 . A A . 11 GLY HA3 1 1 13 7692 1 1 11 GLY N N -8.216 6.379 -1.348 1.00 . A A . 11 GLY N 1 1 13 7693 1 1 11 GLY O O -5.946 6.525 -2.938 1.00 . A A . 11 GLY O 1 1 13 7694 1 1 12 ASP C C -2.307 6.248 -1.277 1.00 . A A . 12 ASP C 1 1 13 7695 1 1 12 ASP CA C -3.381 7.157 -1.871 1.00 . A A . 12 ASP CA 1 1 13 7696 1 1 12 ASP CB C -2.934 8.632 -1.895 1.00 . A A . 12 ASP CB 1 1 13 7697 1 1 12 ASP CG C -3.210 9.446 -0.626 1.00 . A A . 12 ASP CG 1 1 13 7698 1 1 12 ASP H H -4.585 6.910 -0.136 1.00 . A A . 12 ASP H 1 1 13 7699 1 1 12 ASP HA H -3.526 6.831 -2.906 1.00 . A A . 12 ASP HA 1 1 13 7700 1 1 12 ASP HB2 H -1.871 8.689 -2.137 1.00 . A A . 12 ASP HB2 1 1 13 7701 1 1 12 ASP HB3 H -3.478 9.105 -2.709 1.00 . A A . 12 ASP HB3 1 1 13 7702 1 1 12 ASP N N -4.633 6.951 -1.144 1.00 . A A . 12 ASP N 1 1 13 7703 1 1 12 ASP O O -2.027 5.176 -1.805 1.00 . A A . 12 ASP O 1 1 13 7704 1 1 12 ASP OD1 O -2.570 9.192 0.421 1.00 . A A . 12 ASP OD1 1 1 13 7705 1 1 12 ASP OD2 O -3.997 10.418 -0.688 1.00 . A A . 12 ASP OD2 1 1 13 7706 1 1 13 CYS C C -1.010 6.236 2.098 1.00 . A A . 13 CYS C 1 1 13 7707 1 1 13 CYS CA C -0.783 5.875 0.639 1.00 . A A . 13 CYS CA 1 1 13 7708 1 1 13 CYS CB C 0.660 6.164 0.213 1.00 . A A . 13 CYS CB 1 1 13 7709 1 1 13 CYS H H -2.005 7.548 0.217 1.00 . A A . 13 CYS H 1 1 13 7710 1 1 13 CYS HA H -0.989 4.821 0.496 1.00 . A A . 13 CYS HA 1 1 13 7711 1 1 13 CYS HB2 H 0.766 5.879 -0.834 1.00 . A A . 13 CYS HB2 1 1 13 7712 1 1 13 CYS HB3 H 0.858 7.236 0.291 1.00 . A A . 13 CYS HB3 1 1 13 7713 1 1 13 CYS N N -1.715 6.648 -0.156 1.00 . A A . 13 CYS N 1 1 13 7714 1 1 13 CYS O O -1.351 5.383 2.918 1.00 . A A . 13 CYS O 1 1 13 7715 1 1 13 CYS SG S 1.900 5.270 1.190 1.00 . A A . 13 CYS SG 1 1 13 7716 1 1 14 THR C C -2.386 7.651 4.295 1.00 . A A . 14 THR C 1 1 13 7717 1 1 14 THR CA C -1.059 8.114 3.710 1.00 . A A . 14 THR CA 1 1 13 7718 1 1 14 THR CB C -0.920 9.638 3.550 1.00 . A A . 14 THR CB 1 1 13 7719 1 1 14 THR CG2 C -1.400 10.507 4.705 1.00 . A A . 14 THR CG2 1 1 13 7720 1 1 14 THR H H -0.604 8.181 1.669 1.00 . A A . 14 THR H 1 1 13 7721 1 1 14 THR HA H -0.277 7.747 4.369 1.00 . A A . 14 THR HA 1 1 13 7722 1 1 14 THR HB H -1.493 9.949 2.678 1.00 . A A . 14 THR HB 1 1 13 7723 1 1 14 THR HG1 H 0.532 10.054 2.359 1.00 . A A . 14 THR HG1 1 1 13 7724 1 1 14 THR HG21 H -0.848 10.292 5.613 1.00 . A A . 14 THR HG21 1 1 13 7725 1 1 14 THR HG22 H -1.264 11.552 4.444 1.00 . A A . 14 THR HG22 1 1 13 7726 1 1 14 THR HG23 H -2.466 10.355 4.859 1.00 . A A . 14 THR HG23 1 1 13 7727 1 1 14 THR N N -0.855 7.527 2.402 1.00 . A A . 14 THR N 1 1 13 7728 1 1 14 THR O O -2.397 7.063 5.383 1.00 . A A . 14 THR O 1 1 13 7729 1 1 14 THR OG1 O 0.451 9.899 3.322 1.00 . A A . 14 THR OG1 1 1 13 7730 1 1 15 THR C C -5.263 6.161 4.070 1.00 . A A . 15 THR C 1 1 13 7731 1 1 15 THR CA C -4.799 7.633 4.192 1.00 . A A . 15 THR CA 1 1 13 7732 1 1 15 THR CB C -5.713 8.709 3.558 1.00 . A A . 15 THR CB 1 1 13 7733 1 1 15 THR CG2 C -6.414 8.326 2.254 1.00 . A A . 15 THR CG2 1 1 13 7734 1 1 15 THR H H -3.445 8.280 2.667 1.00 . A A . 15 THR H 1 1 13 7735 1 1 15 THR HA H -4.723 7.868 5.253 1.00 . A A . 15 THR HA 1 1 13 7736 1 1 15 THR HB H -5.070 9.544 3.280 1.00 . A A . 15 THR HB 1 1 13 7737 1 1 15 THR HG1 H -7.483 9.348 4.087 1.00 . A A . 15 THR HG1 1 1 13 7738 1 1 15 THR HG21 H -5.675 7.945 1.549 1.00 . A A . 15 THR HG21 1 1 13 7739 1 1 15 THR HG22 H -7.183 7.572 2.426 1.00 . A A . 15 THR HG22 1 1 13 7740 1 1 15 THR HG23 H -6.881 9.207 1.815 1.00 . A A . 15 THR HG23 1 1 13 7741 1 1 15 THR N N -3.495 7.832 3.574 1.00 . A A . 15 THR N 1 1 13 7742 1 1 15 THR O O -6.454 5.874 4.143 1.00 . A A . 15 THR O 1 1 13 7743 1 1 15 THR OG1 O -6.609 9.238 4.514 1.00 . A A . 15 THR OG1 1 1 13 7744 1 1 16 CYS C C -3.276 3.076 4.758 1.00 . A A . 16 CYS C 1 1 13 7745 1 1 16 CYS CA C -4.486 3.748 4.078 1.00 . A A . 16 CYS CA 1 1 13 7746 1 1 16 CYS CB C -4.654 3.314 2.609 1.00 . A A . 16 CYS CB 1 1 13 7747 1 1 16 CYS H H -3.357 5.520 4.104 1.00 . A A . 16 CYS H 1 1 13 7748 1 1 16 CYS HA H -5.375 3.428 4.629 1.00 . A A . 16 CYS HA 1 1 13 7749 1 1 16 CYS HB2 H -3.865 3.786 2.024 1.00 . A A . 16 CYS HB2 1 1 13 7750 1 1 16 CYS HB3 H -4.530 2.235 2.517 1.00 . A A . 16 CYS HB3 1 1 13 7751 1 1 16 CYS N N -4.320 5.207 4.135 1.00 . A A . 16 CYS N 1 1 13 7752 1 1 16 CYS O O -2.903 1.954 4.406 1.00 . A A . 16 CYS O 1 1 13 7753 1 1 16 CYS SG S -6.258 3.748 1.868 1.00 . A A . 16 CYS SG 1 1 13 7754 1 1 17 PHE C C -1.789 3.321 8.030 1.00 . A A . 17 PHE C 1 1 13 7755 1 1 17 PHE CA C -1.530 3.237 6.519 1.00 . A A . 17 PHE CA 1 1 13 7756 1 1 17 PHE CB C -0.243 3.995 6.119 1.00 . A A . 17 PHE CB 1 1 13 7757 1 1 17 PHE CD1 C 1.574 2.222 6.183 1.00 . A A . 17 PHE CD1 1 1 13 7758 1 1 17 PHE CD2 C 1.695 4.037 7.795 1.00 . A A . 17 PHE CD2 1 1 13 7759 1 1 17 PHE CE1 C 2.662 1.576 6.807 1.00 . A A . 17 PHE CE1 1 1 13 7760 1 1 17 PHE CE2 C 2.826 3.425 8.367 1.00 . A A . 17 PHE CE2 1 1 13 7761 1 1 17 PHE CG C 1.047 3.424 6.702 1.00 . A A . 17 PHE CG 1 1 13 7762 1 1 17 PHE CZ C 3.278 2.179 7.908 1.00 . A A . 17 PHE CZ 1 1 13 7763 1 1 17 PHE H H -3.033 4.663 5.979 1.00 . A A . 17 PHE H 1 1 13 7764 1 1 17 PHE HA H -1.377 2.170 6.285 1.00 . A A . 17 PHE HA 1 1 13 7765 1 1 17 PHE HB2 H -0.154 3.970 5.033 1.00 . A A . 17 PHE HB2 1 1 13 7766 1 1 17 PHE HB3 H -0.340 5.041 6.411 1.00 . A A . 17 PHE HB3 1 1 13 7767 1 1 17 PHE HD1 H 1.072 1.722 5.373 1.00 . A A . 17 PHE HD1 1 1 13 7768 1 1 17 PHE HD2 H 1.330 4.961 8.236 1.00 . A A . 17 PHE HD2 1 1 13 7769 1 1 17 PHE HE1 H 2.994 0.588 6.494 1.00 . A A . 17 PHE HE1 1 1 13 7770 1 1 17 PHE HE2 H 3.336 3.879 9.207 1.00 . A A . 17 PHE HE2 1 1 13 7771 1 1 17 PHE HZ H 4.069 1.657 8.427 1.00 . A A . 17 PHE HZ 1 1 13 7772 1 1 17 PHE N N -2.664 3.749 5.747 1.00 . A A . 17 PHE N 1 1 13 7773 1 1 17 PHE O O -1.263 2.487 8.754 1.00 . A A . 17 PHE O 1 1 13 7774 1 1 18 ASN C C -1.667 4.304 10.962 1.00 . A A . 18 ASN C 1 1 13 7775 1 1 18 ASN CA C -2.892 4.308 10.017 1.00 . A A . 18 ASN CA 1 1 13 7776 1 1 18 ASN CB C -3.854 3.162 10.378 1.00 . A A . 18 ASN CB 1 1 13 7777 1 1 18 ASN CG C -4.791 3.526 11.523 1.00 . A A . 18 ASN CG 1 1 13 7778 1 1 18 ASN H H -3.044 4.926 7.980 1.00 . A A . 18 ASN H 1 1 13 7779 1 1 18 ASN HA H -3.431 5.241 10.184 1.00 . A A . 18 ASN HA 1 1 13 7780 1 1 18 ASN HB2 H -4.470 2.925 9.514 1.00 . A A . 18 ASN HB2 1 1 13 7781 1 1 18 ASN HB3 H -3.284 2.268 10.632 1.00 . A A . 18 ASN HB3 1 1 13 7782 1 1 18 ASN HD21 H -3.495 2.915 12.944 1.00 . A A . 18 ASN HD21 1 1 13 7783 1 1 18 ASN HD22 H -5.041 3.455 13.542 1.00 . A A . 18 ASN HD22 1 1 13 7784 1 1 18 ASN N N -2.574 4.252 8.575 1.00 . A A . 18 ASN N 1 1 13 7785 1 1 18 ASN ND2 N -4.413 3.303 12.770 1.00 . A A . 18 ASN ND2 1 1 13 7786 1 1 18 ASN O O -1.803 4.080 12.163 1.00 . A A . 18 ASN O 1 1 13 7787 1 1 18 ASN OD1 O -5.865 4.070 11.291 1.00 . A A . 18 ASN OD1 1 1 13 7788 1 1 19 ASN C C 1.068 2.895 11.567 1.00 . A A . 19 ASN C 1 1 13 7789 1 1 19 ASN CA C 0.817 4.339 11.128 1.00 . A A . 19 ASN CA 1 1 13 7790 1 1 19 ASN CB C 1.160 5.449 12.126 1.00 . A A . 19 ASN CB 1 1 13 7791 1 1 19 ASN CG C 2.505 6.077 11.783 1.00 . A A . 19 ASN CG 1 1 13 7792 1 1 19 ASN H H -0.426 4.729 9.457 1.00 . A A . 19 ASN H 1 1 13 7793 1 1 19 ASN HA H 1.542 4.470 10.338 1.00 . A A . 19 ASN HA 1 1 13 7794 1 1 19 ASN HB2 H 0.414 6.228 12.028 1.00 . A A . 19 ASN HB2 1 1 13 7795 1 1 19 ASN HB3 H 1.151 5.066 13.147 1.00 . A A . 19 ASN HB3 1 1 13 7796 1 1 19 ASN HD21 H 3.340 5.690 13.611 1.00 . A A . 19 ASN HD21 1 1 13 7797 1 1 19 ASN HD22 H 4.325 6.588 12.457 1.00 . A A . 19 ASN HD22 1 1 13 7798 1 1 19 ASN N N -0.460 4.548 10.446 1.00 . A A . 19 ASN N 1 1 13 7799 1 1 19 ASN ND2 N 3.452 6.125 12.696 1.00 . A A . 19 ASN ND2 1 1 13 7800 1 1 19 ASN O O 1.111 2.569 12.751 1.00 . A A . 19 ASN O 1 1 13 7801 1 1 19 ASN OD1 O 2.679 6.553 10.661 1.00 . A A . 19 ASN OD1 1 1 13 7802 1 1 20 GLY C C 0.775 -0.450 10.873 1.00 . A A . 20 GLY C 1 1 13 7803 1 1 20 GLY CA C 1.761 0.698 10.616 1.00 . A A . 20 GLY CA 1 1 13 7804 1 1 20 GLY H H 1.014 2.377 9.633 1.00 . A A . 20 GLY H 1 1 13 7805 1 1 20 GLY HA2 H 2.598 0.709 11.312 1.00 . A A . 20 GLY HA2 1 1 13 7806 1 1 20 GLY HA3 H 2.202 0.522 9.636 1.00 . A A . 20 GLY HA3 1 1 13 7807 1 1 20 GLY N N 1.137 2.017 10.565 1.00 . A A . 20 GLY N 1 1 13 7808 1 1 20 GLY O O 1.191 -1.583 11.117 1.00 . A A . 20 GLY O 1 1 13 7809 1 1 21 THR C C -2.811 -0.963 10.151 1.00 . A A . 21 THR C 1 1 13 7810 1 1 21 THR CA C -1.619 -1.093 11.139 1.00 . A A . 21 THR CA 1 1 13 7811 1 1 21 THR CB C -1.864 -0.833 12.645 1.00 . A A . 21 THR CB 1 1 13 7812 1 1 21 THR CG2 C -3.288 -0.617 13.132 1.00 . A A . 21 THR CG2 1 1 13 7813 1 1 21 THR H H -0.815 0.731 10.493 1.00 . A A . 21 THR H 1 1 13 7814 1 1 21 THR HA H -1.270 -2.116 11.052 1.00 . A A . 21 THR HA 1 1 13 7815 1 1 21 THR HB H -1.342 0.085 12.898 1.00 . A A . 21 THR HB 1 1 13 7816 1 1 21 THR HG1 H -0.589 -1.405 13.976 1.00 . A A . 21 THR HG1 1 1 13 7817 1 1 21 THR HG21 H -3.720 0.205 12.563 1.00 . A A . 21 THR HG21 1 1 13 7818 1 1 21 THR HG22 H -3.877 -1.521 13.001 1.00 . A A . 21 THR HG22 1 1 13 7819 1 1 21 THR HG23 H -3.280 -0.348 14.187 1.00 . A A . 21 THR HG23 1 1 13 7820 1 1 21 THR N N -0.532 -0.192 10.770 1.00 . A A . 21 THR N 1 1 13 7821 1 1 21 THR O O -3.887 -1.513 10.379 1.00 . A A . 21 THR O 1 1 13 7822 1 1 21 THR OG1 O -1.242 -1.856 13.400 1.00 . A A . 21 THR OG1 1 1 13 7823 1 1 22 GLY C C -3.676 -1.291 6.997 1.00 . A A . 22 GLY C 1 1 13 7824 1 1 22 GLY CA C -3.623 -0.097 7.965 1.00 . A A . 22 GLY CA 1 1 13 7825 1 1 22 GLY H H -1.681 0.034 8.803 1.00 . A A . 22 GLY H 1 1 13 7826 1 1 22 GLY HA2 H -3.388 0.807 7.404 1.00 . A A . 22 GLY HA2 1 1 13 7827 1 1 22 GLY HA3 H -4.605 0.024 8.422 1.00 . A A . 22 GLY HA3 1 1 13 7828 1 1 22 GLY N N -2.619 -0.270 9.019 1.00 . A A . 22 GLY N 1 1 13 7829 1 1 22 GLY O O -3.000 -2.295 7.227 1.00 . A A . 22 GLY O 1 1 13 7830 1 1 23 PRO C C -3.275 -2.528 4.169 1.00 . A A . 23 PRO C 1 1 13 7831 1 1 23 PRO CA C -4.581 -2.295 4.933 1.00 . A A . 23 PRO CA 1 1 13 7832 1 1 23 PRO CB C -5.711 -1.883 3.981 1.00 . A A . 23 PRO CB 1 1 13 7833 1 1 23 PRO CD C -5.254 -0.058 5.504 1.00 . A A . 23 PRO CD 1 1 13 7834 1 1 23 PRO CG C -5.770 -0.360 4.098 1.00 . A A . 23 PRO CG 1 1 13 7835 1 1 23 PRO HA H -4.857 -3.216 5.449 1.00 . A A . 23 PRO HA 1 1 13 7836 1 1 23 PRO HB2 H -5.518 -2.197 2.949 1.00 . A A . 23 PRO HB2 1 1 13 7837 1 1 23 PRO HB3 H -6.648 -2.303 4.340 1.00 . A A . 23 PRO HB3 1 1 13 7838 1 1 23 PRO HD2 H -4.667 0.852 5.501 1.00 . A A . 23 PRO HD2 1 1 13 7839 1 1 23 PRO HD3 H -6.088 0.098 6.182 1.00 . A A . 23 PRO HD3 1 1 13 7840 1 1 23 PRO HG2 H -5.110 0.092 3.358 1.00 . A A . 23 PRO HG2 1 1 13 7841 1 1 23 PRO HG3 H -6.790 0.001 3.973 1.00 . A A . 23 PRO HG3 1 1 13 7842 1 1 23 PRO N N -4.455 -1.208 5.902 1.00 . A A . 23 PRO N 1 1 13 7843 1 1 23 PRO O O -2.819 -3.666 4.042 1.00 . A A . 23 PRO O 1 1 13 7844 1 1 24 CYS C C -0.369 -1.002 3.901 1.00 . A A . 24 CYS C 1 1 13 7845 1 1 24 CYS CA C -1.417 -1.496 2.925 1.00 . A A . 24 CYS CA 1 1 13 7846 1 1 24 CYS CB C -1.496 -0.657 1.644 1.00 . A A . 24 CYS CB 1 1 13 7847 1 1 24 CYS H H -3.042 -0.536 3.857 1.00 . A A . 24 CYS H 1 1 13 7848 1 1 24 CYS HA H -1.162 -2.522 2.652 1.00 . A A . 24 CYS HA 1 1 13 7849 1 1 24 CYS HB2 H -2.295 0.081 1.725 1.00 . A A . 24 CYS HB2 1 1 13 7850 1 1 24 CYS HB3 H -0.557 -0.116 1.520 1.00 . A A . 24 CYS HB3 1 1 13 7851 1 1 24 CYS N N -2.681 -1.456 3.638 1.00 . A A . 24 CYS N 1 1 13 7852 1 1 24 CYS O O -0.031 0.176 3.915 1.00 . A A . 24 CYS O 1 1 13 7853 1 1 24 CYS SG S -1.702 -1.633 0.142 1.00 . A A . 24 CYS SG 1 1 13 7854 1 1 25 ALA C C 2.287 -2.305 5.765 1.00 . A A . 25 ALA C 1 1 13 7855 1 1 25 ALA CA C 0.970 -1.576 5.865 1.00 . A A . 25 ALA CA 1 1 13 7856 1 1 25 ALA CB C 0.279 -1.939 7.162 1.00 . A A . 25 ALA CB 1 1 13 7857 1 1 25 ALA H H -0.297 -2.841 4.707 1.00 . A A . 25 ALA H 1 1 13 7858 1 1 25 ALA HA H 1.170 -0.508 5.863 1.00 . A A . 25 ALA HA 1 1 13 7859 1 1 25 ALA HB1 H 0.026 -2.997 7.204 1.00 . A A . 25 ALA HB1 1 1 13 7860 1 1 25 ALA HB2 H 0.977 -1.679 7.962 1.00 . A A . 25 ALA HB2 1 1 13 7861 1 1 25 ALA HB3 H -0.618 -1.325 7.238 1.00 . A A . 25 ALA HB3 1 1 13 7862 1 1 25 ALA N N 0.099 -1.911 4.753 1.00 . A A . 25 ALA N 1 1 13 7863 1 1 25 ALA O O 3.349 -1.704 5.657 1.00 . A A . 25 ALA O 1 1 13 7864 1 1 26 ASN C C 3.976 -4.174 4.130 1.00 . A A . 26 ASN C 1 1 13 7865 1 1 26 ASN CA C 3.334 -4.491 5.480 1.00 . A A . 26 ASN CA 1 1 13 7866 1 1 26 ASN CB C 2.852 -5.948 5.509 1.00 . A A . 26 ASN CB 1 1 13 7867 1 1 26 ASN CG C 1.619 -6.138 4.630 1.00 . A A . 26 ASN CG 1 1 13 7868 1 1 26 ASN H H 1.303 -4.064 5.867 1.00 . A A . 26 ASN H 1 1 13 7869 1 1 26 ASN HA H 4.069 -4.281 6.259 1.00 . A A . 26 ASN HA 1 1 13 7870 1 1 26 ASN HB2 H 3.650 -6.609 5.171 1.00 . A A . 26 ASN HB2 1 1 13 7871 1 1 26 ASN HB3 H 2.606 -6.216 6.534 1.00 . A A . 26 ASN HB3 1 1 13 7872 1 1 26 ASN HD21 H 2.671 -6.901 3.066 1.00 . A A . 26 ASN HD21 1 1 13 7873 1 1 26 ASN HD22 H 0.947 -6.724 2.821 1.00 . A A . 26 ASN HD22 1 1 13 7874 1 1 26 ASN N N 2.208 -3.625 5.752 1.00 . A A . 26 ASN N 1 1 13 7875 1 1 26 ASN ND2 N 1.752 -6.632 3.420 1.00 . A A . 26 ASN ND2 1 1 13 7876 1 1 26 ASN O O 5.191 -4.290 4.006 1.00 . A A . 26 ASN O 1 1 13 7877 1 1 26 ASN OD1 O 0.520 -5.751 5.020 1.00 . A A . 26 ASN OD1 1 1 13 7878 1 1 27 CYS C C 4.583 -1.967 2.020 1.00 . A A . 27 CYS C 1 1 13 7879 1 1 27 CYS CA C 3.677 -3.194 1.884 1.00 . A A . 27 CYS CA 1 1 13 7880 1 1 27 CYS CB C 2.542 -3.016 0.865 1.00 . A A . 27 CYS CB 1 1 13 7881 1 1 27 CYS H H 2.193 -3.661 3.324 1.00 . A A . 27 CYS H 1 1 13 7882 1 1 27 CYS HA H 4.286 -3.977 1.436 1.00 . A A . 27 CYS HA 1 1 13 7883 1 1 27 CYS HB2 H 1.883 -2.170 1.074 1.00 . A A . 27 CYS HB2 1 1 13 7884 1 1 27 CYS HB3 H 2.997 -2.786 -0.095 1.00 . A A . 27 CYS HB3 1 1 13 7885 1 1 27 CYS N N 3.186 -3.690 3.161 1.00 . A A . 27 CYS N 1 1 13 7886 1 1 27 CYS O O 5.033 -1.491 0.992 1.00 . A A . 27 CYS O 1 1 13 7887 1 1 27 CYS SG S 1.649 -4.583 0.686 1.00 . A A . 27 CYS SG 1 1 13 7888 1 1 28 LEU C C 7.167 -0.843 3.955 1.00 . A A . 28 LEU C 1 1 13 7889 1 1 28 LEU CA C 5.843 -0.356 3.398 1.00 . A A . 28 LEU CA 1 1 13 7890 1 1 28 LEU CB C 5.216 0.657 4.357 1.00 . A A . 28 LEU CB 1 1 13 7891 1 1 28 LEU CD1 C 4.733 2.430 2.613 1.00 . A A . 28 LEU CD1 1 1 13 7892 1 1 28 LEU CD2 C 3.004 0.747 3.040 1.00 . A A . 28 LEU CD2 1 1 13 7893 1 1 28 LEU CG C 4.150 1.514 3.682 1.00 . A A . 28 LEU CG 1 1 13 7894 1 1 28 LEU H H 4.289 -1.555 4.017 1.00 . A A . 28 LEU H 1 1 13 7895 1 1 28 LEU HA H 6.059 0.122 2.446 1.00 . A A . 28 LEU HA 1 1 13 7896 1 1 28 LEU HB2 H 4.758 0.147 5.217 1.00 . A A . 28 LEU HB2 1 1 13 7897 1 1 28 LEU HB3 H 5.997 1.318 4.740 1.00 . A A . 28 LEU HB3 1 1 13 7898 1 1 28 LEU HD11 H 5.699 2.811 2.938 1.00 . A A . 28 LEU HD11 1 1 13 7899 1 1 28 LEU HD12 H 4.872 1.838 1.710 1.00 . A A . 28 LEU HD12 1 1 13 7900 1 1 28 LEU HD13 H 4.051 3.253 2.407 1.00 . A A . 28 LEU HD13 1 1 13 7901 1 1 28 LEU HD21 H 2.678 -0.041 3.713 1.00 . A A . 28 LEU HD21 1 1 13 7902 1 1 28 LEU HD22 H 2.175 1.426 2.899 1.00 . A A . 28 LEU HD22 1 1 13 7903 1 1 28 LEU HD23 H 3.329 0.347 2.070 1.00 . A A . 28 LEU HD23 1 1 13 7904 1 1 28 LEU HG H 3.728 2.081 4.484 1.00 . A A . 28 LEU HG 1 1 13 7905 1 1 28 LEU N N 4.889 -1.436 3.212 1.00 . A A . 28 LEU N 1 1 13 7906 1 1 28 LEU O O 8.221 -0.578 3.383 1.00 . A A . 28 LEU O 1 1 13 7907 1 1 29 ALA C C 8.941 -3.075 5.176 1.00 . A A . 29 ALA C 1 1 13 7908 1 1 29 ALA CA C 8.337 -1.843 5.845 1.00 . A A . 29 ALA CA 1 1 13 7909 1 1 29 ALA CB C 8.005 -2.037 7.324 1.00 . A A . 29 ALA CB 1 1 13 7910 1 1 29 ALA H H 6.235 -1.686 5.536 1.00 . A A . 29 ALA H 1 1 13 7911 1 1 29 ALA HA H 9.067 -1.039 5.777 1.00 . A A . 29 ALA HA 1 1 13 7912 1 1 29 ALA HB1 H 8.901 -2.386 7.832 1.00 . A A . 29 ALA HB1 1 1 13 7913 1 1 29 ALA HB2 H 7.709 -1.085 7.764 1.00 . A A . 29 ALA HB2 1 1 13 7914 1 1 29 ALA HB3 H 7.198 -2.758 7.449 1.00 . A A . 29 ALA HB3 1 1 13 7915 1 1 29 ALA N N 7.132 -1.471 5.129 1.00 . A A . 29 ALA N 1 1 13 7916 1 1 29 ALA O O 9.882 -2.978 4.383 1.00 . A A . 29 ALA O 1 1 13 7917 1 1 30 GLY C C 8.081 -5.598 3.452 1.00 . A A . 30 GLY C 1 1 13 7918 1 1 30 GLY CA C 8.759 -5.483 4.811 1.00 . A A . 30 GLY CA 1 1 13 7919 1 1 30 GLY H H 7.598 -4.288 6.101 1.00 . A A . 30 GLY H 1 1 13 7920 1 1 30 GLY HA2 H 8.482 -6.324 5.443 1.00 . A A . 30 GLY HA2 1 1 13 7921 1 1 30 GLY HA3 H 9.837 -5.499 4.697 1.00 . A A . 30 GLY HA3 1 1 13 7922 1 1 30 GLY N N 8.365 -4.244 5.441 1.00 . A A . 30 GLY N 1 1 13 7923 1 1 30 GLY O O 7.250 -6.491 3.278 1.00 . A A . 30 GLY O 1 1 13 7924 1 1 31 TYR C C 8.864 -5.105 0.040 1.00 . A A . 31 TYR C 1 1 13 7925 1 1 31 TYR CA C 7.865 -4.748 1.150 1.00 . A A . 31 TYR CA 1 1 13 7926 1 1 31 TYR CB C 7.307 -3.324 0.911 1.00 . A A . 31 TYR CB 1 1 13 7927 1 1 31 TYR CD1 C 9.600 -2.255 0.692 1.00 . A A . 31 TYR CD1 1 1 13 7928 1 1 31 TYR CD2 C 7.757 -1.305 -0.567 1.00 . A A . 31 TYR CD2 1 1 13 7929 1 1 31 TYR CE1 C 10.437 -1.250 0.189 1.00 . A A . 31 TYR CE1 1 1 13 7930 1 1 31 TYR CE2 C 8.591 -0.321 -1.135 1.00 . A A . 31 TYR CE2 1 1 13 7931 1 1 31 TYR CG C 8.243 -2.261 0.345 1.00 . A A . 31 TYR CG 1 1 13 7932 1 1 31 TYR CZ C 9.940 -0.270 -0.704 1.00 . A A . 31 TYR CZ 1 1 13 7933 1 1 31 TYR H H 9.110 -4.007 2.725 1.00 . A A . 31 TYR H 1 1 13 7934 1 1 31 TYR HA H 7.059 -5.460 1.075 1.00 . A A . 31 TYR HA 1 1 13 7935 1 1 31 TYR HB2 H 6.493 -3.453 0.205 1.00 . A A . 31 TYR HB2 1 1 13 7936 1 1 31 TYR HB3 H 6.905 -2.898 1.836 1.00 . A A . 31 TYR HB3 1 1 13 7937 1 1 31 TYR HD1 H 10.003 -3.064 1.288 1.00 . A A . 31 TYR HD1 1 1 13 7938 1 1 31 TYR HD2 H 6.718 -1.344 -0.819 1.00 . A A . 31 TYR HD2 1 1 13 7939 1 1 31 TYR HE1 H 11.470 -1.259 0.489 1.00 . A A . 31 TYR HE1 1 1 13 7940 1 1 31 TYR HE2 H 8.184 0.393 -1.869 1.00 . A A . 31 TYR HE2 1 1 13 7941 1 1 31 TYR HH H 10.310 1.454 -1.506 1.00 . A A . 31 TYR HH 1 1 13 7942 1 1 31 TYR N N 8.426 -4.720 2.500 1.00 . A A . 31 TYR N 1 1 13 7943 1 1 31 TYR O O 8.745 -4.576 -1.068 1.00 . A A . 31 TYR O 1 1 13 7944 1 1 31 TYR OH O 10.789 0.689 -1.168 1.00 . A A . 31 TYR OH 1 1 13 7945 1 1 32 PRO C C 10.127 -7.056 -2.123 1.00 . A A . 32 PRO C 1 1 13 7946 1 1 32 PRO CA C 10.695 -6.400 -0.852 1.00 . A A . 32 PRO CA 1 1 13 7947 1 1 32 PRO CB C 11.717 -7.288 -0.155 1.00 . A A . 32 PRO CB 1 1 13 7948 1 1 32 PRO CD C 9.753 -7.144 1.213 1.00 . A A . 32 PRO CD 1 1 13 7949 1 1 32 PRO CG C 10.866 -8.110 0.811 1.00 . A A . 32 PRO CG 1 1 13 7950 1 1 32 PRO HA H 11.143 -5.424 -1.085 1.00 . A A . 32 PRO HA 1 1 13 7951 1 1 32 PRO HB2 H 12.250 -7.917 -0.864 1.00 . A A . 32 PRO HB2 1 1 13 7952 1 1 32 PRO HB3 H 12.415 -6.666 0.408 1.00 . A A . 32 PRO HB3 1 1 13 7953 1 1 32 PRO HD2 H 8.800 -7.651 1.360 1.00 . A A . 32 PRO HD2 1 1 13 7954 1 1 32 PRO HD3 H 10.044 -6.632 2.122 1.00 . A A . 32 PRO HD3 1 1 13 7955 1 1 32 PRO HG2 H 10.457 -8.978 0.290 1.00 . A A . 32 PRO HG2 1 1 13 7956 1 1 32 PRO HG3 H 11.447 -8.407 1.681 1.00 . A A . 32 PRO HG3 1 1 13 7957 1 1 32 PRO N N 9.652 -6.183 0.136 1.00 . A A . 32 PRO N 1 1 13 7958 1 1 32 PRO O O 10.828 -7.165 -3.127 1.00 . A A . 32 PRO O 1 1 13 7959 1 1 33 ALA C C 6.802 -7.212 -3.453 1.00 . A A . 33 ALA C 1 1 13 7960 1 1 33 ALA CA C 8.066 -8.036 -3.160 1.00 . A A . 33 ALA CA 1 1 13 7961 1 1 33 ALA CB C 7.644 -9.438 -2.733 1.00 . A A . 33 ALA CB 1 1 13 7962 1 1 33 ALA H H 8.363 -7.320 -1.208 1.00 . A A . 33 ALA H 1 1 13 7963 1 1 33 ALA HA H 8.669 -8.099 -4.067 1.00 . A A . 33 ALA HA 1 1 13 7964 1 1 33 ALA HB1 H 7.109 -9.923 -3.546 1.00 . A A . 33 ALA HB1 1 1 13 7965 1 1 33 ALA HB2 H 8.516 -10.036 -2.473 1.00 . A A . 33 ALA HB2 1 1 13 7966 1 1 33 ALA HB3 H 6.977 -9.346 -1.873 1.00 . A A . 33 ALA HB3 1 1 13 7967 1 1 33 ALA N N 8.853 -7.469 -2.076 1.00 . A A . 33 ALA N 1 1 13 7968 1 1 33 ALA O O 6.010 -7.593 -4.315 1.00 . A A . 33 ALA O 1 1 13 7969 1 1 34 GLY C C 5.086 -4.805 -4.230 1.00 . A A . 34 GLY C 1 1 13 7970 1 1 34 GLY CA C 5.347 -5.331 -2.818 1.00 . A A . 34 GLY CA 1 1 13 7971 1 1 34 GLY H H 7.332 -5.742 -2.183 1.00 . A A . 34 GLY H 1 1 13 7972 1 1 34 GLY HA2 H 5.418 -4.488 -2.135 1.00 . A A . 34 GLY HA2 1 1 13 7973 1 1 34 GLY HA3 H 4.508 -5.955 -2.511 1.00 . A A . 34 GLY HA3 1 1 13 7974 1 1 34 GLY N N 6.568 -6.114 -2.729 1.00 . A A . 34 GLY N 1 1 13 7975 1 1 34 GLY O O 3.927 -4.691 -4.611 1.00 . A A . 34 GLY O 1 1 13 7976 1 1 35 CYS C C 5.386 -5.187 -7.307 1.00 . A A . 35 CYS C 1 1 13 7977 1 1 35 CYS CA C 5.996 -4.103 -6.419 1.00 . A A . 35 CYS CA 1 1 13 7978 1 1 35 CYS CB C 7.381 -3.748 -6.967 1.00 . A A . 35 CYS CB 1 1 13 7979 1 1 35 CYS H H 7.068 -4.628 -4.644 1.00 . A A . 35 CYS H 1 1 13 7980 1 1 35 CYS HA H 5.360 -3.216 -6.461 1.00 . A A . 35 CYS HA 1 1 13 7981 1 1 35 CYS HB2 H 7.960 -4.667 -7.060 1.00 . A A . 35 CYS HB2 1 1 13 7982 1 1 35 CYS HB3 H 7.288 -3.307 -7.963 1.00 . A A . 35 CYS HB3 1 1 13 7983 1 1 35 CYS N N 6.129 -4.537 -5.024 1.00 . A A . 35 CYS N 1 1 13 7984 1 1 35 CYS O O 4.821 -4.883 -8.357 1.00 . A A . 35 CYS O 1 1 13 7985 1 1 35 CYS SG S 8.251 -2.599 -5.884 1.00 . A A . 35 CYS SG 1 1 13 7986 1 1 36 SER C C 3.586 -7.942 -7.079 1.00 . A A . 36 SER C 1 1 13 7987 1 1 36 SER CA C 4.976 -7.592 -7.620 1.00 . A A . 36 SER CA 1 1 13 7988 1 1 36 SER CB C 5.949 -8.756 -7.414 1.00 . A A . 36 SER CB 1 1 13 7989 1 1 36 SER H H 5.956 -6.643 -6.017 1.00 . A A . 36 SER H 1 1 13 7990 1 1 36 SER HA H 4.919 -7.358 -8.685 1.00 . A A . 36 SER HA 1 1 13 7991 1 1 36 SER HB2 H 6.957 -8.402 -7.621 1.00 . A A . 36 SER HB2 1 1 13 7992 1 1 36 SER HB3 H 5.904 -9.106 -6.382 1.00 . A A . 36 SER HB3 1 1 13 7993 1 1 36 SER HG H 6.471 -10.399 -8.305 1.00 . A A . 36 SER HG 1 1 13 7994 1 1 36 SER N N 5.524 -6.452 -6.913 1.00 . A A . 36 SER N 1 1 13 7995 1 1 36 SER O O 2.789 -8.575 -7.777 1.00 . A A . 36 SER O 1 1 13 7996 1 1 36 SER OG O 5.669 -9.831 -8.280 1.00 . A A . 36 SER OG 1 1 13 7997 1 1 37 ASN C C 0.984 -6.892 -5.731 1.00 . A A . 37 ASN C 1 1 13 7998 1 1 37 ASN CA C 2.002 -7.892 -5.207 1.00 . A A . 37 ASN CA 1 1 13 7999 1 1 37 ASN CB C 2.100 -7.836 -3.667 1.00 . A A . 37 ASN CB 1 1 13 8000 1 1 37 ASN CG C 1.886 -9.197 -3.042 1.00 . A A . 37 ASN CG 1 1 13 8001 1 1 37 ASN H H 3.950 -7.024 -5.324 1.00 . A A . 37 ASN H 1 1 13 8002 1 1 37 ASN HA H 1.697 -8.897 -5.507 1.00 . A A . 37 ASN HA 1 1 13 8003 1 1 37 ASN HB2 H 3.042 -7.418 -3.343 1.00 . A A . 37 ASN HB2 1 1 13 8004 1 1 37 ASN HB3 H 1.333 -7.187 -3.246 1.00 . A A . 37 ASN HB3 1 1 13 8005 1 1 37 ASN HD21 H 0.065 -9.273 -3.849 1.00 . A A . 37 ASN HD21 1 1 13 8006 1 1 37 ASN HD22 H 0.432 -10.630 -2.829 1.00 . A A . 37 ASN HD22 1 1 13 8007 1 1 37 ASN N N 3.281 -7.587 -5.833 1.00 . A A . 37 ASN N 1 1 13 8008 1 1 37 ASN ND2 N 0.700 -9.739 -3.217 1.00 . A A . 37 ASN ND2 1 1 13 8009 1 1 37 ASN O O 0.856 -5.821 -5.161 1.00 . A A . 37 ASN O 1 1 13 8010 1 1 37 ASN OD1 O 2.752 -9.752 -2.374 1.00 . A A . 37 ASN OD1 1 1 13 8011 1 1 38 SER C C -1.672 -5.628 -6.512 1.00 . A A . 38 SER C 1 1 13 8012 1 1 38 SER CA C -0.741 -6.399 -7.464 1.00 . A A . 38 SER CA 1 1 13 8013 1 1 38 SER CB C -1.506 -7.310 -8.406 1.00 . A A . 38 SER CB 1 1 13 8014 1 1 38 SER H H 0.386 -8.154 -7.163 1.00 . A A . 38 SER H 1 1 13 8015 1 1 38 SER HA H -0.223 -5.692 -8.099 1.00 . A A . 38 SER HA 1 1 13 8016 1 1 38 SER HB2 H -1.756 -8.205 -7.865 1.00 . A A . 38 SER HB2 1 1 13 8017 1 1 38 SER HB3 H -2.420 -6.825 -8.749 1.00 . A A . 38 SER HB3 1 1 13 8018 1 1 38 SER HG H -0.845 -8.519 -9.841 1.00 . A A . 38 SER HG 1 1 13 8019 1 1 38 SER N N 0.254 -7.225 -6.789 1.00 . A A . 38 SER N 1 1 13 8020 1 1 38 SER O O -1.991 -4.472 -6.804 1.00 . A A . 38 SER O 1 1 13 8021 1 1 38 SER OG O -0.654 -7.617 -9.499 1.00 . A A . 38 SER OG 1 1 13 8022 1 1 39 ASP C C -2.207 -4.399 -3.689 1.00 . A A . 39 ASP C 1 1 13 8023 1 1 39 ASP CA C -2.872 -5.650 -4.306 1.00 . A A . 39 ASP CA 1 1 13 8024 1 1 39 ASP CB C -3.096 -6.763 -3.264 1.00 . A A . 39 ASP CB 1 1 13 8025 1 1 39 ASP CG C -3.888 -6.358 -2.012 1.00 . A A . 39 ASP CG 1 1 13 8026 1 1 39 ASP H H -1.743 -7.185 -5.257 1.00 . A A . 39 ASP H 1 1 13 8027 1 1 39 ASP HA H -3.846 -5.356 -4.707 1.00 . A A . 39 ASP HA 1 1 13 8028 1 1 39 ASP HB2 H -3.632 -7.581 -3.749 1.00 . A A . 39 ASP HB2 1 1 13 8029 1 1 39 ASP HB3 H -2.118 -7.144 -2.950 1.00 . A A . 39 ASP HB3 1 1 13 8030 1 1 39 ASP N N -2.057 -6.234 -5.384 1.00 . A A . 39 ASP N 1 1 13 8031 1 1 39 ASP O O -2.888 -3.449 -3.307 1.00 . A A . 39 ASP O 1 1 13 8032 1 1 39 ASP OD1 O -5.081 -5.992 -2.112 1.00 . A A . 39 ASP OD1 1 1 13 8033 1 1 39 ASP OD2 O -3.345 -6.590 -0.905 1.00 . A A . 39 ASP OD2 1 1 13 8034 1 1 40 CYS C C 0.762 -2.544 -4.318 1.00 . A A . 40 CYS C 1 1 13 8035 1 1 40 CYS CA C -0.005 -3.263 -3.202 1.00 . A A . 40 CYS CA 1 1 13 8036 1 1 40 CYS CB C 0.992 -3.853 -2.189 1.00 . A A . 40 CYS CB 1 1 13 8037 1 1 40 CYS H H -0.382 -5.076 -4.180 1.00 . A A . 40 CYS H 1 1 13 8038 1 1 40 CYS HA H -0.611 -2.514 -2.689 1.00 . A A . 40 CYS HA 1 1 13 8039 1 1 40 CYS HB2 H 1.486 -4.736 -2.604 1.00 . A A . 40 CYS HB2 1 1 13 8040 1 1 40 CYS HB3 H 1.778 -3.127 -1.959 1.00 . A A . 40 CYS HB3 1 1 13 8041 1 1 40 CYS N N -0.872 -4.332 -3.701 1.00 . A A . 40 CYS N 1 1 13 8042 1 1 40 CYS O O 1.270 -1.456 -4.075 1.00 . A A . 40 CYS O 1 1 13 8043 1 1 40 CYS SG S 0.164 -4.257 -0.641 1.00 . A A . 40 CYS SG 1 1 13 8044 1 1 41 THR C C 1.325 -1.111 -6.900 1.00 . A A . 41 THR C 1 1 13 8045 1 1 41 THR CA C 1.654 -2.576 -6.614 1.00 . A A . 41 THR CA 1 1 13 8046 1 1 41 THR CB C 1.461 -3.505 -7.817 1.00 . A A . 41 THR CB 1 1 13 8047 1 1 41 THR CG2 C 1.943 -3.039 -9.176 1.00 . A A . 41 THR CG2 1 1 13 8048 1 1 41 THR H H 0.559 -4.057 -5.650 1.00 . A A . 41 THR H 1 1 13 8049 1 1 41 THR HA H 2.698 -2.627 -6.299 1.00 . A A . 41 THR HA 1 1 13 8050 1 1 41 THR HB H 0.393 -3.677 -7.913 1.00 . A A . 41 THR HB 1 1 13 8051 1 1 41 THR HG1 H 2.590 -4.984 -8.343 1.00 . A A . 41 THR HG1 1 1 13 8052 1 1 41 THR HG21 H 1.454 -2.101 -9.442 1.00 . A A . 41 THR HG21 1 1 13 8053 1 1 41 THR HG22 H 3.024 -2.901 -9.169 1.00 . A A . 41 THR HG22 1 1 13 8054 1 1 41 THR HG23 H 1.649 -3.808 -9.894 1.00 . A A . 41 THR HG23 1 1 13 8055 1 1 41 THR N N 0.848 -3.095 -5.526 1.00 . A A . 41 THR N 1 1 13 8056 1 1 41 THR O O 2.217 -0.279 -6.781 1.00 . A A . 41 THR O 1 1 13 8057 1 1 41 THR OG1 O 2.085 -4.739 -7.559 1.00 . A A . 41 THR OG1 1 1 13 8058 1 1 42 ALA C C -0.122 1.559 -6.433 1.00 . A A . 42 ALA C 1 1 13 8059 1 1 42 ALA CA C -0.264 0.602 -7.622 1.00 . A A . 42 ALA CA 1 1 13 8060 1 1 42 ALA CB C -1.672 0.673 -8.210 1.00 . A A . 42 ALA CB 1 1 13 8061 1 1 42 ALA H H -0.629 -1.493 -7.287 1.00 . A A . 42 ALA H 1 1 13 8062 1 1 42 ALA HA H 0.434 0.938 -8.389 1.00 . A A . 42 ALA HA 1 1 13 8063 1 1 42 ALA HB1 H -1.680 0.244 -9.211 1.00 . A A . 42 ALA HB1 1 1 13 8064 1 1 42 ALA HB2 H -1.995 1.718 -8.267 1.00 . A A . 42 ALA HB2 1 1 13 8065 1 1 42 ALA HB3 H -2.362 0.119 -7.583 1.00 . A A . 42 ALA HB3 1 1 13 8066 1 1 42 ALA N N 0.079 -0.774 -7.258 1.00 . A A . 42 ALA N 1 1 13 8067 1 1 42 ALA O O 0.323 2.692 -6.617 1.00 . A A . 42 ALA O 1 1 13 8068 1 1 43 PHE C C 1.274 2.250 -3.934 1.00 . A A . 43 PHE C 1 1 13 8069 1 1 43 PHE CA C -0.198 1.842 -3.987 1.00 . A A . 43 PHE CA 1 1 13 8070 1 1 43 PHE CB C -0.638 0.993 -2.778 1.00 . A A . 43 PHE CB 1 1 13 8071 1 1 43 PHE CD1 C 0.956 1.529 -0.911 1.00 . A A . 43 PHE CD1 1 1 13 8072 1 1 43 PHE CD2 C -1.392 2.003 -0.563 1.00 . A A . 43 PHE CD2 1 1 13 8073 1 1 43 PHE CE1 C 1.254 1.988 0.374 1.00 . A A . 43 PHE CE1 1 1 13 8074 1 1 43 PHE CE2 C -1.110 2.410 0.752 1.00 . A A . 43 PHE CE2 1 1 13 8075 1 1 43 PHE CG C -0.357 1.556 -1.401 1.00 . A A . 43 PHE CG 1 1 13 8076 1 1 43 PHE CZ C 0.217 2.411 1.215 1.00 . A A . 43 PHE CZ 1 1 13 8077 1 1 43 PHE H H -0.812 0.158 -5.145 1.00 . A A . 43 PHE H 1 1 13 8078 1 1 43 PHE HA H -0.778 2.763 -4.013 1.00 . A A . 43 PHE HA 1 1 13 8079 1 1 43 PHE HB2 H -1.701 0.766 -2.868 1.00 . A A . 43 PHE HB2 1 1 13 8080 1 1 43 PHE HB3 H -0.102 0.052 -2.809 1.00 . A A . 43 PHE HB3 1 1 13 8081 1 1 43 PHE HD1 H 1.744 1.145 -1.523 1.00 . A A . 43 PHE HD1 1 1 13 8082 1 1 43 PHE HD2 H -2.405 2.014 -0.922 1.00 . A A . 43 PHE HD2 1 1 13 8083 1 1 43 PHE HE1 H 2.277 2.004 0.712 1.00 . A A . 43 PHE HE1 1 1 13 8084 1 1 43 PHE HE2 H -1.906 2.740 1.405 1.00 . A A . 43 PHE HE2 1 1 13 8085 1 1 43 PHE HZ H 0.462 2.734 2.214 1.00 . A A . 43 PHE HZ 1 1 13 8086 1 1 43 PHE N N -0.448 1.100 -5.218 1.00 . A A . 43 PHE N 1 1 13 8087 1 1 43 PHE O O 1.589 3.433 -3.828 1.00 . A A . 43 PHE O 1 1 13 8088 1 1 44 LEU C C 4.192 2.294 -5.129 1.00 . A A . 44 LEU C 1 1 13 8089 1 1 44 LEU CA C 3.614 1.580 -3.905 1.00 . A A . 44 LEU CA 1 1 13 8090 1 1 44 LEU CB C 4.395 0.298 -3.645 1.00 . A A . 44 LEU CB 1 1 13 8091 1 1 44 LEU CD1 C 4.637 -1.835 -2.419 1.00 . A A . 44 LEU CD1 1 1 13 8092 1 1 44 LEU CD2 C 4.172 0.319 -1.096 1.00 . A A . 44 LEU CD2 1 1 13 8093 1 1 44 LEU CG C 3.944 -0.472 -2.392 1.00 . A A . 44 LEU CG 1 1 13 8094 1 1 44 LEU H H 1.899 0.308 -3.936 1.00 . A A . 44 LEU H 1 1 13 8095 1 1 44 LEU HA H 3.728 2.243 -3.054 1.00 . A A . 44 LEU HA 1 1 13 8096 1 1 44 LEU HB2 H 4.326 -0.349 -4.515 1.00 . A A . 44 LEU HB2 1 1 13 8097 1 1 44 LEU HB3 H 5.435 0.581 -3.555 1.00 . A A . 44 LEU HB3 1 1 13 8098 1 1 44 LEU HD11 H 5.685 -1.727 -2.694 1.00 . A A . 44 LEU HD11 1 1 13 8099 1 1 44 LEU HD12 H 4.563 -2.321 -1.451 1.00 . A A . 44 LEU HD12 1 1 13 8100 1 1 44 LEU HD13 H 4.143 -2.451 -3.169 1.00 . A A . 44 LEU HD13 1 1 13 8101 1 1 44 LEU HD21 H 3.905 1.368 -1.181 1.00 . A A . 44 LEU HD21 1 1 13 8102 1 1 44 LEU HD22 H 3.528 -0.086 -0.316 1.00 . A A . 44 LEU HD22 1 1 13 8103 1 1 44 LEU HD23 H 5.210 0.248 -0.789 1.00 . A A . 44 LEU HD23 1 1 13 8104 1 1 44 LEU HG H 2.878 -0.677 -2.443 1.00 . A A . 44 LEU HG 1 1 13 8105 1 1 44 LEU N N 2.193 1.285 -4.009 1.00 . A A . 44 LEU N 1 1 13 8106 1 1 44 LEU O O 5.152 3.050 -5.009 1.00 . A A . 44 LEU O 1 1 13 8107 1 1 45 SER C C 3.743 4.347 -7.233 1.00 . A A . 45 SER C 1 1 13 8108 1 1 45 SER CA C 3.900 2.844 -7.516 1.00 . A A . 45 SER CA 1 1 13 8109 1 1 45 SER CB C 2.996 2.329 -8.642 1.00 . A A . 45 SER CB 1 1 13 8110 1 1 45 SER H H 2.927 1.342 -6.322 1.00 . A A . 45 SER H 1 1 13 8111 1 1 45 SER HA H 4.930 2.650 -7.799 1.00 . A A . 45 SER HA 1 1 13 8112 1 1 45 SER HB2 H 2.862 1.257 -8.518 1.00 . A A . 45 SER HB2 1 1 13 8113 1 1 45 SER HB3 H 2.016 2.799 -8.587 1.00 . A A . 45 SER HB3 1 1 13 8114 1 1 45 SER HG H 3.433 3.448 -10.190 1.00 . A A . 45 SER HG 1 1 13 8115 1 1 45 SER N N 3.610 2.089 -6.302 1.00 . A A . 45 SER N 1 1 13 8116 1 1 45 SER O O 4.592 5.148 -7.630 1.00 . A A . 45 SER O 1 1 13 8117 1 1 45 SER OG O 3.548 2.509 -9.930 1.00 . A A . 45 SER OG 1 1 13 8118 1 1 46 GLN C C 3.631 6.232 -4.777 1.00 . A A . 46 GLN C 1 1 13 8119 1 1 46 GLN CA C 2.594 6.059 -5.902 1.00 . A A . 46 GLN CA 1 1 13 8120 1 1 46 GLN CB C 1.121 6.339 -5.529 1.00 . A A . 46 GLN CB 1 1 13 8121 1 1 46 GLN CD C -1.013 7.161 -6.721 1.00 . A A . 46 GLN CD 1 1 13 8122 1 1 46 GLN CG C 0.267 6.335 -6.814 1.00 . A A . 46 GLN CG 1 1 13 8123 1 1 46 GLN H H 2.043 4.024 -6.174 1.00 . A A . 46 GLN H 1 1 13 8124 1 1 46 GLN HA H 2.863 6.784 -6.669 1.00 . A A . 46 GLN HA 1 1 13 8125 1 1 46 GLN HB2 H 0.739 5.591 -4.836 1.00 . A A . 46 GLN HB2 1 1 13 8126 1 1 46 GLN HB3 H 1.038 7.311 -5.050 1.00 . A A . 46 GLN HB3 1 1 13 8127 1 1 46 GLN HE21 H -2.201 5.522 -6.833 1.00 . A A . 46 GLN HE21 1 1 13 8128 1 1 46 GLN HE22 H -3.045 7.049 -6.692 1.00 . A A . 46 GLN HE22 1 1 13 8129 1 1 46 GLN HG2 H 0.851 6.762 -7.629 1.00 . A A . 46 GLN HG2 1 1 13 8130 1 1 46 GLN HG3 H 0.032 5.307 -7.089 1.00 . A A . 46 GLN HG3 1 1 13 8131 1 1 46 GLN N N 2.714 4.726 -6.470 1.00 . A A . 46 GLN N 1 1 13 8132 1 1 46 GLN NE2 N -2.173 6.531 -6.812 1.00 . A A . 46 GLN NE2 1 1 13 8133 1 1 46 GLN O O 4.610 6.952 -4.971 1.00 . A A . 46 GLN O 1 1 13 8134 1 1 46 GLN OE1 O -0.974 8.386 -6.722 1.00 . A A . 46 GLN OE1 1 1 13 8135 1 1 47 CYS C C 5.720 5.682 -2.397 1.00 . A A . 47 CYS C 1 1 13 8136 1 1 47 CYS CA C 4.190 5.845 -2.384 1.00 . A A . 47 CYS CA 1 1 13 8137 1 1 47 CYS CB C 3.622 4.973 -1.257 1.00 . A A . 47 CYS CB 1 1 13 8138 1 1 47 CYS H H 2.700 4.899 -3.597 1.00 . A A . 47 CYS H 1 1 13 8139 1 1 47 CYS HA H 3.976 6.889 -2.144 1.00 . A A . 47 CYS HA 1 1 13 8140 1 1 47 CYS HB2 H 2.589 4.717 -1.485 1.00 . A A . 47 CYS HB2 1 1 13 8141 1 1 47 CYS HB3 H 4.196 4.045 -1.176 1.00 . A A . 47 CYS HB3 1 1 13 8142 1 1 47 CYS N N 3.485 5.542 -3.639 1.00 . A A . 47 CYS N 1 1 13 8143 1 1 47 CYS O O 6.392 6.138 -1.473 1.00 . A A . 47 CYS O 1 1 13 8144 1 1 47 CYS SG S 3.650 5.824 0.341 1.00 . A A . 47 CYS SG 1 1 13 8145 1 1 48 TYR C C 8.179 5.107 -4.936 1.00 . A A . 48 TYR C 1 1 13 8146 1 1 48 TYR CA C 7.701 4.727 -3.542 1.00 . A A . 48 TYR CA 1 1 13 8147 1 1 48 TYR CB C 7.996 3.273 -3.211 1.00 . A A . 48 TYR CB 1 1 13 8148 1 1 48 TYR CD1 C 9.199 3.607 -1.005 1.00 . A A . 48 TYR CD1 1 1 13 8149 1 1 48 TYR CD2 C 7.094 2.398 -1.033 1.00 . A A . 48 TYR CD2 1 1 13 8150 1 1 48 TYR CE1 C 9.317 3.398 0.375 1.00 . A A . 48 TYR CE1 1 1 13 8151 1 1 48 TYR CE2 C 7.260 2.096 0.326 1.00 . A A . 48 TYR CE2 1 1 13 8152 1 1 48 TYR CG C 8.100 3.089 -1.715 1.00 . A A . 48 TYR CG 1 1 13 8153 1 1 48 TYR CZ C 8.350 2.624 1.047 1.00 . A A . 48 TYR CZ 1 1 13 8154 1 1 48 TYR H H 5.651 4.627 -4.097 1.00 . A A . 48 TYR H 1 1 13 8155 1 1 48 TYR HA H 8.279 5.265 -2.801 1.00 . A A . 48 TYR HA 1 1 13 8156 1 1 48 TYR HB2 H 7.232 2.620 -3.627 1.00 . A A . 48 TYR HB2 1 1 13 8157 1 1 48 TYR HB3 H 8.947 2.982 -3.660 1.00 . A A . 48 TYR HB3 1 1 13 8158 1 1 48 TYR HD1 H 9.952 4.193 -1.507 1.00 . A A . 48 TYR HD1 1 1 13 8159 1 1 48 TYR HD2 H 6.258 2.009 -1.589 1.00 . A A . 48 TYR HD2 1 1 13 8160 1 1 48 TYR HE1 H 10.165 3.815 0.894 1.00 . A A . 48 TYR HE1 1 1 13 8161 1 1 48 TYR HE2 H 6.589 1.394 0.783 1.00 . A A . 48 TYR HE2 1 1 13 8162 1 1 48 TYR HH H 9.266 2.816 2.739 1.00 . A A . 48 TYR HH 1 1 13 8163 1 1 48 TYR N N 6.276 5.007 -3.397 1.00 . A A . 48 TYR N 1 1 13 8164 1 1 48 TYR O O 9.184 5.800 -5.081 1.00 . A A . 48 TYR O 1 1 13 8165 1 1 48 TYR OH O 8.439 2.440 2.389 1.00 . A A . 48 TYR OH 1 1 13 8166 1 1 49 GLY C C 7.913 3.197 -7.852 1.00 . A A . 49 GLY C 1 1 13 8167 1 1 49 GLY CA C 7.912 4.637 -7.337 1.00 . A A . 49 GLY CA 1 1 13 8168 1 1 49 GLY H H 6.556 4.232 -5.765 1.00 . A A . 49 GLY H 1 1 13 8169 1 1 49 GLY HA2 H 8.932 5.020 -7.398 1.00 . A A . 49 GLY HA2 1 1 13 8170 1 1 49 GLY HA3 H 7.267 5.242 -7.973 1.00 . A A . 49 GLY HA3 1 1 13 8171 1 1 49 GLY N N 7.430 4.703 -5.961 1.00 . A A . 49 GLY N 1 1 13 8172 1 1 49 GLY O O 8.389 2.944 -8.958 1.00 . A A . 49 GLY O 1 1 13 8173 1 1 50 GLY C C 8.567 0.235 -7.764 1.00 . A A . 50 GLY C 1 1 13 8174 1 1 50 GLY CA C 7.218 0.858 -7.445 1.00 . A A . 50 GLY CA 1 1 13 8175 1 1 50 GLY H H 7.015 2.515 -6.164 1.00 . A A . 50 GLY H 1 1 13 8176 1 1 50 GLY HA2 H 6.572 0.783 -8.321 1.00 . A A . 50 GLY HA2 1 1 13 8177 1 1 50 GLY HA3 H 6.764 0.317 -6.613 1.00 . A A . 50 GLY HA3 1 1 13 8178 1 1 50 GLY N N 7.374 2.251 -7.069 1.00 . A A . 50 GLY N 1 1 13 8179 1 1 50 GLY O O 8.797 -0.186 -8.901 1.00 . A A . 50 GLY O 1 1 13 8180 1 1 51 CYS C C 11.526 0.560 -7.927 1.00 . A A . 51 CYS C 1 1 13 8181 1 1 51 CYS CA C 10.808 -0.317 -6.907 1.00 . A A . 51 CYS CA 1 1 13 8182 1 1 51 CYS CB C 10.894 -1.822 -7.244 1.00 . A A . 51 CYS CB 1 1 13 8183 1 1 51 CYS H H 9.136 0.455 -5.819 1.00 . A A . 51 CYS H 1 1 13 8184 1 1 51 CYS HA H 11.325 -0.145 -5.971 1.00 . A A . 51 CYS HA 1 1 13 8185 1 1 51 CYS HB2 H 10.413 -1.995 -8.203 1.00 . A A . 51 CYS HB2 1 1 13 8186 1 1 51 CYS HB3 H 11.947 -2.066 -7.379 1.00 . A A . 51 CYS HB3 1 1 13 8187 1 1 51 CYS N N 9.429 0.130 -6.745 1.00 . A A . 51 CYS N 1 1 13 8188 1 1 51 CYS O O 12.164 0.003 -8.849 1.00 . A A . 51 CYS O 1 1 13 8189 1 1 51 CYS OXT O 11.581 1.782 -7.706 1.00 . A A . 51 CYS OXT 1 1 13 8190 1 1 51 CYS SG S 10.238 -3.016 -6.058 1.00 . A A . 51 CYS SG 1 1 14 8191 1 1 1 GLY C C -7.917 -5.725 -0.848 1.00 . A A . 1 GLY C 1 1 14 8192 1 1 1 GLY CA C -7.677 -7.012 -1.618 1.00 . A A . 1 GLY CA 1 1 14 8193 1 1 1 GLY H1 H -7.100 -6.084 -3.335 1.00 . A A . 1 GLY H1 1 1 14 8194 1 1 1 GLY H2 H -7.604 -7.640 -3.576 1.00 . A A . 1 GLY H2 1 1 14 8195 1 1 1 GLY H3 H -8.698 -6.442 -3.282 1.00 . A A . 1 GLY H3 1 1 14 8196 1 1 1 GLY HA2 H -6.675 -7.363 -1.394 1.00 . A A . 1 GLY HA2 1 1 14 8197 1 1 1 GLY HA3 H -8.398 -7.765 -1.305 1.00 . A A . 1 GLY HA3 1 1 14 8198 1 1 1 GLY N N -7.777 -6.790 -3.062 1.00 . A A . 1 GLY N 1 1 14 8199 1 1 1 GLY O O -8.583 -4.804 -1.321 1.00 . A A . 1 GLY O 1 1 14 8200 1 1 2 GLU C C -7.032 -3.283 0.824 1.00 . A A . 2 GLU C 1 1 14 8201 1 1 2 GLU CA C -7.604 -4.600 1.338 1.00 . A A . 2 GLU CA 1 1 14 8202 1 1 2 GLU CB C -7.010 -4.969 2.710 1.00 . A A . 2 GLU CB 1 1 14 8203 1 1 2 GLU CD C -4.946 -6.121 3.722 1.00 . A A . 2 GLU CD 1 1 14 8204 1 1 2 GLU CG C -5.496 -5.233 2.598 1.00 . A A . 2 GLU CG 1 1 14 8205 1 1 2 GLU H H -6.993 -6.527 0.744 1.00 . A A . 2 GLU H 1 1 14 8206 1 1 2 GLU HA H -8.670 -4.478 1.462 1.00 . A A . 2 GLU HA 1 1 14 8207 1 1 2 GLU HB2 H -7.186 -4.124 3.387 1.00 . A A . 2 GLU HB2 1 1 14 8208 1 1 2 GLU HB3 H -7.523 -5.868 3.071 1.00 . A A . 2 GLU HB3 1 1 14 8209 1 1 2 GLU HG2 H -5.322 -5.729 1.634 1.00 . A A . 2 GLU HG2 1 1 14 8210 1 1 2 GLU HG3 H -4.967 -4.276 2.621 1.00 . A A . 2 GLU HG3 1 1 14 8211 1 1 2 GLU N N -7.406 -5.678 0.379 1.00 . A A . 2 GLU N 1 1 14 8212 1 1 2 GLU O O -7.604 -2.222 1.091 1.00 . A A . 2 GLU O 1 1 14 8213 1 1 2 GLU OE1 O -5.112 -5.830 4.927 1.00 . A A . 2 GLU OE1 1 1 14 8214 1 1 2 GLU OE2 O -4.315 -7.155 3.406 1.00 . A A . 2 GLU OE2 1 1 14 8215 1 1 3 CYS C C -5.909 -1.597 -1.615 1.00 . A A . 3 CYS C 1 1 14 8216 1 1 3 CYS CA C -5.232 -2.138 -0.352 1.00 . A A . 3 CYS CA 1 1 14 8217 1 1 3 CYS CB C -3.748 -2.446 -0.543 1.00 . A A . 3 CYS CB 1 1 14 8218 1 1 3 CYS H H -5.513 -4.238 -0.164 1.00 . A A . 3 CYS H 1 1 14 8219 1 1 3 CYS HA H -5.315 -1.390 0.440 1.00 . A A . 3 CYS HA 1 1 14 8220 1 1 3 CYS HB2 H -3.341 -2.814 0.399 1.00 . A A . 3 CYS HB2 1 1 14 8221 1 1 3 CYS HB3 H -3.629 -3.231 -1.286 1.00 . A A . 3 CYS HB3 1 1 14 8222 1 1 3 CYS N N -5.917 -3.337 0.090 1.00 . A A . 3 CYS N 1 1 14 8223 1 1 3 CYS O O -6.138 -0.387 -1.708 1.00 . A A . 3 CYS O 1 1 14 8224 1 1 3 CYS SG S -2.762 -1.026 -1.061 1.00 . A A . 3 CYS SG 1 1 14 8225 1 1 4 GLU C C -8.479 -1.397 -2.977 1.00 . A A . 4 GLU C 1 1 14 8226 1 1 4 GLU CA C -7.293 -2.152 -3.578 1.00 . A A . 4 GLU CA 1 1 14 8227 1 1 4 GLU CB C -7.843 -3.412 -4.268 1.00 . A A . 4 GLU CB 1 1 14 8228 1 1 4 GLU CD C -7.998 -5.004 -6.162 1.00 . A A . 4 GLU CD 1 1 14 8229 1 1 4 GLU CG C -7.161 -3.866 -5.563 1.00 . A A . 4 GLU CG 1 1 14 8230 1 1 4 GLU H H -6.063 -3.465 -2.433 1.00 . A A . 4 GLU H 1 1 14 8231 1 1 4 GLU HA H -6.807 -1.507 -4.310 1.00 . A A . 4 GLU HA 1 1 14 8232 1 1 4 GLU HB2 H -7.833 -4.234 -3.564 1.00 . A A . 4 GLU HB2 1 1 14 8233 1 1 4 GLU HB3 H -8.889 -3.225 -4.504 1.00 . A A . 4 GLU HB3 1 1 14 8234 1 1 4 GLU HG2 H -7.133 -3.029 -6.263 1.00 . A A . 4 GLU HG2 1 1 14 8235 1 1 4 GLU HG3 H -6.138 -4.194 -5.367 1.00 . A A . 4 GLU HG3 1 1 14 8236 1 1 4 GLU N N -6.336 -2.485 -2.527 1.00 . A A . 4 GLU N 1 1 14 8237 1 1 4 GLU O O -8.825 -0.324 -3.466 1.00 . A A . 4 GLU O 1 1 14 8238 1 1 4 GLU OE1 O -8.992 -4.698 -6.856 1.00 . A A . 4 GLU OE1 1 1 14 8239 1 1 4 GLU OE2 O -7.758 -6.187 -5.827 1.00 . A A . 4 GLU OE2 1 1 14 8240 1 1 5 GLN C C -10.190 -0.105 -0.698 1.00 . A A . 5 GLN C 1 1 14 8241 1 1 5 GLN CA C -10.379 -1.429 -1.441 1.00 . A A . 5 GLN CA 1 1 14 8242 1 1 5 GLN CB C -11.052 -2.470 -0.534 1.00 . A A . 5 GLN CB 1 1 14 8243 1 1 5 GLN CD C -13.269 -2.492 -1.769 1.00 . A A . 5 GLN CD 1 1 14 8244 1 1 5 GLN CG C -12.574 -2.263 -0.428 1.00 . A A . 5 GLN CG 1 1 14 8245 1 1 5 GLN H H -8.799 -2.860 -1.613 1.00 . A A . 5 GLN H 1 1 14 8246 1 1 5 GLN HA H -11.014 -1.247 -2.306 1.00 . A A . 5 GLN HA 1 1 14 8247 1 1 5 GLN HB2 H -10.869 -3.468 -0.928 1.00 . A A . 5 GLN HB2 1 1 14 8248 1 1 5 GLN HB3 H -10.605 -2.423 0.455 1.00 . A A . 5 GLN HB3 1 1 14 8249 1 1 5 GLN HE21 H -14.283 -0.704 -1.737 1.00 . A A . 5 GLN HE21 1 1 14 8250 1 1 5 GLN HE22 H -14.481 -1.713 -3.165 1.00 . A A . 5 GLN HE22 1 1 14 8251 1 1 5 GLN HG2 H -12.967 -2.980 0.294 1.00 . A A . 5 GLN HG2 1 1 14 8252 1 1 5 GLN HG3 H -12.793 -1.263 -0.059 1.00 . A A . 5 GLN HG3 1 1 14 8253 1 1 5 GLN N N -9.123 -1.958 -1.949 1.00 . A A . 5 GLN N 1 1 14 8254 1 1 5 GLN NE2 N -14.141 -1.598 -2.213 1.00 . A A . 5 GLN NE2 1 1 14 8255 1 1 5 GLN O O -11.134 0.683 -0.628 1.00 . A A . 5 GLN O 1 1 14 8256 1 1 5 GLN OE1 O -13.026 -3.496 -2.427 1.00 . A A . 5 GLN OE1 1 1 14 8257 1 1 6 CYS C C -8.692 2.505 -0.705 1.00 . A A . 6 CYS C 1 1 14 8258 1 1 6 CYS CA C -8.708 1.471 0.424 1.00 . A A . 6 CYS CA 1 1 14 8259 1 1 6 CYS CB C -7.382 1.444 1.183 1.00 . A A . 6 CYS CB 1 1 14 8260 1 1 6 CYS H H -8.274 -0.540 -0.186 1.00 . A A . 6 CYS H 1 1 14 8261 1 1 6 CYS HA H -9.493 1.741 1.131 1.00 . A A . 6 CYS HA 1 1 14 8262 1 1 6 CYS HB2 H -7.362 0.560 1.817 1.00 . A A . 6 CYS HB2 1 1 14 8263 1 1 6 CYS HB3 H -6.553 1.384 0.478 1.00 . A A . 6 CYS HB3 1 1 14 8264 1 1 6 CYS N N -9.006 0.159 -0.137 1.00 . A A . 6 CYS N 1 1 14 8265 1 1 6 CYS O O -9.301 3.566 -0.595 1.00 . A A . 6 CYS O 1 1 14 8266 1 1 6 CYS SG S -7.185 2.906 2.231 1.00 . A A . 6 CYS SG 1 1 14 8267 1 1 7 PHE C C -9.482 3.149 -3.590 1.00 . A A . 7 PHE C 1 1 14 8268 1 1 7 PHE CA C -8.074 2.996 -3.018 1.00 . A A . 7 PHE CA 1 1 14 8269 1 1 7 PHE CB C -7.108 2.436 -4.063 1.00 . A A . 7 PHE CB 1 1 14 8270 1 1 7 PHE CD1 C -5.849 4.483 -4.783 1.00 . A A . 7 PHE CD1 1 1 14 8271 1 1 7 PHE CD2 C -4.696 2.839 -3.399 1.00 . A A . 7 PHE CD2 1 1 14 8272 1 1 7 PHE CE1 C -4.722 5.314 -4.742 1.00 . A A . 7 PHE CE1 1 1 14 8273 1 1 7 PHE CE2 C -3.557 3.658 -3.408 1.00 . A A . 7 PHE CE2 1 1 14 8274 1 1 7 PHE CG C -5.838 3.246 -4.114 1.00 . A A . 7 PHE CG 1 1 14 8275 1 1 7 PHE CZ C -3.565 4.893 -4.070 1.00 . A A . 7 PHE CZ 1 1 14 8276 1 1 7 PHE H H -7.580 1.271 -1.866 1.00 . A A . 7 PHE H 1 1 14 8277 1 1 7 PHE HA H -7.734 3.994 -2.729 1.00 . A A . 7 PHE HA 1 1 14 8278 1 1 7 PHE HB2 H -6.881 1.394 -3.846 1.00 . A A . 7 PHE HB2 1 1 14 8279 1 1 7 PHE HB3 H -7.574 2.466 -5.048 1.00 . A A . 7 PHE HB3 1 1 14 8280 1 1 7 PHE HD1 H -6.749 4.836 -5.268 1.00 . A A . 7 PHE HD1 1 1 14 8281 1 1 7 PHE HD2 H -4.699 1.939 -2.794 1.00 . A A . 7 PHE HD2 1 1 14 8282 1 1 7 PHE HE1 H -4.770 6.300 -5.181 1.00 . A A . 7 PHE HE1 1 1 14 8283 1 1 7 PHE HE2 H -2.687 3.395 -2.838 1.00 . A A . 7 PHE HE2 1 1 14 8284 1 1 7 PHE HZ H -2.698 5.537 -4.003 1.00 . A A . 7 PHE HZ 1 1 14 8285 1 1 7 PHE N N -8.058 2.163 -1.827 1.00 . A A . 7 PHE N 1 1 14 8286 1 1 7 PHE O O -9.832 4.254 -4.007 1.00 . A A . 7 PHE O 1 1 14 8287 1 1 8 SER C C -12.396 3.258 -3.121 1.00 . A A . 8 SER C 1 1 14 8288 1 1 8 SER CA C -11.705 2.215 -3.993 1.00 . A A . 8 SER CA 1 1 14 8289 1 1 8 SER CB C -12.459 0.886 -3.884 1.00 . A A . 8 SER CB 1 1 14 8290 1 1 8 SER H H -9.957 1.188 -3.296 1.00 . A A . 8 SER H 1 1 14 8291 1 1 8 SER HA H -11.740 2.555 -5.027 1.00 . A A . 8 SER HA 1 1 14 8292 1 1 8 SER HB2 H -12.448 0.540 -2.852 1.00 . A A . 8 SER HB2 1 1 14 8293 1 1 8 SER HB3 H -13.498 1.052 -4.173 1.00 . A A . 8 SER HB3 1 1 14 8294 1 1 8 SER HG H -12.635 -0.714 -4.969 1.00 . A A . 8 SER HG 1 1 14 8295 1 1 8 SER N N -10.305 2.091 -3.599 1.00 . A A . 8 SER N 1 1 14 8296 1 1 8 SER O O -13.152 4.075 -3.646 1.00 . A A . 8 SER O 1 1 14 8297 1 1 8 SER OG O -11.904 -0.100 -4.727 1.00 . A A . 8 SER OG 1 1 14 8298 1 1 9 ASP C C -11.821 5.534 -0.848 1.00 . A A . 9 ASP C 1 1 14 8299 1 1 9 ASP CA C -12.653 4.245 -0.885 1.00 . A A . 9 ASP CA 1 1 14 8300 1 1 9 ASP CB C -12.709 3.585 0.498 1.00 . A A . 9 ASP CB 1 1 14 8301 1 1 9 ASP CG C -13.717 4.256 1.423 1.00 . A A . 9 ASP CG 1 1 14 8302 1 1 9 ASP H H -11.423 2.624 -1.441 1.00 . A A . 9 ASP H 1 1 14 8303 1 1 9 ASP HA H -13.669 4.496 -1.185 1.00 . A A . 9 ASP HA 1 1 14 8304 1 1 9 ASP HB2 H -13.008 2.543 0.392 1.00 . A A . 9 ASP HB2 1 1 14 8305 1 1 9 ASP HB3 H -11.720 3.589 0.951 1.00 . A A . 9 ASP HB3 1 1 14 8306 1 1 9 ASP N N -12.104 3.274 -1.819 1.00 . A A . 9 ASP N 1 1 14 8307 1 1 9 ASP O O -11.789 6.233 0.159 1.00 . A A . 9 ASP O 1 1 14 8308 1 1 9 ASP OD1 O -14.888 4.369 0.996 1.00 . A A . 9 ASP OD1 1 1 14 8309 1 1 9 ASP OD2 O -13.442 4.391 2.637 1.00 . A A . 9 ASP OD2 1 1 14 8310 1 1 10 GLY C C -9.320 7.504 -1.584 1.00 . A A . 10 GLY C 1 1 14 8311 1 1 10 GLY CA C -10.692 7.265 -2.212 1.00 . A A . 10 GLY CA 1 1 14 8312 1 1 10 GLY H H -11.283 5.311 -2.776 1.00 . A A . 10 GLY H 1 1 14 8313 1 1 10 GLY HA2 H -11.373 8.028 -1.832 1.00 . A A . 10 GLY HA2 1 1 14 8314 1 1 10 GLY HA3 H -10.589 7.412 -3.284 1.00 . A A . 10 GLY HA3 1 1 14 8315 1 1 10 GLY N N -11.283 5.952 -1.994 1.00 . A A . 10 GLY N 1 1 14 8316 1 1 10 GLY O O -8.889 8.657 -1.605 1.00 . A A . 10 GLY O 1 1 14 8317 1 1 11 GLY C C -6.194 6.917 -1.259 1.00 . A A . 11 GLY C 1 1 14 8318 1 1 11 GLY CA C -7.389 6.706 -0.325 1.00 . A A . 11 GLY CA 1 1 14 8319 1 1 11 GLY H H -9.050 5.564 -1.011 1.00 . A A . 11 GLY H 1 1 14 8320 1 1 11 GLY HA2 H -7.206 5.852 0.324 1.00 . A A . 11 GLY HA2 1 1 14 8321 1 1 11 GLY HA3 H -7.511 7.604 0.280 1.00 . A A . 11 GLY HA3 1 1 14 8322 1 1 11 GLY N N -8.648 6.493 -1.030 1.00 . A A . 11 GLY N 1 1 14 8323 1 1 11 GLY O O -6.306 6.680 -2.460 1.00 . A A . 11 GLY O 1 1 14 8324 1 1 12 ASP C C -2.676 6.763 -0.916 1.00 . A A . 12 ASP C 1 1 14 8325 1 1 12 ASP CA C -3.826 7.639 -1.466 1.00 . A A . 12 ASP CA 1 1 14 8326 1 1 12 ASP CB C -3.435 9.143 -1.416 1.00 . A A . 12 ASP CB 1 1 14 8327 1 1 12 ASP CG C -3.661 9.869 -0.074 1.00 . A A . 12 ASP CG 1 1 14 8328 1 1 12 ASP H H -5.052 7.496 0.289 1.00 . A A . 12 ASP H 1 1 14 8329 1 1 12 ASP HA H -3.969 7.365 -2.515 1.00 . A A . 12 ASP HA 1 1 14 8330 1 1 12 ASP HB2 H -2.397 9.266 -1.721 1.00 . A A . 12 ASP HB2 1 1 14 8331 1 1 12 ASP HB3 H -4.041 9.650 -2.174 1.00 . A A . 12 ASP HB3 1 1 14 8332 1 1 12 ASP N N -5.052 7.354 -0.706 1.00 . A A . 12 ASP N 1 1 14 8333 1 1 12 ASP O O -2.547 5.598 -1.271 1.00 . A A . 12 ASP O 1 1 14 8334 1 1 12 ASP OD1 O -2.789 9.748 0.827 1.00 . A A . 12 ASP OD1 1 1 14 8335 1 1 12 ASP OD2 O -4.665 10.589 0.077 1.00 . A A . 12 ASP OD2 1 1 14 8336 1 1 13 CYS C C -0.645 6.937 2.095 1.00 . A A . 13 CYS C 1 1 14 8337 1 1 13 CYS CA C -0.677 6.663 0.592 1.00 . A A . 13 CYS CA 1 1 14 8338 1 1 13 CYS CB C 0.623 7.163 -0.056 1.00 . A A . 13 CYS CB 1 1 14 8339 1 1 13 CYS H H -2.036 8.247 0.276 1.00 . A A . 13 CYS H 1 1 14 8340 1 1 13 CYS HA H -0.729 5.591 0.439 1.00 . A A . 13 CYS HA 1 1 14 8341 1 1 13 CYS HB2 H 0.588 8.245 -0.152 1.00 . A A . 13 CYS HB2 1 1 14 8342 1 1 13 CYS HB3 H 1.450 6.919 0.614 1.00 . A A . 13 CYS HB3 1 1 14 8343 1 1 13 CYS N N -1.850 7.292 -0.007 1.00 . A A . 13 CYS N 1 1 14 8344 1 1 13 CYS O O -0.254 6.058 2.869 1.00 . A A . 13 CYS O 1 1 14 8345 1 1 13 CYS SG S 1.003 6.461 -1.678 1.00 . A A . 13 CYS SG 1 1 14 8346 1 1 14 THR C C -2.396 7.586 4.459 1.00 . A A . 14 THR C 1 1 14 8347 1 1 14 THR CA C -1.230 8.428 3.946 1.00 . A A . 14 THR CA 1 1 14 8348 1 1 14 THR CB C -1.473 9.938 4.147 1.00 . A A . 14 THR CB 1 1 14 8349 1 1 14 THR CG2 C -1.386 10.319 5.623 1.00 . A A . 14 THR CG2 1 1 14 8350 1 1 14 THR H H -1.413 8.821 1.870 1.00 . A A . 14 THR H 1 1 14 8351 1 1 14 THR HA H -0.325 8.137 4.480 1.00 . A A . 14 THR HA 1 1 14 8352 1 1 14 THR HB H -2.458 10.206 3.763 1.00 . A A . 14 THR HB 1 1 14 8353 1 1 14 THR HG1 H -1.019 11.328 2.891 1.00 . A A . 14 THR HG1 1 1 14 8354 1 1 14 THR HG21 H -0.434 10.004 6.050 1.00 . A A . 14 THR HG21 1 1 14 8355 1 1 14 THR HG22 H -1.499 11.400 5.723 1.00 . A A . 14 THR HG22 1 1 14 8356 1 1 14 THR HG23 H -2.196 9.838 6.171 1.00 . A A . 14 THR HG23 1 1 14 8357 1 1 14 THR N N -1.070 8.126 2.530 1.00 . A A . 14 THR N 1 1 14 8358 1 1 14 THR O O -2.234 6.705 5.304 1.00 . A A . 14 THR O 1 1 14 8359 1 1 14 THR OG1 O -0.505 10.701 3.449 1.00 . A A . 14 THR OG1 1 1 14 8360 1 1 15 THR C C -5.242 5.984 4.196 1.00 . A A . 15 THR C 1 1 14 8361 1 1 15 THR CA C -4.858 7.460 4.484 1.00 . A A . 15 THR CA 1 1 14 8362 1 1 15 THR CB C -5.800 8.524 3.868 1.00 . A A . 15 THR CB 1 1 14 8363 1 1 15 THR CG2 C -6.094 8.273 2.390 1.00 . A A . 15 THR CG2 1 1 14 8364 1 1 15 THR H H -3.628 8.499 3.143 1.00 . A A . 15 THR H 1 1 14 8365 1 1 15 THR HA H -4.805 7.618 5.561 1.00 . A A . 15 THR HA 1 1 14 8366 1 1 15 THR HB H -5.287 9.484 3.920 1.00 . A A . 15 THR HB 1 1 14 8367 1 1 15 THR HG1 H -7.465 9.419 4.062 1.00 . A A . 15 THR HG1 1 1 14 8368 1 1 15 THR HG21 H -5.163 8.207 1.834 1.00 . A A . 15 THR HG21 1 1 14 8369 1 1 15 THR HG22 H -6.663 7.350 2.283 1.00 . A A . 15 THR HG22 1 1 14 8370 1 1 15 THR HG23 H -6.672 9.094 1.971 1.00 . A A . 15 THR HG23 1 1 14 8371 1 1 15 THR N N -3.578 7.811 3.886 1.00 . A A . 15 THR N 1 1 14 8372 1 1 15 THR O O -6.408 5.601 4.174 1.00 . A A . 15 THR O 1 1 14 8373 1 1 15 THR OG1 O -7.005 8.713 4.558 1.00 . A A . 15 THR OG1 1 1 14 8374 1 1 16 CYS C C -3.152 2.970 4.686 1.00 . A A . 16 CYS C 1 1 14 8375 1 1 16 CYS CA C -4.306 3.656 3.947 1.00 . A A . 16 CYS CA 1 1 14 8376 1 1 16 CYS CB C -4.210 3.355 2.438 1.00 . A A . 16 CYS CB 1 1 14 8377 1 1 16 CYS H H -3.322 5.510 4.270 1.00 . A A . 16 CYS H 1 1 14 8378 1 1 16 CYS HA H -5.239 3.238 4.347 1.00 . A A . 16 CYS HA 1 1 14 8379 1 1 16 CYS HB2 H -3.310 3.826 2.050 1.00 . A A . 16 CYS HB2 1 1 14 8380 1 1 16 CYS HB3 H -4.107 2.281 2.281 1.00 . A A . 16 CYS HB3 1 1 14 8381 1 1 16 CYS N N -4.241 5.102 4.161 1.00 . A A . 16 CYS N 1 1 14 8382 1 1 16 CYS O O -2.991 1.756 4.545 1.00 . A A . 16 CYS O 1 1 14 8383 1 1 16 CYS SG S -5.605 3.909 1.431 1.00 . A A . 16 CYS SG 1 1 14 8384 1 1 17 PHE C C -1.510 3.063 7.702 1.00 . A A . 17 PHE C 1 1 14 8385 1 1 17 PHE CA C -1.221 3.166 6.201 1.00 . A A . 17 PHE CA 1 1 14 8386 1 1 17 PHE CB C 0.021 4.019 5.908 1.00 . A A . 17 PHE CB 1 1 14 8387 1 1 17 PHE CD1 C 1.636 2.126 6.275 1.00 . A A . 17 PHE CD1 1 1 14 8388 1 1 17 PHE CD2 C 2.111 4.242 7.353 1.00 . A A . 17 PHE CD2 1 1 14 8389 1 1 17 PHE CE1 C 2.737 1.536 6.905 1.00 . A A . 17 PHE CE1 1 1 14 8390 1 1 17 PHE CE2 C 3.219 3.653 7.991 1.00 . A A . 17 PHE CE2 1 1 14 8391 1 1 17 PHE CG C 1.295 3.464 6.513 1.00 . A A . 17 PHE CG 1 1 14 8392 1 1 17 PHE CZ C 3.533 2.300 7.759 1.00 . A A . 17 PHE CZ 1 1 14 8393 1 1 17 PHE H H -2.510 4.708 5.559 1.00 . A A . 17 PHE H 1 1 14 8394 1 1 17 PHE HA H -1.028 2.158 5.835 1.00 . A A . 17 PHE HA 1 1 14 8395 1 1 17 PHE HB2 H 0.157 4.062 4.825 1.00 . A A . 17 PHE HB2 1 1 14 8396 1 1 17 PHE HB3 H -0.144 5.031 6.286 1.00 . A A . 17 PHE HB3 1 1 14 8397 1 1 17 PHE HD1 H 1.038 1.549 5.600 1.00 . A A . 17 PHE HD1 1 1 14 8398 1 1 17 PHE HD2 H 1.865 5.275 7.560 1.00 . A A . 17 PHE HD2 1 1 14 8399 1 1 17 PHE HE1 H 2.974 0.493 6.752 1.00 . A A . 17 PHE HE1 1 1 14 8400 1 1 17 PHE HE2 H 3.800 4.231 8.698 1.00 . A A . 17 PHE HE2 1 1 14 8401 1 1 17 PHE HZ H 4.372 1.799 8.220 1.00 . A A . 17 PHE HZ 1 1 14 8402 1 1 17 PHE N N -2.353 3.710 5.467 1.00 . A A . 17 PHE N 1 1 14 8403 1 1 17 PHE O O -0.983 2.161 8.354 1.00 . A A . 17 PHE O 1 1 14 8404 1 1 18 ASN C C -1.474 4.031 10.587 1.00 . A A . 18 ASN C 1 1 14 8405 1 1 18 ASN CA C -2.714 4.036 9.675 1.00 . A A . 18 ASN CA 1 1 14 8406 1 1 18 ASN CB C -3.673 2.897 10.028 1.00 . A A . 18 ASN CB 1 1 14 8407 1 1 18 ASN CG C -4.349 3.059 11.384 1.00 . A A . 18 ASN CG 1 1 14 8408 1 1 18 ASN H H -2.719 4.680 7.664 1.00 . A A . 18 ASN H 1 1 14 8409 1 1 18 ASN HA H -3.226 4.987 9.829 1.00 . A A . 18 ASN HA 1 1 14 8410 1 1 18 ASN HB2 H -4.443 2.790 9.264 1.00 . A A . 18 ASN HB2 1 1 14 8411 1 1 18 ASN HB3 H -3.042 2.015 10.043 1.00 . A A . 18 ASN HB3 1 1 14 8412 1 1 18 ASN HD21 H -4.538 1.061 11.600 1.00 . A A . 18 ASN HD21 1 1 14 8413 1 1 18 ASN HD22 H -5.005 1.989 12.995 1.00 . A A . 18 ASN HD22 1 1 14 8414 1 1 18 ASN N N -2.372 3.931 8.248 1.00 . A A . 18 ASN N 1 1 14 8415 1 1 18 ASN ND2 N -4.762 1.972 12.011 1.00 . A A . 18 ASN ND2 1 1 14 8416 1 1 18 ASN O O -1.488 3.459 11.672 1.00 . A A . 18 ASN O 1 1 14 8417 1 1 18 ASN OD1 O -4.582 4.167 11.858 1.00 . A A . 18 ASN OD1 1 1 14 8418 1 1 19 ASN C C 1.408 3.081 11.053 1.00 . A A . 19 ASN C 1 1 14 8419 1 1 19 ASN CA C 0.987 4.493 10.606 1.00 . A A . 19 ASN CA 1 1 14 8420 1 1 19 ASN CB C 1.341 5.620 11.579 1.00 . A A . 19 ASN CB 1 1 14 8421 1 1 19 ASN CG C 2.849 5.838 11.570 1.00 . A A . 19 ASN CG 1 1 14 8422 1 1 19 ASN H H -0.492 5.128 9.247 1.00 . A A . 19 ASN H 1 1 14 8423 1 1 19 ASN HA H 1.566 4.683 9.722 1.00 . A A . 19 ASN HA 1 1 14 8424 1 1 19 ASN HB2 H 0.874 6.543 11.241 1.00 . A A . 19 ASN HB2 1 1 14 8425 1 1 19 ASN HB3 H 0.973 5.367 12.576 1.00 . A A . 19 ASN HB3 1 1 14 8426 1 1 19 ASN HD21 H 3.041 5.094 13.432 1.00 . A A . 19 ASN HD21 1 1 14 8427 1 1 19 ASN HD22 H 4.536 5.574 12.662 1.00 . A A . 19 ASN HD22 1 1 14 8428 1 1 19 ASN N N -0.376 4.613 10.115 1.00 . A A . 19 ASN N 1 1 14 8429 1 1 19 ASN ND2 N 3.525 5.519 12.657 1.00 . A A . 19 ASN ND2 1 1 14 8430 1 1 19 ASN O O 1.931 2.881 12.155 1.00 . A A . 19 ASN O 1 1 14 8431 1 1 19 ASN OD1 O 3.406 6.301 10.574 1.00 . A A . 19 ASN OD1 1 1 14 8432 1 1 20 GLY C C 0.748 -0.309 10.640 1.00 . A A . 20 GLY C 1 1 14 8433 1 1 20 GLY CA C 1.757 0.760 10.221 1.00 . A A . 20 GLY CA 1 1 14 8434 1 1 20 GLY H H 0.739 2.323 9.291 1.00 . A A . 20 GLY H 1 1 14 8435 1 1 20 GLY HA2 H 2.618 0.762 10.878 1.00 . A A . 20 GLY HA2 1 1 14 8436 1 1 20 GLY HA3 H 2.115 0.486 9.232 1.00 . A A . 20 GLY HA3 1 1 14 8437 1 1 20 GLY N N 1.209 2.107 10.159 1.00 . A A . 20 GLY N 1 1 14 8438 1 1 20 GLY O O 1.112 -1.470 10.816 1.00 . A A . 20 GLY O 1 1 14 8439 1 1 21 THR C C -2.850 -0.558 10.307 1.00 . A A . 21 THR C 1 1 14 8440 1 1 21 THR CA C -1.619 -0.816 11.204 1.00 . A A . 21 THR CA 1 1 14 8441 1 1 21 THR CB C -1.753 -0.728 12.743 1.00 . A A . 21 THR CB 1 1 14 8442 1 1 21 THR CG2 C -1.699 0.706 13.211 1.00 . A A . 21 THR CG2 1 1 14 8443 1 1 21 THR H H -0.764 1.019 10.578 1.00 . A A . 21 THR H 1 1 14 8444 1 1 21 THR HA H -1.322 -1.830 11.044 1.00 . A A . 21 THR HA 1 1 14 8445 1 1 21 THR HB H -0.887 -1.232 13.174 1.00 . A A . 21 THR HB 1 1 14 8446 1 1 21 THR HG1 H -2.805 -2.295 13.122 1.00 . A A . 21 THR HG1 1 1 14 8447 1 1 21 THR HG21 H -2.371 1.276 12.587 1.00 . A A . 21 THR HG21 1 1 14 8448 1 1 21 THR HG22 H -1.990 0.765 14.253 1.00 . A A . 21 THR HG22 1 1 14 8449 1 1 21 THR HG23 H -0.681 1.067 13.084 1.00 . A A . 21 THR HG23 1 1 14 8450 1 1 21 THR N N -0.530 0.052 10.755 1.00 . A A . 21 THR N 1 1 14 8451 1 1 21 THR O O -3.978 -0.388 10.766 1.00 . A A . 21 THR O 1 1 14 8452 1 1 21 THR OG1 O -2.901 -1.334 13.301 1.00 . A A . 21 THR OG1 1 1 14 8453 1 1 22 GLY C C -3.693 -1.082 6.893 1.00 . A A . 22 GLY C 1 1 14 8454 1 1 22 GLY CA C -3.598 -0.019 7.985 1.00 . A A . 22 GLY CA 1 1 14 8455 1 1 22 GLY H H -1.679 -0.563 8.659 1.00 . A A . 22 GLY H 1 1 14 8456 1 1 22 GLY HA2 H -3.284 0.915 7.522 1.00 . A A . 22 GLY HA2 1 1 14 8457 1 1 22 GLY HA3 H -4.577 0.121 8.440 1.00 . A A . 22 GLY HA3 1 1 14 8458 1 1 22 GLY N N -2.614 -0.395 9.001 1.00 . A A . 22 GLY N 1 1 14 8459 1 1 22 GLY O O -2.948 -2.062 6.944 1.00 . A A . 22 GLY O 1 1 14 8460 1 1 23 PRO C C -3.509 -2.144 4.045 1.00 . A A . 23 PRO C 1 1 14 8461 1 1 23 PRO CA C -4.780 -1.940 4.868 1.00 . A A . 23 PRO CA 1 1 14 8462 1 1 23 PRO CB C -5.957 -1.443 4.026 1.00 . A A . 23 PRO CB 1 1 14 8463 1 1 23 PRO CD C -5.430 0.232 5.654 1.00 . A A . 23 PRO CD 1 1 14 8464 1 1 23 PRO CG C -5.960 0.071 4.234 1.00 . A A . 23 PRO CG 1 1 14 8465 1 1 23 PRO HA H -5.052 -2.892 5.333 1.00 . A A . 23 PRO HA 1 1 14 8466 1 1 23 PRO HB2 H -5.846 -1.701 2.976 1.00 . A A . 23 PRO HB2 1 1 14 8467 1 1 23 PRO HB3 H -6.885 -1.861 4.414 1.00 . A A . 23 PRO HB3 1 1 14 8468 1 1 23 PRO HD2 H -4.905 1.172 5.777 1.00 . A A . 23 PRO HD2 1 1 14 8469 1 1 23 PRO HD3 H -6.264 0.237 6.337 1.00 . A A . 23 PRO HD3 1 1 14 8470 1 1 23 PRO HG2 H -5.283 0.543 3.525 1.00 . A A . 23 PRO HG2 1 1 14 8471 1 1 23 PRO HG3 H -6.957 0.491 4.136 1.00 . A A . 23 PRO HG3 1 1 14 8472 1 1 23 PRO N N -4.568 -0.918 5.887 1.00 . A A . 23 PRO N 1 1 14 8473 1 1 23 PRO O O -3.038 -3.274 3.904 1.00 . A A . 23 PRO O 1 1 14 8474 1 1 24 CYS C C -0.590 -0.716 3.910 1.00 . A A . 24 CYS C 1 1 14 8475 1 1 24 CYS CA C -1.636 -1.101 2.868 1.00 . A A . 24 CYS CA 1 1 14 8476 1 1 24 CYS CB C -1.621 -0.217 1.609 1.00 . A A . 24 CYS CB 1 1 14 8477 1 1 24 CYS H H -3.274 -0.142 3.815 1.00 . A A . 24 CYS H 1 1 14 8478 1 1 24 CYS HA H -1.441 -2.119 2.543 1.00 . A A . 24 CYS HA 1 1 14 8479 1 1 24 CYS HB2 H -2.610 0.200 1.424 1.00 . A A . 24 CYS HB2 1 1 14 8480 1 1 24 CYS HB3 H -0.931 0.616 1.740 1.00 . A A . 24 CYS HB3 1 1 14 8481 1 1 24 CYS N N -2.929 -1.056 3.532 1.00 . A A . 24 CYS N 1 1 14 8482 1 1 24 CYS O O -0.201 0.444 3.986 1.00 . A A . 24 CYS O 1 1 14 8483 1 1 24 CYS SG S -1.111 -1.108 0.122 1.00 . A A . 24 CYS SG 1 1 14 8484 1 1 25 ALA C C 2.006 -2.385 5.680 1.00 . A A . 25 ALA C 1 1 14 8485 1 1 25 ALA CA C 0.806 -1.463 5.813 1.00 . A A . 25 ALA CA 1 1 14 8486 1 1 25 ALA CB C 0.173 -1.570 7.197 1.00 . A A . 25 ALA CB 1 1 14 8487 1 1 25 ALA H H -0.531 -2.602 4.586 1.00 . A A . 25 ALA H 1 1 14 8488 1 1 25 ALA HA H 1.199 -0.460 5.722 1.00 . A A . 25 ALA HA 1 1 14 8489 1 1 25 ALA HB1 H -0.297 -2.544 7.329 1.00 . A A . 25 ALA HB1 1 1 14 8490 1 1 25 ALA HB2 H -0.561 -0.777 7.307 1.00 . A A . 25 ALA HB2 1 1 14 8491 1 1 25 ALA HB3 H 0.951 -1.452 7.951 1.00 . A A . 25 ALA HB3 1 1 14 8492 1 1 25 ALA N N -0.182 -1.667 4.758 1.00 . A A . 25 ALA N 1 1 14 8493 1 1 25 ALA O O 3.142 -1.908 5.657 1.00 . A A . 25 ALA O 1 1 14 8494 1 1 26 ASN C C 3.659 -4.432 4.159 1.00 . A A . 26 ASN C 1 1 14 8495 1 1 26 ASN CA C 2.893 -4.634 5.469 1.00 . A A . 26 ASN CA 1 1 14 8496 1 1 26 ASN CB C 2.469 -6.094 5.678 1.00 . A A . 26 ASN CB 1 1 14 8497 1 1 26 ASN CG C 1.621 -6.672 4.559 1.00 . A A . 26 ASN CG 1 1 14 8498 1 1 26 ASN H H 0.828 -4.031 5.536 1.00 . A A . 26 ASN H 1 1 14 8499 1 1 26 ASN HA H 3.574 -4.386 6.277 1.00 . A A . 26 ASN HA 1 1 14 8500 1 1 26 ASN HB2 H 3.374 -6.697 5.766 1.00 . A A . 26 ASN HB2 1 1 14 8501 1 1 26 ASN HB3 H 1.933 -6.177 6.619 1.00 . A A . 26 ASN HB3 1 1 14 8502 1 1 26 ASN HD21 H -0.131 -6.089 5.441 1.00 . A A . 26 ASN HD21 1 1 14 8503 1 1 26 ASN HD22 H -0.289 -6.758 3.858 1.00 . A A . 26 ASN HD22 1 1 14 8504 1 1 26 ASN N N 1.779 -3.697 5.585 1.00 . A A . 26 ASN N 1 1 14 8505 1 1 26 ASN ND2 N 0.313 -6.502 4.634 1.00 . A A . 26 ASN ND2 1 1 14 8506 1 1 26 ASN O O 4.863 -4.670 4.111 1.00 . A A . 26 ASN O 1 1 14 8507 1 1 26 ASN OD1 O 2.119 -7.335 3.655 1.00 . A A . 26 ASN OD1 1 1 14 8508 1 1 27 CYS C C 4.557 -2.253 2.075 1.00 . A A . 27 CYS C 1 1 14 8509 1 1 27 CYS CA C 3.603 -3.436 1.894 1.00 . A A . 27 CYS CA 1 1 14 8510 1 1 27 CYS CB C 2.541 -3.189 0.826 1.00 . A A . 27 CYS CB 1 1 14 8511 1 1 27 CYS H H 1.996 -3.739 3.265 1.00 . A A . 27 CYS H 1 1 14 8512 1 1 27 CYS HA H 4.182 -4.245 1.453 1.00 . A A . 27 CYS HA 1 1 14 8513 1 1 27 CYS HB2 H 1.875 -2.359 1.075 1.00 . A A . 27 CYS HB2 1 1 14 8514 1 1 27 CYS HB3 H 3.050 -2.896 -0.089 1.00 . A A . 27 CYS HB3 1 1 14 8515 1 1 27 CYS N N 2.991 -3.890 3.136 1.00 . A A . 27 CYS N 1 1 14 8516 1 1 27 CYS O O 5.045 -1.777 1.064 1.00 . A A . 27 CYS O 1 1 14 8517 1 1 27 CYS SG S 1.692 -4.764 0.515 1.00 . A A . 27 CYS SG 1 1 14 8518 1 1 28 LEU C C 7.002 -1.300 4.283 1.00 . A A . 28 LEU C 1 1 14 8519 1 1 28 LEU CA C 5.830 -0.704 3.506 1.00 . A A . 28 LEU CA 1 1 14 8520 1 1 28 LEU CB C 5.197 0.437 4.309 1.00 . A A . 28 LEU CB 1 1 14 8521 1 1 28 LEU CD1 C 4.593 2.162 2.540 1.00 . A A . 28 LEU CD1 1 1 14 8522 1 1 28 LEU CD2 C 2.915 0.442 3.057 1.00 . A A . 28 LEU CD2 1 1 14 8523 1 1 28 LEU CG C 4.080 1.232 3.631 1.00 . A A . 28 LEU CG 1 1 14 8524 1 1 28 LEU H H 4.196 -1.843 4.063 1.00 . A A . 28 LEU H 1 1 14 8525 1 1 28 LEU HA H 6.192 -0.311 2.557 1.00 . A A . 28 LEU HA 1 1 14 8526 1 1 28 LEU HB2 H 4.799 0.040 5.240 1.00 . A A . 28 LEU HB2 1 1 14 8527 1 1 28 LEU HB3 H 5.985 1.130 4.595 1.00 . A A . 28 LEU HB3 1 1 14 8528 1 1 28 LEU HD11 H 5.611 2.472 2.770 1.00 . A A . 28 LEU HD11 1 1 14 8529 1 1 28 LEU HD12 H 4.586 1.621 1.599 1.00 . A A . 28 LEU HD12 1 1 14 8530 1 1 28 LEU HD13 H 3.942 3.033 2.456 1.00 . A A . 28 LEU HD13 1 1 14 8531 1 1 28 LEU HD21 H 2.612 -0.312 3.774 1.00 . A A . 28 LEU HD21 1 1 14 8532 1 1 28 LEU HD22 H 2.079 1.118 2.905 1.00 . A A . 28 LEU HD22 1 1 14 8533 1 1 28 LEU HD23 H 3.216 -0.004 2.100 1.00 . A A . 28 LEU HD23 1 1 14 8534 1 1 28 LEU HG H 3.671 1.808 4.435 1.00 . A A . 28 LEU HG 1 1 14 8535 1 1 28 LEU N N 4.831 -1.733 3.280 1.00 . A A . 28 LEU N 1 1 14 8536 1 1 28 LEU O O 8.105 -1.464 3.759 1.00 . A A . 28 LEU O 1 1 14 8537 1 1 29 ALA C C 8.391 -3.409 6.222 1.00 . A A . 29 ALA C 1 1 14 8538 1 1 29 ALA CA C 7.785 -2.029 6.511 1.00 . A A . 29 ALA CA 1 1 14 8539 1 1 29 ALA CB C 7.212 -1.939 7.930 1.00 . A A . 29 ALA CB 1 1 14 8540 1 1 29 ALA H H 5.812 -1.561 5.901 1.00 . A A . 29 ALA H 1 1 14 8541 1 1 29 ALA HA H 8.599 -1.310 6.444 1.00 . A A . 29 ALA HA 1 1 14 8542 1 1 29 ALA HB1 H 7.982 -2.185 8.659 1.00 . A A . 29 ALA HB1 1 1 14 8543 1 1 29 ALA HB2 H 6.863 -0.927 8.134 1.00 . A A . 29 ALA HB2 1 1 14 8544 1 1 29 ALA HB3 H 6.383 -2.631 8.053 1.00 . A A . 29 ALA HB3 1 1 14 8545 1 1 29 ALA N N 6.756 -1.640 5.553 1.00 . A A . 29 ALA N 1 1 14 8546 1 1 29 ALA O O 9.310 -3.824 6.929 1.00 . A A . 29 ALA O 1 1 14 8547 1 1 30 GLY C C 8.104 -5.503 3.243 1.00 . A A . 30 GLY C 1 1 14 8548 1 1 30 GLY CA C 8.537 -5.318 4.685 1.00 . A A . 30 GLY CA 1 1 14 8549 1 1 30 GLY H H 7.134 -3.750 4.674 1.00 . A A . 30 GLY H 1 1 14 8550 1 1 30 GLY HA2 H 8.221 -6.178 5.274 1.00 . A A . 30 GLY HA2 1 1 14 8551 1 1 30 GLY HA3 H 9.618 -5.224 4.740 1.00 . A A . 30 GLY HA3 1 1 14 8552 1 1 30 GLY N N 7.912 -4.121 5.201 1.00 . A A . 30 GLY N 1 1 14 8553 1 1 30 GLY O O 7.259 -6.359 2.983 1.00 . A A . 30 GLY O 1 1 14 8554 1 1 31 TYR C C 9.167 -5.065 -0.160 1.00 . A A . 31 TYR C 1 1 14 8555 1 1 31 TYR CA C 8.122 -4.761 0.933 1.00 . A A . 31 TYR CA 1 1 14 8556 1 1 31 TYR CB C 7.463 -3.377 0.753 1.00 . A A . 31 TYR CB 1 1 14 8557 1 1 31 TYR CD1 C 9.648 -2.191 0.173 1.00 . A A . 31 TYR CD1 1 1 14 8558 1 1 31 TYR CD2 C 7.563 -1.412 -0.790 1.00 . A A . 31 TYR CD2 1 1 14 8559 1 1 31 TYR CE1 C 10.351 -1.315 -0.674 1.00 . A A . 31 TYR CE1 1 1 14 8560 1 1 31 TYR CE2 C 8.246 -0.491 -1.595 1.00 . A A . 31 TYR CE2 1 1 14 8561 1 1 31 TYR CG C 8.253 -2.291 0.049 1.00 . A A . 31 TYR CG 1 1 14 8562 1 1 31 TYR CZ C 9.661 -0.478 -1.579 1.00 . A A . 31 TYR CZ 1 1 14 8563 1 1 31 TYR H H 9.322 -4.007 2.552 1.00 . A A . 31 TYR H 1 1 14 8564 1 1 31 TYR HA H 7.347 -5.504 0.820 1.00 . A A . 31 TYR HA 1 1 14 8565 1 1 31 TYR HB2 H 6.581 -3.565 0.149 1.00 . A A . 31 TYR HB2 1 1 14 8566 1 1 31 TYR HB3 H 7.122 -2.954 1.703 1.00 . A A . 31 TYR HB3 1 1 14 8567 1 1 31 TYR HD1 H 10.173 -2.906 0.798 1.00 . A A . 31 TYR HD1 1 1 14 8568 1 1 31 TYR HD2 H 6.497 -1.503 -0.834 1.00 . A A . 31 TYR HD2 1 1 14 8569 1 1 31 TYR HE1 H 11.425 -1.323 -0.653 1.00 . A A . 31 TYR HE1 1 1 14 8570 1 1 31 TYR HE2 H 7.671 0.196 -2.209 1.00 . A A . 31 TYR HE2 1 1 14 8571 1 1 31 TYR HH H 11.306 0.250 -2.342 1.00 . A A . 31 TYR HH 1 1 14 8572 1 1 31 TYR N N 8.634 -4.705 2.303 1.00 . A A . 31 TYR N 1 1 14 8573 1 1 31 TYR O O 9.027 -4.580 -1.287 1.00 . A A . 31 TYR O 1 1 14 8574 1 1 31 TYR OH O 10.348 0.291 -2.467 1.00 . A A . 31 TYR OH 1 1 14 8575 1 1 32 PRO C C 10.424 -6.869 -2.331 1.00 . A A . 32 PRO C 1 1 14 8576 1 1 32 PRO CA C 11.038 -6.340 -1.030 1.00 . A A . 32 PRO CA 1 1 14 8577 1 1 32 PRO CB C 12.016 -7.318 -0.387 1.00 . A A . 32 PRO CB 1 1 14 8578 1 1 32 PRO CD C 10.192 -6.943 1.137 1.00 . A A . 32 PRO CD 1 1 14 8579 1 1 32 PRO CG C 11.251 -7.966 0.764 1.00 . A A . 32 PRO CG 1 1 14 8580 1 1 32 PRO HA H 11.557 -5.404 -1.240 1.00 . A A . 32 PRO HA 1 1 14 8581 1 1 32 PRO HB2 H 12.343 -8.063 -1.103 1.00 . A A . 32 PRO HB2 1 1 14 8582 1 1 32 PRO HB3 H 12.869 -6.767 0.008 1.00 . A A . 32 PRO HB3 1 1 14 8583 1 1 32 PRO HD2 H 9.259 -7.434 1.411 1.00 . A A . 32 PRO HD2 1 1 14 8584 1 1 32 PRO HD3 H 10.566 -6.339 1.960 1.00 . A A . 32 PRO HD3 1 1 14 8585 1 1 32 PRO HG2 H 10.778 -8.891 0.433 1.00 . A A . 32 PRO HG2 1 1 14 8586 1 1 32 PRO HG3 H 11.903 -8.134 1.616 1.00 . A A . 32 PRO HG3 1 1 14 8587 1 1 32 PRO N N 10.009 -6.098 -0.025 1.00 . A A . 32 PRO N 1 1 14 8588 1 1 32 PRO O O 10.951 -6.634 -3.422 1.00 . A A . 32 PRO O 1 1 14 8589 1 1 33 ALA C C 7.216 -7.310 -3.607 1.00 . A A . 33 ALA C 1 1 14 8590 1 1 33 ALA CA C 8.495 -8.103 -3.294 1.00 . A A . 33 ALA CA 1 1 14 8591 1 1 33 ALA CB C 8.163 -9.523 -2.859 1.00 . A A . 33 ALA CB 1 1 14 8592 1 1 33 ALA H H 8.909 -7.644 -1.285 1.00 . A A . 33 ALA H 1 1 14 8593 1 1 33 ALA HA H 9.101 -8.155 -4.201 1.00 . A A . 33 ALA HA 1 1 14 8594 1 1 33 ALA HB1 H 7.675 -10.047 -3.680 1.00 . A A . 33 ALA HB1 1 1 14 8595 1 1 33 ALA HB2 H 9.073 -10.061 -2.596 1.00 . A A . 33 ALA HB2 1 1 14 8596 1 1 33 ALA HB3 H 7.497 -9.478 -1.994 1.00 . A A . 33 ALA HB3 1 1 14 8597 1 1 33 ALA N N 9.265 -7.509 -2.220 1.00 . A A . 33 ALA N 1 1 14 8598 1 1 33 ALA O O 6.413 -7.754 -4.421 1.00 . A A . 33 ALA O 1 1 14 8599 1 1 34 GLY C C 5.221 -5.108 -4.374 1.00 . A A . 34 GLY C 1 1 14 8600 1 1 34 GLY CA C 5.644 -5.540 -2.968 1.00 . A A . 34 GLY CA 1 1 14 8601 1 1 34 GLY H H 7.661 -5.805 -2.315 1.00 . A A . 34 GLY H 1 1 14 8602 1 1 34 GLY HA2 H 5.641 -4.673 -2.313 1.00 . A A . 34 GLY HA2 1 1 14 8603 1 1 34 GLY HA3 H 4.906 -6.250 -2.597 1.00 . A A . 34 GLY HA3 1 1 14 8604 1 1 34 GLY N N 6.954 -6.188 -2.926 1.00 . A A . 34 GLY N 1 1 14 8605 1 1 34 GLY O O 4.025 -5.110 -4.664 1.00 . A A . 34 GLY O 1 1 14 8606 1 1 35 CYS C C 5.261 -5.697 -7.429 1.00 . A A . 35 CYS C 1 1 14 8607 1 1 35 CYS CA C 5.911 -4.536 -6.674 1.00 . A A . 35 CYS CA 1 1 14 8608 1 1 35 CYS CB C 7.216 -4.231 -7.408 1.00 . A A . 35 CYS CB 1 1 14 8609 1 1 35 CYS H H 7.116 -4.702 -4.925 1.00 . A A . 35 CYS H 1 1 14 8610 1 1 35 CYS HA H 5.246 -3.670 -6.722 1.00 . A A . 35 CYS HA 1 1 14 8611 1 1 35 CYS HB2 H 7.821 -5.134 -7.444 1.00 . A A . 35 CYS HB2 1 1 14 8612 1 1 35 CYS HB3 H 6.958 -3.982 -8.440 1.00 . A A . 35 CYS HB3 1 1 14 8613 1 1 35 CYS N N 6.171 -4.803 -5.264 1.00 . A A . 35 CYS N 1 1 14 8614 1 1 35 CYS O O 4.686 -5.465 -8.491 1.00 . A A . 35 CYS O 1 1 14 8615 1 1 35 CYS SG S 8.165 -2.853 -6.740 1.00 . A A . 35 CYS SG 1 1 14 8616 1 1 36 SER C C 3.402 -8.376 -6.915 1.00 . A A . 36 SER C 1 1 14 8617 1 1 36 SER CA C 4.752 -8.084 -7.563 1.00 . A A . 36 SER CA 1 1 14 8618 1 1 36 SER CB C 5.723 -9.252 -7.477 1.00 . A A . 36 SER CB 1 1 14 8619 1 1 36 SER H H 5.953 -7.186 -6.151 1.00 . A A . 36 SER H 1 1 14 8620 1 1 36 SER HA H 4.601 -7.869 -8.617 1.00 . A A . 36 SER HA 1 1 14 8621 1 1 36 SER HB2 H 5.476 -9.933 -8.276 1.00 . A A . 36 SER HB2 1 1 14 8622 1 1 36 SER HB3 H 6.725 -8.867 -7.647 1.00 . A A . 36 SER HB3 1 1 14 8623 1 1 36 SER HG H 6.226 -10.778 -6.455 1.00 . A A . 36 SER HG 1 1 14 8624 1 1 36 SER N N 5.391 -6.939 -6.956 1.00 . A A . 36 SER N 1 1 14 8625 1 1 36 SER O O 2.582 -9.119 -7.450 1.00 . A A . 36 SER O 1 1 14 8626 1 1 36 SER OG O 5.721 -9.966 -6.256 1.00 . A A . 36 SER OG 1 1 14 8627 1 1 37 ASN C C 0.928 -6.819 -5.706 1.00 . A A . 37 ASN C 1 1 14 8628 1 1 37 ASN CA C 1.840 -7.867 -5.099 1.00 . A A . 37 ASN CA 1 1 14 8629 1 1 37 ASN CB C 1.954 -7.743 -3.566 1.00 . A A . 37 ASN CB 1 1 14 8630 1 1 37 ASN CG C 1.578 -9.099 -3.002 1.00 . A A . 37 ASN CG 1 1 14 8631 1 1 37 ASN H H 3.850 -7.165 -5.391 1.00 . A A . 37 ASN H 1 1 14 8632 1 1 37 ASN HA H 1.406 -8.843 -5.324 1.00 . A A . 37 ASN HA 1 1 14 8633 1 1 37 ASN HB2 H 2.953 -7.431 -3.244 1.00 . A A . 37 ASN HB2 1 1 14 8634 1 1 37 ASN HB3 H 1.251 -7.006 -3.182 1.00 . A A . 37 ASN HB3 1 1 14 8635 1 1 37 ASN HD21 H -0.204 -8.416 -2.269 1.00 . A A . 37 ASN HD21 1 1 14 8636 1 1 37 ASN HD22 H 0.052 -10.140 -2.203 1.00 . A A . 37 ASN HD22 1 1 14 8637 1 1 37 ASN N N 3.133 -7.781 -5.753 1.00 . A A . 37 ASN N 1 1 14 8638 1 1 37 ASN ND2 N 0.373 -9.218 -2.470 1.00 . A A . 37 ASN ND2 1 1 14 8639 1 1 37 ASN O O 0.887 -5.696 -5.210 1.00 . A A . 37 ASN O 1 1 14 8640 1 1 37 ASN OD1 O 2.314 -10.069 -3.166 1.00 . A A . 37 ASN OD1 1 1 14 8641 1 1 38 SER C C -1.600 -5.429 -6.604 1.00 . A A . 38 SER C 1 1 14 8642 1 1 38 SER CA C -0.633 -6.205 -7.516 1.00 . A A . 38 SER CA 1 1 14 8643 1 1 38 SER CB C -1.357 -6.931 -8.651 1.00 . A A . 38 SER CB 1 1 14 8644 1 1 38 SER H H 0.346 -8.066 -7.186 1.00 . A A . 38 SER H 1 1 14 8645 1 1 38 SER HA H 0.029 -5.478 -7.993 1.00 . A A . 38 SER HA 1 1 14 8646 1 1 38 SER HB2 H -1.024 -7.964 -8.728 1.00 . A A . 38 SER HB2 1 1 14 8647 1 1 38 SER HB3 H -2.429 -6.927 -8.467 1.00 . A A . 38 SER HB3 1 1 14 8648 1 1 38 SER HG H -1.945 -5.873 -10.134 1.00 . A A . 38 SER HG 1 1 14 8649 1 1 38 SER N N 0.205 -7.150 -6.778 1.00 . A A . 38 SER N 1 1 14 8650 1 1 38 SER O O -1.794 -4.234 -6.829 1.00 . A A . 38 SER O 1 1 14 8651 1 1 38 SER OG O -1.093 -6.276 -9.873 1.00 . A A . 38 SER OG 1 1 14 8652 1 1 39 ASP C C -2.295 -4.175 -3.888 1.00 . A A . 39 ASP C 1 1 14 8653 1 1 39 ASP CA C -2.983 -5.376 -4.542 1.00 . A A . 39 ASP CA 1 1 14 8654 1 1 39 ASP CB C -3.436 -6.362 -3.454 1.00 . A A . 39 ASP CB 1 1 14 8655 1 1 39 ASP CG C -4.442 -5.715 -2.480 1.00 . A A . 39 ASP CG 1 1 14 8656 1 1 39 ASP H H -1.955 -7.031 -5.411 1.00 . A A . 39 ASP H 1 1 14 8657 1 1 39 ASP HA H -3.873 -5.015 -5.057 1.00 . A A . 39 ASP HA 1 1 14 8658 1 1 39 ASP HB2 H -3.917 -7.206 -3.946 1.00 . A A . 39 ASP HB2 1 1 14 8659 1 1 39 ASP HB3 H -2.568 -6.759 -2.916 1.00 . A A . 39 ASP HB3 1 1 14 8660 1 1 39 ASP N N -2.122 -6.045 -5.532 1.00 . A A . 39 ASP N 1 1 14 8661 1 1 39 ASP O O -2.942 -3.175 -3.593 1.00 . A A . 39 ASP O 1 1 14 8662 1 1 39 ASP OD1 O -5.518 -5.275 -2.943 1.00 . A A . 39 ASP OD1 1 1 14 8663 1 1 39 ASP OD2 O -4.216 -5.724 -1.254 1.00 . A A . 39 ASP OD2 1 1 14 8664 1 1 40 CYS C C 0.579 -2.403 -4.219 1.00 . A A . 40 CYS C 1 1 14 8665 1 1 40 CYS CA C -0.132 -3.207 -3.137 1.00 . A A . 40 CYS CA 1 1 14 8666 1 1 40 CYS CB C 0.882 -3.858 -2.174 1.00 . A A . 40 CYS CB 1 1 14 8667 1 1 40 CYS H H -0.484 -5.008 -4.170 1.00 . A A . 40 CYS H 1 1 14 8668 1 1 40 CYS HA H -0.746 -2.510 -2.563 1.00 . A A . 40 CYS HA 1 1 14 8669 1 1 40 CYS HB2 H 1.356 -4.731 -2.638 1.00 . A A . 40 CYS HB2 1 1 14 8670 1 1 40 CYS HB3 H 1.686 -3.165 -1.894 1.00 . A A . 40 CYS HB3 1 1 14 8671 1 1 40 CYS N N -0.972 -4.242 -3.721 1.00 . A A . 40 CYS N 1 1 14 8672 1 1 40 CYS O O 1.015 -1.301 -3.934 1.00 . A A . 40 CYS O 1 1 14 8673 1 1 40 CYS SG S 0.093 -4.343 -0.632 1.00 . A A . 40 CYS SG 1 1 14 8674 1 1 41 THR C C 1.095 -0.894 -6.792 1.00 . A A . 41 THR C 1 1 14 8675 1 1 41 THR CA C 1.520 -2.331 -6.489 1.00 . A A . 41 THR CA 1 1 14 8676 1 1 41 THR CB C 1.461 -3.270 -7.692 1.00 . A A . 41 THR CB 1 1 14 8677 1 1 41 THR CG2 C 2.171 -2.799 -8.941 1.00 . A A . 41 THR CG2 1 1 14 8678 1 1 41 THR H H 0.293 -3.816 -5.640 1.00 . A A . 41 THR H 1 1 14 8679 1 1 41 THR HA H 2.552 -2.297 -6.135 1.00 . A A . 41 THR HA 1 1 14 8680 1 1 41 THR HB H 0.412 -3.424 -7.946 1.00 . A A . 41 THR HB 1 1 14 8681 1 1 41 THR HG1 H 1.966 -4.675 -6.414 1.00 . A A . 41 THR HG1 1 1 14 8682 1 1 41 THR HG21 H 1.816 -1.810 -9.233 1.00 . A A . 41 THR HG21 1 1 14 8683 1 1 41 THR HG22 H 3.249 -2.772 -8.774 1.00 . A A . 41 THR HG22 1 1 14 8684 1 1 41 THR HG23 H 1.917 -3.525 -9.711 1.00 . A A . 41 THR HG23 1 1 14 8685 1 1 41 THR N N 0.701 -2.913 -5.442 1.00 . A A . 41 THR N 1 1 14 8686 1 1 41 THR O O 1.939 -0.020 -6.665 1.00 . A A . 41 THR O 1 1 14 8687 1 1 41 THR OG1 O 2.070 -4.505 -7.364 1.00 . A A . 41 THR OG1 1 1 14 8688 1 1 42 ALA C C -0.371 1.753 -6.402 1.00 . A A . 42 ALA C 1 1 14 8689 1 1 42 ALA CA C -0.552 0.748 -7.547 1.00 . A A . 42 ALA CA 1 1 14 8690 1 1 42 ALA CB C -2.005 0.759 -8.044 1.00 . A A . 42 ALA CB 1 1 14 8691 1 1 42 ALA H H -0.843 -1.354 -7.206 1.00 . A A . 42 ALA H 1 1 14 8692 1 1 42 ALA HA H 0.115 1.067 -8.364 1.00 . A A . 42 ALA HA 1 1 14 8693 1 1 42 ALA HB1 H -2.150 -0.004 -8.806 1.00 . A A . 42 ALA HB1 1 1 14 8694 1 1 42 ALA HB2 H -2.694 0.579 -7.218 1.00 . A A . 42 ALA HB2 1 1 14 8695 1 1 42 ALA HB3 H -2.221 1.733 -8.480 1.00 . A A . 42 ALA HB3 1 1 14 8696 1 1 42 ALA N N -0.165 -0.609 -7.144 1.00 . A A . 42 ALA N 1 1 14 8697 1 1 42 ALA O O 0.056 2.881 -6.663 1.00 . A A . 42 ALA O 1 1 14 8698 1 1 43 PHE C C 1.205 2.357 -3.957 1.00 . A A . 43 PHE C 1 1 14 8699 1 1 43 PHE CA C -0.298 2.091 -3.951 1.00 . A A . 43 PHE CA 1 1 14 8700 1 1 43 PHE CB C -0.772 1.331 -2.695 1.00 . A A . 43 PHE CB 1 1 14 8701 1 1 43 PHE CD1 C 0.934 1.465 -0.861 1.00 . A A . 43 PHE CD1 1 1 14 8702 1 1 43 PHE CD2 C -1.146 2.664 -0.531 1.00 . A A . 43 PHE CD2 1 1 14 8703 1 1 43 PHE CE1 C 1.405 1.922 0.375 1.00 . A A . 43 PHE CE1 1 1 14 8704 1 1 43 PHE CE2 C -0.685 3.087 0.730 1.00 . A A . 43 PHE CE2 1 1 14 8705 1 1 43 PHE CG C -0.319 1.866 -1.347 1.00 . A A . 43 PHE CG 1 1 14 8706 1 1 43 PHE CZ C 0.598 2.741 1.175 1.00 . A A . 43 PHE CZ 1 1 14 8707 1 1 43 PHE H H -1.022 0.407 -5.043 1.00 . A A . 43 PHE H 1 1 14 8708 1 1 43 PHE HA H -0.802 3.056 -3.991 1.00 . A A . 43 PHE HA 1 1 14 8709 1 1 43 PHE HB2 H -1.859 1.274 -2.710 1.00 . A A . 43 PHE HB2 1 1 14 8710 1 1 43 PHE HB3 H -0.389 0.317 -2.749 1.00 . A A . 43 PHE HB3 1 1 14 8711 1 1 43 PHE HD1 H 1.538 0.791 -1.440 1.00 . A A . 43 PHE HD1 1 1 14 8712 1 1 43 PHE HD2 H -2.138 2.955 -0.841 1.00 . A A . 43 PHE HD2 1 1 14 8713 1 1 43 PHE HE1 H 2.389 1.643 0.700 1.00 . A A . 43 PHE HE1 1 1 14 8714 1 1 43 PHE HE2 H -1.309 3.701 1.355 1.00 . A A . 43 PHE HE2 1 1 14 8715 1 1 43 PHE HZ H 0.961 3.086 2.132 1.00 . A A . 43 PHE HZ 1 1 14 8716 1 1 43 PHE N N -0.643 1.341 -5.155 1.00 . A A . 43 PHE N 1 1 14 8717 1 1 43 PHE O O 1.612 3.512 -4.011 1.00 . A A . 43 PHE O 1 1 14 8718 1 1 44 LEU C C 4.090 2.279 -4.997 1.00 . A A . 44 LEU C 1 1 14 8719 1 1 44 LEU CA C 3.492 1.500 -3.829 1.00 . A A . 44 LEU CA 1 1 14 8720 1 1 44 LEU CB C 4.207 0.151 -3.717 1.00 . A A . 44 LEU CB 1 1 14 8721 1 1 44 LEU CD1 C 4.504 -2.046 -2.639 1.00 . A A . 44 LEU CD1 1 1 14 8722 1 1 44 LEU CD2 C 4.162 0.057 -1.183 1.00 . A A . 44 LEU CD2 1 1 14 8723 1 1 44 LEU CG C 3.832 -0.677 -2.486 1.00 . A A . 44 LEU CG 1 1 14 8724 1 1 44 LEU H H 1.690 0.377 -3.793 1.00 . A A . 44 LEU H 1 1 14 8725 1 1 44 LEU HA H 3.657 2.084 -2.931 1.00 . A A . 44 LEU HA 1 1 14 8726 1 1 44 LEU HB2 H 4.028 -0.441 -4.619 1.00 . A A . 44 LEU HB2 1 1 14 8727 1 1 44 LEU HB3 H 5.270 0.354 -3.668 1.00 . A A . 44 LEU HB3 1 1 14 8728 1 1 44 LEU HD11 H 5.567 -1.922 -2.837 1.00 . A A . 44 LEU HD11 1 1 14 8729 1 1 44 LEU HD12 H 4.366 -2.642 -1.742 1.00 . A A . 44 LEU HD12 1 1 14 8730 1 1 44 LEU HD13 H 4.069 -2.571 -3.496 1.00 . A A . 44 LEU HD13 1 1 14 8731 1 1 44 LEU HD21 H 3.745 1.059 -1.157 1.00 . A A . 44 LEU HD21 1 1 14 8732 1 1 44 LEU HD22 H 3.690 -0.472 -0.363 1.00 . A A . 44 LEU HD22 1 1 14 8733 1 1 44 LEU HD23 H 5.233 0.127 -1.036 1.00 . A A . 44 LEU HD23 1 1 14 8734 1 1 44 LEU HG H 2.766 -0.850 -2.460 1.00 . A A . 44 LEU HG 1 1 14 8735 1 1 44 LEU N N 2.050 1.322 -3.922 1.00 . A A . 44 LEU N 1 1 14 8736 1 1 44 LEU O O 5.040 3.030 -4.803 1.00 . A A . 44 LEU O 1 1 14 8737 1 1 45 SER C C 3.632 4.423 -7.064 1.00 . A A . 45 SER C 1 1 14 8738 1 1 45 SER CA C 3.829 2.927 -7.364 1.00 . A A . 45 SER CA 1 1 14 8739 1 1 45 SER CB C 2.911 2.379 -8.463 1.00 . A A . 45 SER CB 1 1 14 8740 1 1 45 SER H H 2.803 1.455 -6.316 1.00 . A A . 45 SER H 1 1 14 8741 1 1 45 SER HA H 4.873 2.762 -7.641 1.00 . A A . 45 SER HA 1 1 14 8742 1 1 45 SER HB2 H 1.946 2.122 -8.040 1.00 . A A . 45 SER HB2 1 1 14 8743 1 1 45 SER HB3 H 2.714 3.110 -9.227 1.00 . A A . 45 SER HB3 1 1 14 8744 1 1 45 SER HG H 3.285 1.357 -10.032 1.00 . A A . 45 SER HG 1 1 14 8745 1 1 45 SER N N 3.535 2.143 -6.190 1.00 . A A . 45 SER N 1 1 14 8746 1 1 45 SER O O 4.514 5.224 -7.389 1.00 . A A . 45 SER O 1 1 14 8747 1 1 45 SER OG O 3.468 1.235 -9.076 1.00 . A A . 45 SER OG 1 1 14 8748 1 1 46 GLN C C 3.393 6.473 -4.756 1.00 . A A . 46 GLN C 1 1 14 8749 1 1 46 GLN CA C 2.388 6.172 -5.874 1.00 . A A . 46 GLN CA 1 1 14 8750 1 1 46 GLN CB C 0.942 6.469 -5.422 1.00 . A A . 46 GLN CB 1 1 14 8751 1 1 46 GLN CD C -1.380 7.129 -6.321 1.00 . A A . 46 GLN CD 1 1 14 8752 1 1 46 GLN CG C -0.052 6.422 -6.594 1.00 . A A . 46 GLN CG 1 1 14 8753 1 1 46 GLN H H 1.880 4.110 -6.067 1.00 . A A . 46 GLN H 1 1 14 8754 1 1 46 GLN HA H 2.619 6.845 -6.698 1.00 . A A . 46 GLN HA 1 1 14 8755 1 1 46 GLN HB2 H 0.625 5.773 -4.648 1.00 . A A . 46 GLN HB2 1 1 14 8756 1 1 46 GLN HB3 H 0.928 7.471 -4.995 1.00 . A A . 46 GLN HB3 1 1 14 8757 1 1 46 GLN HE21 H -2.491 5.559 -7.003 1.00 . A A . 46 GLN HE21 1 1 14 8758 1 1 46 GLN HE22 H -3.379 7.001 -6.588 1.00 . A A . 46 GLN HE22 1 1 14 8759 1 1 46 GLN HG2 H 0.400 6.900 -7.461 1.00 . A A . 46 GLN HG2 1 1 14 8760 1 1 46 GLN HG3 H -0.251 5.382 -6.838 1.00 . A A . 46 GLN HG3 1 1 14 8761 1 1 46 GLN N N 2.552 4.810 -6.370 1.00 . A A . 46 GLN N 1 1 14 8762 1 1 46 GLN NE2 N -2.497 6.515 -6.670 1.00 . A A . 46 GLN NE2 1 1 14 8763 1 1 46 GLN O O 4.058 7.508 -4.816 1.00 . A A . 46 GLN O 1 1 14 8764 1 1 46 GLN OE1 O -1.417 8.266 -5.856 1.00 . A A . 46 GLN OE1 1 1 14 8765 1 1 47 CYS C C 5.753 5.971 -2.757 1.00 . A A . 47 CYS C 1 1 14 8766 1 1 47 CYS CA C 4.239 6.028 -2.517 1.00 . A A . 47 CYS CA 1 1 14 8767 1 1 47 CYS CB C 3.801 5.223 -1.279 1.00 . A A . 47 CYS CB 1 1 14 8768 1 1 47 CYS H H 2.886 4.832 -3.687 1.00 . A A . 47 CYS H 1 1 14 8769 1 1 47 CYS HA H 3.979 7.066 -2.306 1.00 . A A . 47 CYS HA 1 1 14 8770 1 1 47 CYS HB2 H 4.400 4.309 -1.181 1.00 . A A . 47 CYS HB2 1 1 14 8771 1 1 47 CYS HB3 H 3.995 5.842 -0.400 1.00 . A A . 47 CYS HB3 1 1 14 8772 1 1 47 CYS N N 3.501 5.640 -3.718 1.00 . A A . 47 CYS N 1 1 14 8773 1 1 47 CYS O O 6.445 6.978 -2.590 1.00 . A A . 47 CYS O 1 1 14 8774 1 1 47 CYS SG S 2.045 4.767 -1.221 1.00 . A A . 47 CYS SG 1 1 14 8775 1 1 48 TYR C C 8.065 4.965 -4.809 1.00 . A A . 48 TYR C 1 1 14 8776 1 1 48 TYR CA C 7.695 4.559 -3.385 1.00 . A A . 48 TYR CA 1 1 14 8777 1 1 48 TYR CB C 8.052 3.097 -3.144 1.00 . A A . 48 TYR CB 1 1 14 8778 1 1 48 TYR CD1 C 7.033 2.334 -0.973 1.00 . A A . 48 TYR CD1 1 1 14 8779 1 1 48 TYR CD2 C 9.424 2.781 -1.044 1.00 . A A . 48 TYR CD2 1 1 14 8780 1 1 48 TYR CE1 C 7.188 1.811 0.317 1.00 . A A . 48 TYR CE1 1 1 14 8781 1 1 48 TYR CE2 C 9.571 2.311 0.275 1.00 . A A . 48 TYR CE2 1 1 14 8782 1 1 48 TYR CG C 8.167 2.766 -1.675 1.00 . A A . 48 TYR CG 1 1 14 8783 1 1 48 TYR CZ C 8.447 1.795 0.953 1.00 . A A . 48 TYR CZ 1 1 14 8784 1 1 48 TYR H H 5.642 4.059 -3.375 1.00 . A A . 48 TYR H 1 1 14 8785 1 1 48 TYR HA H 8.309 5.107 -2.683 1.00 . A A . 48 TYR HA 1 1 14 8786 1 1 48 TYR HB2 H 7.322 2.440 -3.617 1.00 . A A . 48 TYR HB2 1 1 14 8787 1 1 48 TYR HB3 H 9.017 2.895 -3.612 1.00 . A A . 48 TYR HB3 1 1 14 8788 1 1 48 TYR HD1 H 6.072 2.294 -1.465 1.00 . A A . 48 TYR HD1 1 1 14 8789 1 1 48 TYR HD2 H 10.298 3.087 -1.601 1.00 . A A . 48 TYR HD2 1 1 14 8790 1 1 48 TYR HE1 H 6.359 1.321 0.778 1.00 . A A . 48 TYR HE1 1 1 14 8791 1 1 48 TYR HE2 H 10.550 2.296 0.732 1.00 . A A . 48 TYR HE2 1 1 14 8792 1 1 48 TYR HH H 9.386 0.816 2.334 1.00 . A A . 48 TYR HH 1 1 14 8793 1 1 48 TYR N N 6.280 4.800 -3.112 1.00 . A A . 48 TYR N 1 1 14 8794 1 1 48 TYR O O 8.982 5.761 -4.997 1.00 . A A . 48 TYR O 1 1 14 8795 1 1 48 TYR OH O 8.556 1.286 2.207 1.00 . A A . 48 TYR OH 1 1 14 8796 1 1 49 GLY C C 7.909 3.158 -7.913 1.00 . A A . 49 GLY C 1 1 14 8797 1 1 49 GLY CA C 7.760 4.506 -7.215 1.00 . A A . 49 GLY CA 1 1 14 8798 1 1 49 GLY H H 6.586 3.818 -5.574 1.00 . A A . 49 GLY H 1 1 14 8799 1 1 49 GLY HA2 H 8.702 5.041 -7.312 1.00 . A A . 49 GLY HA2 1 1 14 8800 1 1 49 GLY HA3 H 7.009 5.086 -7.745 1.00 . A A . 49 GLY HA3 1 1 14 8801 1 1 49 GLY N N 7.388 4.393 -5.807 1.00 . A A . 49 GLY N 1 1 14 8802 1 1 49 GLY O O 8.113 3.145 -9.124 1.00 . A A . 49 GLY O 1 1 14 8803 1 1 50 GLY C C 9.455 0.326 -7.716 1.00 . A A . 50 GLY C 1 1 14 8804 1 1 50 GLY CA C 7.973 0.712 -7.740 1.00 . A A . 50 GLY CA 1 1 14 8805 1 1 50 GLY H H 7.563 2.116 -6.213 1.00 . A A . 50 GLY H 1 1 14 8806 1 1 50 GLY HA2 H 7.612 0.675 -8.764 1.00 . A A . 50 GLY HA2 1 1 14 8807 1 1 50 GLY HA3 H 7.379 0.003 -7.164 1.00 . A A . 50 GLY HA3 1 1 14 8808 1 1 50 GLY N N 7.775 2.042 -7.193 1.00 . A A . 50 GLY N 1 1 14 8809 1 1 50 GLY O O 10.188 0.627 -8.656 1.00 . A A . 50 GLY O 1 1 14 8810 1 1 51 CYS C C 11.891 -1.551 -7.518 1.00 . A A . 51 CYS C 1 1 14 8811 1 1 51 CYS CA C 11.097 -1.011 -6.323 1.00 . A A . 51 CYS CA 1 1 14 8812 1 1 51 CYS CB C 10.826 -2.106 -5.260 1.00 . A A . 51 CYS CB 1 1 14 8813 1 1 51 CYS H H 9.108 -0.535 -5.953 1.00 . A A . 51 CYS H 1 1 14 8814 1 1 51 CYS HA H 11.724 -0.250 -5.860 1.00 . A A . 51 CYS HA 1 1 14 8815 1 1 51 CYS HB2 H 11.795 -2.488 -4.937 1.00 . A A . 51 CYS HB2 1 1 14 8816 1 1 51 CYS HB3 H 10.394 -1.629 -4.383 1.00 . A A . 51 CYS HB3 1 1 14 8817 1 1 51 CYS N N 9.823 -0.387 -6.652 1.00 . A A . 51 CYS N 1 1 14 8818 1 1 51 CYS O O 11.760 -2.742 -7.885 1.00 . A A . 51 CYS O 1 1 14 8819 1 1 51 CYS OXT O 12.801 -0.851 -7.992 1.00 . A A . 51 CYS OXT 1 1 14 8820 1 1 51 CYS SG S 9.773 -3.556 -5.679 1.00 . A A . 51 CYS SG 1 1 15 8821 1 1 1 GLY C C -7.830 -5.803 -1.037 1.00 . A A . 1 GLY C 1 1 15 8822 1 1 1 GLY CA C -7.612 -7.047 -1.870 1.00 . A A . 1 GLY CA 1 1 15 8823 1 1 1 GLY H1 H -8.159 -6.140 -3.614 1.00 . A A . 1 GLY H1 1 1 15 8824 1 1 1 GLY H2 H -6.531 -6.130 -3.318 1.00 . A A . 1 GLY H2 1 1 15 8825 1 1 1 GLY H3 H -7.263 -7.510 -3.836 1.00 . A A . 1 GLY H3 1 1 15 8826 1 1 1 GLY HA2 H -6.745 -7.586 -1.507 1.00 . A A . 1 GLY HA2 1 1 15 8827 1 1 1 GLY HA3 H -8.489 -7.676 -1.786 1.00 . A A . 1 GLY HA3 1 1 15 8828 1 1 1 GLY N N -7.380 -6.682 -3.269 1.00 . A A . 1 GLY N 1 1 15 8829 1 1 1 GLY O O -8.279 -4.779 -1.554 1.00 . A A . 1 GLY O 1 1 15 8830 1 1 2 GLU C C -7.212 -3.483 0.831 1.00 . A A . 2 GLU C 1 1 15 8831 1 1 2 GLU CA C -7.895 -4.804 1.194 1.00 . A A . 2 GLU CA 1 1 15 8832 1 1 2 GLU CB C -7.646 -5.199 2.654 1.00 . A A . 2 GLU CB 1 1 15 8833 1 1 2 GLU CD C -6.119 -6.462 4.233 1.00 . A A . 2 GLU CD 1 1 15 8834 1 1 2 GLU CG C -6.241 -5.748 2.888 1.00 . A A . 2 GLU CG 1 1 15 8835 1 1 2 GLU H H -7.130 -6.716 0.640 1.00 . A A . 2 GLU H 1 1 15 8836 1 1 2 GLU HA H -8.960 -4.644 1.123 1.00 . A A . 2 GLU HA 1 1 15 8837 1 1 2 GLU HB2 H -7.792 -4.318 3.280 1.00 . A A . 2 GLU HB2 1 1 15 8838 1 1 2 GLU HB3 H -8.378 -5.960 2.926 1.00 . A A . 2 GLU HB3 1 1 15 8839 1 1 2 GLU HG2 H -6.027 -6.451 2.091 1.00 . A A . 2 GLU HG2 1 1 15 8840 1 1 2 GLU HG3 H -5.508 -4.943 2.826 1.00 . A A . 2 GLU HG3 1 1 15 8841 1 1 2 GLU N N -7.571 -5.886 0.265 1.00 . A A . 2 GLU N 1 1 15 8842 1 1 2 GLU O O -7.804 -2.425 1.042 1.00 . A A . 2 GLU O 1 1 15 8843 1 1 2 GLU OE1 O -6.194 -5.799 5.288 1.00 . A A . 2 GLU OE1 1 1 15 8844 1 1 2 GLU OE2 O -5.867 -7.689 4.248 1.00 . A A . 2 GLU OE2 1 1 15 8845 1 1 3 CYS C C -6.038 -1.658 -1.354 1.00 . A A . 3 CYS C 1 1 15 8846 1 1 3 CYS CA C -5.344 -2.274 -0.130 1.00 . A A . 3 CYS CA 1 1 15 8847 1 1 3 CYS CB C -3.844 -2.499 -0.338 1.00 . A A . 3 CYS CB 1 1 15 8848 1 1 3 CYS H H -5.599 -4.407 -0.004 1.00 . A A . 3 CYS H 1 1 15 8849 1 1 3 CYS HA H -5.460 -1.585 0.708 1.00 . A A . 3 CYS HA 1 1 15 8850 1 1 3 CYS HB2 H -3.407 -2.809 0.611 1.00 . A A . 3 CYS HB2 1 1 15 8851 1 1 3 CYS HB3 H -3.689 -3.297 -1.060 1.00 . A A . 3 CYS HB3 1 1 15 8852 1 1 3 CYS N N -6.009 -3.515 0.247 1.00 . A A . 3 CYS N 1 1 15 8853 1 1 3 CYS O O -6.345 -0.466 -1.355 1.00 . A A . 3 CYS O 1 1 15 8854 1 1 3 CYS SG S -2.982 -1.011 -0.913 1.00 . A A . 3 CYS SG 1 1 15 8855 1 1 4 GLU C C -8.551 -1.518 -3.077 1.00 . A A . 4 GLU C 1 1 15 8856 1 1 4 GLU CA C -7.168 -2.025 -3.509 1.00 . A A . 4 GLU CA 1 1 15 8857 1 1 4 GLU CB C -7.383 -3.166 -4.514 1.00 . A A . 4 GLU CB 1 1 15 8858 1 1 4 GLU CD C -6.454 -4.956 -6.003 1.00 . A A . 4 GLU CD 1 1 15 8859 1 1 4 GLU CG C -6.111 -3.784 -5.083 1.00 . A A . 4 GLU CG 1 1 15 8860 1 1 4 GLU H H -6.047 -3.429 -2.329 1.00 . A A . 4 GLU H 1 1 15 8861 1 1 4 GLU HA H -6.639 -1.211 -4.008 1.00 . A A . 4 GLU HA 1 1 15 8862 1 1 4 GLU HB2 H -7.966 -3.953 -4.040 1.00 . A A . 4 GLU HB2 1 1 15 8863 1 1 4 GLU HB3 H -7.956 -2.774 -5.349 1.00 . A A . 4 GLU HB3 1 1 15 8864 1 1 4 GLU HG2 H -5.546 -3.032 -5.635 1.00 . A A . 4 GLU HG2 1 1 15 8865 1 1 4 GLU HG3 H -5.512 -4.144 -4.253 1.00 . A A . 4 GLU HG3 1 1 15 8866 1 1 4 GLU N N -6.375 -2.472 -2.360 1.00 . A A . 4 GLU N 1 1 15 8867 1 1 4 GLU O O -9.113 -0.630 -3.717 1.00 . A A . 4 GLU O 1 1 15 8868 1 1 4 GLU OE1 O -7.189 -4.767 -6.996 1.00 . A A . 4 GLU OE1 1 1 15 8869 1 1 4 GLU OE2 O -6.033 -6.101 -5.715 1.00 . A A . 4 GLU OE2 1 1 15 8870 1 1 5 GLN C C -10.257 -0.308 -0.770 1.00 . A A . 5 GLN C 1 1 15 8871 1 1 5 GLN CA C -10.412 -1.650 -1.485 1.00 . A A . 5 GLN CA 1 1 15 8872 1 1 5 GLN CB C -11.021 -2.732 -0.579 1.00 . A A . 5 GLN CB 1 1 15 8873 1 1 5 GLN CD C -13.427 -1.978 -1.090 1.00 . A A . 5 GLN CD 1 1 15 8874 1 1 5 GLN CG C -12.403 -2.359 -0.017 1.00 . A A . 5 GLN CG 1 1 15 8875 1 1 5 GLN H H -8.623 -2.824 -1.533 1.00 . A A . 5 GLN H 1 1 15 8876 1 1 5 GLN HA H -11.080 -1.499 -2.328 1.00 . A A . 5 GLN HA 1 1 15 8877 1 1 5 GLN HB2 H -11.120 -3.656 -1.149 1.00 . A A . 5 GLN HB2 1 1 15 8878 1 1 5 GLN HB3 H -10.349 -2.914 0.261 1.00 . A A . 5 GLN HB3 1 1 15 8879 1 1 5 GLN HE21 H -13.599 -3.899 -1.784 1.00 . A A . 5 GLN HE21 1 1 15 8880 1 1 5 GLN HE22 H -14.430 -2.650 -2.693 1.00 . A A . 5 GLN HE22 1 1 15 8881 1 1 5 GLN HG2 H -12.779 -3.209 0.553 1.00 . A A . 5 GLN HG2 1 1 15 8882 1 1 5 GLN HG3 H -12.288 -1.524 0.675 1.00 . A A . 5 GLN HG3 1 1 15 8883 1 1 5 GLN N N -9.128 -2.088 -2.013 1.00 . A A . 5 GLN N 1 1 15 8884 1 1 5 GLN NE2 N -13.871 -2.927 -1.894 1.00 . A A . 5 GLN NE2 1 1 15 8885 1 1 5 GLN O O -11.148 0.528 -0.866 1.00 . A A . 5 GLN O 1 1 15 8886 1 1 5 GLN OE1 O -13.853 -0.831 -1.214 1.00 . A A . 5 GLN OE1 1 1 15 8887 1 1 6 CYS C C -8.713 2.276 -0.644 1.00 . A A . 6 CYS C 1 1 15 8888 1 1 6 CYS CA C -8.807 1.224 0.466 1.00 . A A . 6 CYS CA 1 1 15 8889 1 1 6 CYS CB C -7.524 1.103 1.295 1.00 . A A . 6 CYS CB 1 1 15 8890 1 1 6 CYS H H -8.439 -0.817 -0.033 1.00 . A A . 6 CYS H 1 1 15 8891 1 1 6 CYS HA H -9.625 1.504 1.131 1.00 . A A . 6 CYS HA 1 1 15 8892 1 1 6 CYS HB2 H -7.502 0.110 1.740 1.00 . A A . 6 CYS HB2 1 1 15 8893 1 1 6 CYS HB3 H -6.654 1.192 0.642 1.00 . A A . 6 CYS HB3 1 1 15 8894 1 1 6 CYS N N -9.126 -0.073 -0.105 1.00 . A A . 6 CYS N 1 1 15 8895 1 1 6 CYS O O -9.269 3.363 -0.515 1.00 . A A . 6 CYS O 1 1 15 8896 1 1 6 CYS SG S -7.399 2.310 2.639 1.00 . A A . 6 CYS SG 1 1 15 8897 1 1 7 PHE C C -9.525 3.002 -3.506 1.00 . A A . 7 PHE C 1 1 15 8898 1 1 7 PHE CA C -8.098 2.796 -2.967 1.00 . A A . 7 PHE CA 1 1 15 8899 1 1 7 PHE CB C -7.150 2.226 -4.031 1.00 . A A . 7 PHE CB 1 1 15 8900 1 1 7 PHE CD1 C -5.764 4.133 -4.978 1.00 . A A . 7 PHE CD1 1 1 15 8901 1 1 7 PHE CD2 C -4.709 2.598 -3.420 1.00 . A A . 7 PHE CD2 1 1 15 8902 1 1 7 PHE CE1 C -4.578 4.889 -5.060 1.00 . A A . 7 PHE CE1 1 1 15 8903 1 1 7 PHE CE2 C -3.523 3.349 -3.517 1.00 . A A . 7 PHE CE2 1 1 15 8904 1 1 7 PHE CG C -5.841 2.992 -4.155 1.00 . A A . 7 PHE CG 1 1 15 8905 1 1 7 PHE CZ C -3.447 4.498 -4.321 1.00 . A A . 7 PHE CZ 1 1 15 8906 1 1 7 PHE H H -7.614 1.049 -1.816 1.00 . A A . 7 PHE H 1 1 15 8907 1 1 7 PHE HA H -7.728 3.781 -2.678 1.00 . A A . 7 PHE HA 1 1 15 8908 1 1 7 PHE HB2 H -6.937 1.177 -3.824 1.00 . A A . 7 PHE HB2 1 1 15 8909 1 1 7 PHE HB3 H -7.653 2.250 -4.995 1.00 . A A . 7 PHE HB3 1 1 15 8910 1 1 7 PHE HD1 H -6.636 4.470 -5.519 1.00 . A A . 7 PHE HD1 1 1 15 8911 1 1 7 PHE HD2 H -4.756 1.756 -2.734 1.00 . A A . 7 PHE HD2 1 1 15 8912 1 1 7 PHE HE1 H -4.565 5.802 -5.641 1.00 . A A . 7 PHE HE1 1 1 15 8913 1 1 7 PHE HE2 H -2.680 3.095 -2.899 1.00 . A A . 7 PHE HE2 1 1 15 8914 1 1 7 PHE HZ H -2.538 5.102 -4.316 1.00 . A A . 7 PHE HZ 1 1 15 8915 1 1 7 PHE N N -8.086 1.946 -1.778 1.00 . A A . 7 PHE N 1 1 15 8916 1 1 7 PHE O O -9.870 4.124 -3.883 1.00 . A A . 7 PHE O 1 1 15 8917 1 1 8 SER C C -12.584 2.867 -2.713 1.00 . A A . 8 SER C 1 1 15 8918 1 1 8 SER CA C -11.809 2.093 -3.798 1.00 . A A . 8 SER CA 1 1 15 8919 1 1 8 SER CB C -12.426 0.705 -3.998 1.00 . A A . 8 SER CB 1 1 15 8920 1 1 8 SER H H -10.031 1.048 -3.282 1.00 . A A . 8 SER H 1 1 15 8921 1 1 8 SER HA H -11.933 2.652 -4.725 1.00 . A A . 8 SER HA 1 1 15 8922 1 1 8 SER HB2 H -12.081 0.044 -3.209 1.00 . A A . 8 SER HB2 1 1 15 8923 1 1 8 SER HB3 H -13.508 0.782 -3.926 1.00 . A A . 8 SER HB3 1 1 15 8924 1 1 8 SER HG H -12.995 0.101 -5.732 1.00 . A A . 8 SER HG 1 1 15 8925 1 1 8 SER N N -10.377 1.972 -3.514 1.00 . A A . 8 SER N 1 1 15 8926 1 1 8 SER O O -13.797 3.036 -2.844 1.00 . A A . 8 SER O 1 1 15 8927 1 1 8 SER OG O -12.132 0.158 -5.275 1.00 . A A . 8 SER OG 1 1 15 8928 1 1 9 ASP C C -11.651 5.536 -0.604 1.00 . A A . 9 ASP C 1 1 15 8929 1 1 9 ASP CA C -12.501 4.256 -0.659 1.00 . A A . 9 ASP CA 1 1 15 8930 1 1 9 ASP CB C -12.557 3.508 0.683 1.00 . A A . 9 ASP CB 1 1 15 8931 1 1 9 ASP CG C -13.723 3.934 1.576 1.00 . A A . 9 ASP CG 1 1 15 8932 1 1 9 ASP H H -10.946 3.138 -1.547 1.00 . A A . 9 ASP H 1 1 15 8933 1 1 9 ASP HA H -13.517 4.534 -0.943 1.00 . A A . 9 ASP HA 1 1 15 8934 1 1 9 ASP HB2 H -12.676 2.439 0.493 1.00 . A A . 9 ASP HB2 1 1 15 8935 1 1 9 ASP HB3 H -11.614 3.627 1.217 1.00 . A A . 9 ASP HB3 1 1 15 8936 1 1 9 ASP N N -11.928 3.360 -1.664 1.00 . A A . 9 ASP N 1 1 15 8937 1 1 9 ASP O O -11.419 6.126 0.450 1.00 . A A . 9 ASP O 1 1 15 8938 1 1 9 ASP OD1 O -14.038 5.135 1.721 1.00 . A A . 9 ASP OD1 1 1 15 8939 1 1 9 ASP OD2 O -14.324 3.005 2.171 1.00 . A A . 9 ASP OD2 1 1 15 8940 1 1 10 GLY C C -9.012 7.231 -1.467 1.00 . A A . 10 GLY C 1 1 15 8941 1 1 10 GLY CA C -10.455 7.224 -1.980 1.00 . A A . 10 GLY CA 1 1 15 8942 1 1 10 GLY H H -11.303 5.383 -2.585 1.00 . A A . 10 GLY H 1 1 15 8943 1 1 10 GLY HA2 H -11.004 8.021 -1.482 1.00 . A A . 10 GLY HA2 1 1 15 8944 1 1 10 GLY HA3 H -10.425 7.427 -3.049 1.00 . A A . 10 GLY HA3 1 1 15 8945 1 1 10 GLY N N -11.180 5.979 -1.776 1.00 . A A . 10 GLY N 1 1 15 8946 1 1 10 GLY O O -8.386 8.294 -1.470 1.00 . A A . 10 GLY O 1 1 15 8947 1 1 11 GLY C C -6.049 6.381 -1.378 1.00 . A A . 11 GLY C 1 1 15 8948 1 1 11 GLY CA C -7.168 5.927 -0.451 1.00 . A A . 11 GLY CA 1 1 15 8949 1 1 11 GLY H H -9.085 5.265 -1.018 1.00 . A A . 11 GLY H 1 1 15 8950 1 1 11 GLY HA2 H -7.029 4.863 -0.295 1.00 . A A . 11 GLY HA2 1 1 15 8951 1 1 11 GLY HA3 H -7.118 6.448 0.500 1.00 . A A . 11 GLY HA3 1 1 15 8952 1 1 11 GLY N N -8.494 6.088 -1.022 1.00 . A A . 11 GLY N 1 1 15 8953 1 1 11 GLY O O -6.155 6.200 -2.588 1.00 . A A . 11 GLY O 1 1 15 8954 1 1 12 ASP C C -2.545 6.588 -1.071 1.00 . A A . 12 ASP C 1 1 15 8955 1 1 12 ASP CA C -3.779 7.338 -1.580 1.00 . A A . 12 ASP CA 1 1 15 8956 1 1 12 ASP CB C -3.579 8.863 -1.548 1.00 . A A . 12 ASP CB 1 1 15 8957 1 1 12 ASP CG C -3.912 9.589 -0.243 1.00 . A A . 12 ASP CG 1 1 15 8958 1 1 12 ASP H H -4.909 6.987 0.182 1.00 . A A . 12 ASP H 1 1 15 8959 1 1 12 ASP HA H -3.899 7.054 -2.627 1.00 . A A . 12 ASP HA 1 1 15 8960 1 1 12 ASP HB2 H -2.564 9.112 -1.856 1.00 . A A . 12 ASP HB2 1 1 15 8961 1 1 12 ASP HB3 H -4.242 9.269 -2.308 1.00 . A A . 12 ASP HB3 1 1 15 8962 1 1 12 ASP N N -4.957 6.917 -0.822 1.00 . A A . 12 ASP N 1 1 15 8963 1 1 12 ASP O O -2.283 5.472 -1.513 1.00 . A A . 12 ASP O 1 1 15 8964 1 1 12 ASP OD1 O -3.565 9.102 0.861 1.00 . A A . 12 ASP OD1 1 1 15 8965 1 1 12 ASP OD2 O -4.408 10.738 -0.338 1.00 . A A . 12 ASP OD2 1 1 15 8966 1 1 13 CYS C C -0.588 6.937 1.949 1.00 . A A . 13 CYS C 1 1 15 8967 1 1 13 CYS CA C -0.570 6.659 0.457 1.00 . A A . 13 CYS CA 1 1 15 8968 1 1 13 CYS CB C 0.661 7.312 -0.181 1.00 . A A . 13 CYS CB 1 1 15 8969 1 1 13 CYS H H -2.160 8.049 0.245 1.00 . A A . 13 CYS H 1 1 15 8970 1 1 13 CYS HA H -0.515 5.586 0.299 1.00 . A A . 13 CYS HA 1 1 15 8971 1 1 13 CYS HB2 H 0.532 8.390 -0.239 1.00 . A A . 13 CYS HB2 1 1 15 8972 1 1 13 CYS HB3 H 1.525 7.117 0.456 1.00 . A A . 13 CYS HB3 1 1 15 8973 1 1 13 CYS N N -1.801 7.173 -0.130 1.00 . A A . 13 CYS N 1 1 15 8974 1 1 13 CYS O O -0.394 6.029 2.760 1.00 . A A . 13 CYS O 1 1 15 8975 1 1 13 CYS SG S 1.042 6.674 -1.819 1.00 . A A . 13 CYS SG 1 1 15 8976 1 1 14 THR C C -2.354 7.814 4.166 1.00 . A A . 14 THR C 1 1 15 8977 1 1 14 THR CA C -1.107 8.574 3.688 1.00 . A A . 14 THR CA 1 1 15 8978 1 1 14 THR CB C -1.185 10.111 3.728 1.00 . A A . 14 THR CB 1 1 15 8979 1 1 14 THR CG2 C -1.558 10.705 5.081 1.00 . A A . 14 THR CG2 1 1 15 8980 1 1 14 THR H H -0.968 8.910 1.611 1.00 . A A . 14 THR H 1 1 15 8981 1 1 14 THR HA H -0.278 8.258 4.322 1.00 . A A . 14 THR HA 1 1 15 8982 1 1 14 THR HB H -1.918 10.450 3.000 1.00 . A A . 14 THR HB 1 1 15 8983 1 1 14 THR HG1 H 0.747 10.091 3.803 1.00 . A A . 14 THR HG1 1 1 15 8984 1 1 14 THR HG21 H -0.966 10.248 5.876 1.00 . A A . 14 THR HG21 1 1 15 8985 1 1 14 THR HG22 H -1.389 11.780 5.074 1.00 . A A . 14 THR HG22 1 1 15 8986 1 1 14 THR HG23 H -2.620 10.546 5.258 1.00 . A A . 14 THR HG23 1 1 15 8987 1 1 14 THR N N -0.831 8.192 2.320 1.00 . A A . 14 THR N 1 1 15 8988 1 1 14 THR O O -2.260 7.019 5.106 1.00 . A A . 14 THR O 1 1 15 8989 1 1 14 THR OG1 O 0.082 10.633 3.364 1.00 . A A . 14 THR OG1 1 1 15 8990 1 1 15 THR C C -5.203 6.175 4.001 1.00 . A A . 15 THR C 1 1 15 8991 1 1 15 THR CA C -4.774 7.656 4.166 1.00 . A A . 15 THR CA 1 1 15 8992 1 1 15 THR CB C -5.765 8.714 3.628 1.00 . A A . 15 THR CB 1 1 15 8993 1 1 15 THR CG2 C -6.435 8.350 2.301 1.00 . A A . 15 THR CG2 1 1 15 8994 1 1 15 THR H H -3.546 8.490 2.633 1.00 . A A . 15 THR H 1 1 15 8995 1 1 15 THR HA H -4.657 7.851 5.231 1.00 . A A . 15 THR HA 1 1 15 8996 1 1 15 THR HB H -5.198 9.628 3.440 1.00 . A A . 15 THR HB 1 1 15 8997 1 1 15 THR HG1 H -7.534 9.324 4.152 1.00 . A A . 15 THR HG1 1 1 15 8998 1 1 15 THR HG21 H -5.710 7.886 1.639 1.00 . A A . 15 THR HG21 1 1 15 8999 1 1 15 THR HG22 H -7.269 7.667 2.461 1.00 . A A . 15 THR HG22 1 1 15 9000 1 1 15 THR HG23 H -6.808 9.250 1.816 1.00 . A A . 15 THR HG23 1 1 15 9001 1 1 15 THR N N -3.506 7.957 3.503 1.00 . A A . 15 THR N 1 1 15 9002 1 1 15 THR O O -6.391 5.854 4.051 1.00 . A A . 15 THR O 1 1 15 9003 1 1 15 THR OG1 O -6.710 9.065 4.614 1.00 . A A . 15 THR OG1 1 1 15 9004 1 1 16 CYS C C -3.082 3.105 4.504 1.00 . A A . 16 CYS C 1 1 15 9005 1 1 16 CYS CA C -4.334 3.785 3.925 1.00 . A A . 16 CYS CA 1 1 15 9006 1 1 16 CYS CB C -4.540 3.359 2.465 1.00 . A A . 16 CYS CB 1 1 15 9007 1 1 16 CYS H H -3.296 5.637 4.035 1.00 . A A . 16 CYS H 1 1 15 9008 1 1 16 CYS HA H -5.187 3.415 4.510 1.00 . A A . 16 CYS HA 1 1 15 9009 1 1 16 CYS HB2 H -3.808 3.873 1.841 1.00 . A A . 16 CYS HB2 1 1 15 9010 1 1 16 CYS HB3 H -4.375 2.287 2.343 1.00 . A A . 16 CYS HB3 1 1 15 9011 1 1 16 CYS N N -4.228 5.253 3.996 1.00 . A A . 16 CYS N 1 1 15 9012 1 1 16 CYS O O -3.006 1.875 4.496 1.00 . A A . 16 CYS O 1 1 15 9013 1 1 16 CYS SG S -6.199 3.737 1.856 1.00 . A A . 16 CYS SG 1 1 15 9014 1 1 17 PHE C C -1.444 3.177 7.296 1.00 . A A . 17 PHE C 1 1 15 9015 1 1 17 PHE CA C -1.036 3.263 5.826 1.00 . A A . 17 PHE CA 1 1 15 9016 1 1 17 PHE CB C 0.260 4.078 5.685 1.00 . A A . 17 PHE CB 1 1 15 9017 1 1 17 PHE CD1 C 1.777 2.119 6.204 1.00 . A A . 17 PHE CD1 1 1 15 9018 1 1 17 PHE CD2 C 2.232 4.233 7.303 1.00 . A A . 17 PHE CD2 1 1 15 9019 1 1 17 PHE CE1 C 2.854 1.518 6.875 1.00 . A A . 17 PHE CE1 1 1 15 9020 1 1 17 PHE CE2 C 3.344 3.648 7.937 1.00 . A A . 17 PHE CE2 1 1 15 9021 1 1 17 PHE CG C 1.452 3.471 6.411 1.00 . A A . 17 PHE CG 1 1 15 9022 1 1 17 PHE CZ C 3.656 2.295 7.720 1.00 . A A . 17 PHE CZ 1 1 15 9023 1 1 17 PHE H H -2.158 4.868 5.012 1.00 . A A . 17 PHE H 1 1 15 9024 1 1 17 PHE HA H -0.847 2.249 5.469 1.00 . A A . 17 PHE HA 1 1 15 9025 1 1 17 PHE HB2 H 0.513 4.145 4.627 1.00 . A A . 17 PHE HB2 1 1 15 9026 1 1 17 PHE HB3 H 0.086 5.090 6.052 1.00 . A A . 17 PHE HB3 1 1 15 9027 1 1 17 PHE HD1 H 1.197 1.535 5.516 1.00 . A A . 17 PHE HD1 1 1 15 9028 1 1 17 PHE HD2 H 1.987 5.263 7.524 1.00 . A A . 17 PHE HD2 1 1 15 9029 1 1 17 PHE HE1 H 3.087 0.468 6.733 1.00 . A A . 17 PHE HE1 1 1 15 9030 1 1 17 PHE HE2 H 3.948 4.226 8.625 1.00 . A A . 17 PHE HE2 1 1 15 9031 1 1 17 PHE HZ H 4.486 1.832 8.231 1.00 . A A . 17 PHE HZ 1 1 15 9032 1 1 17 PHE N N -2.102 3.859 5.025 1.00 . A A . 17 PHE N 1 1 15 9033 1 1 17 PHE O O -1.008 2.264 7.997 1.00 . A A . 17 PHE O 1 1 15 9034 1 1 18 ASN C C -1.497 4.459 10.166 1.00 . A A . 18 ASN C 1 1 15 9035 1 1 18 ASN CA C -2.667 4.335 9.176 1.00 . A A . 18 ASN CA 1 1 15 9036 1 1 18 ASN CB C -3.671 3.248 9.592 1.00 . A A . 18 ASN CB 1 1 15 9037 1 1 18 ASN CG C -4.809 3.730 10.483 1.00 . A A . 18 ASN CG 1 1 15 9038 1 1 18 ASN H H -2.606 4.838 7.145 1.00 . A A . 18 ASN H 1 1 15 9039 1 1 18 ASN HA H -3.199 5.286 9.216 1.00 . A A . 18 ASN HA 1 1 15 9040 1 1 18 ASN HB2 H -4.110 2.807 8.700 1.00 . A A . 18 ASN HB2 1 1 15 9041 1 1 18 ASN HB3 H -3.126 2.484 10.130 1.00 . A A . 18 ASN HB3 1 1 15 9042 1 1 18 ASN HD21 H -6.189 3.091 9.144 1.00 . A A . 18 ASN HD21 1 1 15 9043 1 1 18 ASN HD22 H -6.832 3.849 10.576 1.00 . A A . 18 ASN HD22 1 1 15 9044 1 1 18 ASN N N -2.255 4.129 7.779 1.00 . A A . 18 ASN N 1 1 15 9045 1 1 18 ASN ND2 N -6.036 3.579 10.023 1.00 . A A . 18 ASN ND2 1 1 15 9046 1 1 18 ASN O O -1.731 4.628 11.358 1.00 . A A . 18 ASN O 1 1 15 9047 1 1 18 ASN OD1 O -4.624 4.208 11.598 1.00 . A A . 18 ASN OD1 1 1 15 9048 1 1 19 ASN C C 1.217 2.814 10.862 1.00 . A A . 19 ASN C 1 1 15 9049 1 1 19 ASN CA C 0.973 4.276 10.498 1.00 . A A . 19 ASN CA 1 1 15 9050 1 1 19 ASN CB C 1.078 5.283 11.643 1.00 . A A . 19 ASN CB 1 1 15 9051 1 1 19 ASN CG C 2.514 5.592 12.002 1.00 . A A . 19 ASN CG 1 1 15 9052 1 1 19 ASN H H -0.138 4.271 8.710 1.00 . A A . 19 ASN H 1 1 15 9053 1 1 19 ASN HA H 1.779 4.542 9.830 1.00 . A A . 19 ASN HA 1 1 15 9054 1 1 19 ASN HB2 H 0.663 6.215 11.280 1.00 . A A . 19 ASN HB2 1 1 15 9055 1 1 19 ASN HB3 H 0.522 4.942 12.516 1.00 . A A . 19 ASN HB3 1 1 15 9056 1 1 19 ASN HD21 H 2.376 4.736 13.853 1.00 . A A . 19 ASN HD21 1 1 15 9057 1 1 19 ASN HD22 H 3.834 5.664 13.486 1.00 . A A . 19 ASN HD22 1 1 15 9058 1 1 19 ASN N N -0.243 4.419 9.699 1.00 . A A . 19 ASN N 1 1 15 9059 1 1 19 ASN ND2 N 2.947 5.270 13.202 1.00 . A A . 19 ASN ND2 1 1 15 9060 1 1 19 ASN O O 1.002 2.387 11.996 1.00 . A A . 19 ASN O 1 1 15 9061 1 1 19 ASN OD1 O 3.222 6.211 11.213 1.00 . A A . 19 ASN OD1 1 1 15 9062 1 1 20 GLY C C 0.641 -0.306 10.372 1.00 . A A . 20 GLY C 1 1 15 9063 1 1 20 GLY CA C 1.812 0.585 9.975 1.00 . A A . 20 GLY CA 1 1 15 9064 1 1 20 GLY H H 1.581 2.392 8.920 1.00 . A A . 20 GLY H 1 1 15 9065 1 1 20 GLY HA2 H 2.624 0.510 10.698 1.00 . A A . 20 GLY HA2 1 1 15 9066 1 1 20 GLY HA3 H 2.196 0.219 9.025 1.00 . A A . 20 GLY HA3 1 1 15 9067 1 1 20 GLY N N 1.438 1.988 9.835 1.00 . A A . 20 GLY N 1 1 15 9068 1 1 20 GLY O O 0.835 -1.473 10.716 1.00 . A A . 20 GLY O 1 1 15 9069 1 1 21 THR C C -2.986 -0.312 9.976 1.00 . A A . 21 THR C 1 1 15 9070 1 1 21 THR CA C -1.772 -0.349 10.920 1.00 . A A . 21 THR CA 1 1 15 9071 1 1 21 THR CB C -2.001 0.372 12.268 1.00 . A A . 21 THR CB 1 1 15 9072 1 1 21 THR CG2 C -1.102 -0.202 13.360 1.00 . A A . 21 THR CG2 1 1 15 9073 1 1 21 THR H H -0.658 1.181 10.001 1.00 . A A . 21 THR H 1 1 15 9074 1 1 21 THR HA H -1.607 -1.403 11.142 1.00 . A A . 21 THR HA 1 1 15 9075 1 1 21 THR HB H -3.039 0.248 12.573 1.00 . A A . 21 THR HB 1 1 15 9076 1 1 21 THR HG1 H -0.721 1.846 12.173 1.00 . A A . 21 THR HG1 1 1 15 9077 1 1 21 THR HG21 H -1.224 -1.283 13.389 1.00 . A A . 21 THR HG21 1 1 15 9078 1 1 21 THR HG22 H -0.054 0.021 13.164 1.00 . A A . 21 THR HG22 1 1 15 9079 1 1 21 THR HG23 H -1.380 0.216 14.329 1.00 . A A . 21 THR HG23 1 1 15 9080 1 1 21 THR N N -0.580 0.219 10.301 1.00 . A A . 21 THR N 1 1 15 9081 1 1 21 THR O O -4.061 -0.789 10.333 1.00 . A A . 21 THR O 1 1 15 9082 1 1 21 THR OG1 O -1.690 1.753 12.217 1.00 . A A . 21 THR OG1 1 1 15 9083 1 1 22 GLY C C -3.736 -0.973 6.818 1.00 . A A . 22 GLY C 1 1 15 9084 1 1 22 GLY CA C -3.846 0.257 7.718 1.00 . A A . 22 GLY CA 1 1 15 9085 1 1 22 GLY H H -1.930 0.608 8.505 1.00 . A A . 22 GLY H 1 1 15 9086 1 1 22 GLY HA2 H -3.705 1.150 7.112 1.00 . A A . 22 GLY HA2 1 1 15 9087 1 1 22 GLY HA3 H -4.840 0.286 8.166 1.00 . A A . 22 GLY HA3 1 1 15 9088 1 1 22 GLY N N -2.832 0.231 8.764 1.00 . A A . 22 GLY N 1 1 15 9089 1 1 22 GLY O O -2.880 -1.829 7.060 1.00 . A A . 22 GLY O 1 1 15 9090 1 1 23 PRO C C -3.366 -2.359 4.041 1.00 . A A . 23 PRO C 1 1 15 9091 1 1 23 PRO CA C -4.615 -2.246 4.920 1.00 . A A . 23 PRO CA 1 1 15 9092 1 1 23 PRO CB C -5.885 -2.096 4.082 1.00 . A A . 23 PRO CB 1 1 15 9093 1 1 23 PRO CD C -5.511 -0.043 5.310 1.00 . A A . 23 PRO CD 1 1 15 9094 1 1 23 PRO CG C -6.121 -0.588 4.021 1.00 . A A . 23 PRO CG 1 1 15 9095 1 1 23 PRO HA H -4.696 -3.143 5.537 1.00 . A A . 23 PRO HA 1 1 15 9096 1 1 23 PRO HB2 H -5.765 -2.520 3.085 1.00 . A A . 23 PRO HB2 1 1 15 9097 1 1 23 PRO HB3 H -6.714 -2.578 4.597 1.00 . A A . 23 PRO HB3 1 1 15 9098 1 1 23 PRO HD2 H -5.007 0.891 5.100 1.00 . A A . 23 PRO HD2 1 1 15 9099 1 1 23 PRO HD3 H -6.282 0.178 6.041 1.00 . A A . 23 PRO HD3 1 1 15 9100 1 1 23 PRO HG2 H -5.585 -0.172 3.166 1.00 . A A . 23 PRO HG2 1 1 15 9101 1 1 23 PRO HG3 H -7.184 -0.356 3.959 1.00 . A A . 23 PRO HG3 1 1 15 9102 1 1 23 PRO N N -4.576 -1.066 5.774 1.00 . A A . 23 PRO N 1 1 15 9103 1 1 23 PRO O O -2.902 -3.470 3.778 1.00 . A A . 23 PRO O 1 1 15 9104 1 1 24 CYS C C -0.437 -0.877 3.874 1.00 . A A . 24 CYS C 1 1 15 9105 1 1 24 CYS CA C -1.531 -1.220 2.864 1.00 . A A . 24 CYS CA 1 1 15 9106 1 1 24 CYS CB C -1.604 -0.252 1.665 1.00 . A A . 24 CYS CB 1 1 15 9107 1 1 24 CYS H H -3.142 -0.338 3.908 1.00 . A A . 24 CYS H 1 1 15 9108 1 1 24 CYS HA H -1.325 -2.217 2.474 1.00 . A A . 24 CYS HA 1 1 15 9109 1 1 24 CYS HB2 H -2.596 0.195 1.598 1.00 . A A . 24 CYS HB2 1 1 15 9110 1 1 24 CYS HB3 H -0.900 0.570 1.794 1.00 . A A . 24 CYS HB3 1 1 15 9111 1 1 24 CYS N N -2.790 -1.236 3.593 1.00 . A A . 24 CYS N 1 1 15 9112 1 1 24 CYS O O 0.030 0.256 3.913 1.00 . A A . 24 CYS O 1 1 15 9113 1 1 24 CYS SG S -1.213 -1.024 0.081 1.00 . A A . 24 CYS SG 1 1 15 9114 1 1 25 ALA C C 2.128 -2.498 5.720 1.00 . A A . 25 ALA C 1 1 15 9115 1 1 25 ALA CA C 0.907 -1.597 5.804 1.00 . A A . 25 ALA CA 1 1 15 9116 1 1 25 ALA CB C 0.244 -1.703 7.171 1.00 . A A . 25 ALA CB 1 1 15 9117 1 1 25 ALA H H -0.522 -2.730 4.669 1.00 . A A . 25 ALA H 1 1 15 9118 1 1 25 ALA HA H 1.281 -0.581 5.727 1.00 . A A . 25 ALA HA 1 1 15 9119 1 1 25 ALA HB1 H 1.015 -1.636 7.936 1.00 . A A . 25 ALA HB1 1 1 15 9120 1 1 25 ALA HB2 H -0.272 -2.658 7.257 1.00 . A A . 25 ALA HB2 1 1 15 9121 1 1 25 ALA HB3 H -0.460 -0.878 7.293 1.00 . A A . 25 ALA HB3 1 1 15 9122 1 1 25 ALA N N -0.058 -1.833 4.731 1.00 . A A . 25 ALA N 1 1 15 9123 1 1 25 ALA O O 3.254 -1.998 5.787 1.00 . A A . 25 ALA O 1 1 15 9124 1 1 26 ASN C C 3.799 -4.391 4.059 1.00 . A A . 26 ASN C 1 1 15 9125 1 1 26 ASN CA C 3.123 -4.681 5.402 1.00 . A A . 26 ASN CA 1 1 15 9126 1 1 26 ASN CB C 2.782 -6.174 5.513 1.00 . A A . 26 ASN CB 1 1 15 9127 1 1 26 ASN CG C 2.343 -6.578 6.911 1.00 . A A . 26 ASN CG 1 1 15 9128 1 1 26 ASN H H 1.021 -4.204 5.508 1.00 . A A . 26 ASN H 1 1 15 9129 1 1 26 ASN HA H 3.836 -4.420 6.189 1.00 . A A . 26 ASN HA 1 1 15 9130 1 1 26 ASN HB2 H 2.035 -6.443 4.767 1.00 . A A . 26 ASN HB2 1 1 15 9131 1 1 26 ASN HB3 H 3.691 -6.733 5.289 1.00 . A A . 26 ASN HB3 1 1 15 9132 1 1 26 ASN HD21 H 0.363 -6.535 6.423 1.00 . A A . 26 ASN HD21 1 1 15 9133 1 1 26 ASN HD22 H 0.692 -6.849 8.097 1.00 . A A . 26 ASN HD22 1 1 15 9134 1 1 26 ASN N N 1.952 -3.814 5.568 1.00 . A A . 26 ASN N 1 1 15 9135 1 1 26 ASN ND2 N 1.050 -6.626 7.169 1.00 . A A . 26 ASN ND2 1 1 15 9136 1 1 26 ASN O O 5.014 -4.533 3.946 1.00 . A A . 26 ASN O 1 1 15 9137 1 1 26 ASN OD1 O 3.177 -6.861 7.765 1.00 . A A . 26 ASN OD1 1 1 15 9138 1 1 27 CYS C C 4.533 -2.214 1.981 1.00 . A A . 27 CYS C 1 1 15 9139 1 1 27 CYS CA C 3.511 -3.350 1.817 1.00 . A A . 27 CYS CA 1 1 15 9140 1 1 27 CYS CB C 2.339 -3.010 0.879 1.00 . A A . 27 CYS CB 1 1 15 9141 1 1 27 CYS H H 2.033 -3.851 3.246 1.00 . A A . 27 CYS H 1 1 15 9142 1 1 27 CYS HA H 4.020 -4.147 1.276 1.00 . A A . 27 CYS HA 1 1 15 9143 1 1 27 CYS HB2 H 1.738 -2.163 1.217 1.00 . A A . 27 CYS HB2 1 1 15 9144 1 1 27 CYS HB3 H 2.754 -2.716 -0.082 1.00 . A A . 27 CYS HB3 1 1 15 9145 1 1 27 CYS N N 3.028 -3.885 3.083 1.00 . A A . 27 CYS N 1 1 15 9146 1 1 27 CYS O O 5.035 -1.772 0.960 1.00 . A A . 27 CYS O 1 1 15 9147 1 1 27 CYS SG S 1.341 -4.505 0.623 1.00 . A A . 27 CYS SG 1 1 15 9148 1 1 28 LEU C C 7.190 -1.265 3.929 1.00 . A A . 28 LEU C 1 1 15 9149 1 1 28 LEU CA C 5.890 -0.697 3.383 1.00 . A A . 28 LEU CA 1 1 15 9150 1 1 28 LEU CB C 5.339 0.337 4.365 1.00 . A A . 28 LEU CB 1 1 15 9151 1 1 28 LEU CD1 C 4.888 2.184 2.726 1.00 . A A . 28 LEU CD1 1 1 15 9152 1 1 28 LEU CD2 C 3.089 0.556 3.095 1.00 . A A . 28 LEU CD2 1 1 15 9153 1 1 28 LEU CG C 4.277 1.249 3.756 1.00 . A A . 28 LEU CG 1 1 15 9154 1 1 28 LEU H H 4.268 -1.832 3.987 1.00 . A A . 28 LEU H 1 1 15 9155 1 1 28 LEU HA H 6.121 -0.206 2.438 1.00 . A A . 28 LEU HA 1 1 15 9156 1 1 28 LEU HB2 H 4.916 -0.164 5.237 1.00 . A A . 28 LEU HB2 1 1 15 9157 1 1 28 LEU HB3 H 6.161 0.959 4.724 1.00 . A A . 28 LEU HB3 1 1 15 9158 1 1 28 LEU HD11 H 5.866 2.537 3.054 1.00 . A A . 28 LEU HD11 1 1 15 9159 1 1 28 LEU HD12 H 5.003 1.612 1.816 1.00 . A A . 28 LEU HD12 1 1 15 9160 1 1 28 LEU HD13 H 4.224 3.026 2.542 1.00 . A A . 28 LEU HD13 1 1 15 9161 1 1 28 LEU HD21 H 2.730 -0.246 3.732 1.00 . A A . 28 LEU HD21 1 1 15 9162 1 1 28 LEU HD22 H 2.286 1.277 2.980 1.00 . A A . 28 LEU HD22 1 1 15 9163 1 1 28 LEU HD23 H 3.379 0.174 2.109 1.00 . A A . 28 LEU HD23 1 1 15 9164 1 1 28 LEU HG H 3.896 1.807 4.582 1.00 . A A . 28 LEU HG 1 1 15 9165 1 1 28 LEU N N 4.874 -1.720 3.182 1.00 . A A . 28 LEU N 1 1 15 9166 1 1 28 LEU O O 8.237 -1.086 3.308 1.00 . A A . 28 LEU O 1 1 15 9167 1 1 29 ALA C C 8.914 -3.503 5.137 1.00 . A A . 29 ALA C 1 1 15 9168 1 1 29 ALA CA C 8.336 -2.279 5.843 1.00 . A A . 29 ALA CA 1 1 15 9169 1 1 29 ALA CB C 8.000 -2.541 7.314 1.00 . A A . 29 ALA CB 1 1 15 9170 1 1 29 ALA H H 6.252 -1.951 5.583 1.00 . A A . 29 ALA H 1 1 15 9171 1 1 29 ALA HA H 9.080 -1.484 5.808 1.00 . A A . 29 ALA HA 1 1 15 9172 1 1 29 ALA HB1 H 8.890 -2.917 7.819 1.00 . A A . 29 ALA HB1 1 1 15 9173 1 1 29 ALA HB2 H 7.685 -1.612 7.792 1.00 . A A . 29 ALA HB2 1 1 15 9174 1 1 29 ALA HB3 H 7.203 -3.277 7.401 1.00 . A A . 29 ALA HB3 1 1 15 9175 1 1 29 ALA N N 7.145 -1.845 5.130 1.00 . A A . 29 ALA N 1 1 15 9176 1 1 29 ALA O O 9.916 -3.406 4.424 1.00 . A A . 29 ALA O 1 1 15 9177 1 1 30 GLY C C 8.047 -5.864 3.215 1.00 . A A . 30 GLY C 1 1 15 9178 1 1 30 GLY CA C 8.667 -5.863 4.598 1.00 . A A . 30 GLY CA 1 1 15 9179 1 1 30 GLY H H 7.414 -4.697 5.830 1.00 . A A . 30 GLY H 1 1 15 9180 1 1 30 GLY HA2 H 8.320 -6.731 5.158 1.00 . A A . 30 GLY HA2 1 1 15 9181 1 1 30 GLY HA3 H 9.753 -5.897 4.510 1.00 . A A . 30 GLY HA3 1 1 15 9182 1 1 30 GLY N N 8.266 -4.655 5.284 1.00 . A A . 30 GLY N 1 1 15 9183 1 1 30 GLY O O 7.147 -6.669 2.962 1.00 . A A . 30 GLY O 1 1 15 9184 1 1 31 TYR C C 8.996 -5.246 -0.149 1.00 . A A . 31 TYR C 1 1 15 9185 1 1 31 TYR CA C 7.973 -4.968 0.961 1.00 . A A . 31 TYR CA 1 1 15 9186 1 1 31 TYR CB C 7.394 -3.547 0.796 1.00 . A A . 31 TYR CB 1 1 15 9187 1 1 31 TYR CD1 C 9.687 -2.452 0.475 1.00 . A A . 31 TYR CD1 1 1 15 9188 1 1 31 TYR CD2 C 7.751 -1.524 -0.655 1.00 . A A . 31 TYR CD2 1 1 15 9189 1 1 31 TYR CE1 C 10.498 -1.493 -0.154 1.00 . A A . 31 TYR CE1 1 1 15 9190 1 1 31 TYR CE2 C 8.545 -0.565 -1.302 1.00 . A A . 31 TYR CE2 1 1 15 9191 1 1 31 TYR CG C 8.305 -2.472 0.216 1.00 . A A . 31 TYR CG 1 1 15 9192 1 1 31 TYR CZ C 9.937 -0.558 -1.051 1.00 . A A . 31 TYR CZ 1 1 15 9193 1 1 31 TYR H H 9.266 -4.367 2.563 1.00 . A A . 31 TYR H 1 1 15 9194 1 1 31 TYR HA H 7.167 -5.671 0.839 1.00 . A A . 31 TYR HA 1 1 15 9195 1 1 31 TYR HB2 H 6.567 -3.680 0.108 1.00 . A A . 31 TYR HB2 1 1 15 9196 1 1 31 TYR HB3 H 6.987 -3.143 1.730 1.00 . A A . 31 TYR HB3 1 1 15 9197 1 1 31 TYR HD1 H 10.127 -3.246 1.062 1.00 . A A . 31 TYR HD1 1 1 15 9198 1 1 31 TYR HD2 H 6.697 -1.575 -0.839 1.00 . A A . 31 TYR HD2 1 1 15 9199 1 1 31 TYR HE1 H 11.559 -1.485 0.030 1.00 . A A . 31 TYR HE1 1 1 15 9200 1 1 31 TYR HE2 H 8.068 0.150 -1.977 1.00 . A A . 31 TYR HE2 1 1 15 9201 1 1 31 TYR HH H 10.299 1.170 -1.802 1.00 . A A . 31 TYR HH 1 1 15 9202 1 1 31 TYR N N 8.511 -4.988 2.314 1.00 . A A . 31 TYR N 1 1 15 9203 1 1 31 TYR O O 8.804 -4.759 -1.264 1.00 . A A . 31 TYR O 1 1 15 9204 1 1 31 TYR OH O 10.749 0.327 -1.688 1.00 . A A . 31 TYR OH 1 1 15 9205 1 1 32 PRO C C 10.068 -7.149 -2.293 1.00 . A A . 32 PRO C 1 1 15 9206 1 1 32 PRO CA C 10.801 -6.528 -1.106 1.00 . A A . 32 PRO CA 1 1 15 9207 1 1 32 PRO CB C 11.853 -7.461 -0.502 1.00 . A A . 32 PRO CB 1 1 15 9208 1 1 32 PRO CD C 10.087 -7.141 1.086 1.00 . A A . 32 PRO CD 1 1 15 9209 1 1 32 PRO CG C 11.088 -8.188 0.604 1.00 . A A . 32 PRO CG 1 1 15 9210 1 1 32 PRO HA H 11.243 -5.564 -1.371 1.00 . A A . 32 PRO HA 1 1 15 9211 1 1 32 PRO HB2 H 12.262 -8.154 -1.237 1.00 . A A . 32 PRO HB2 1 1 15 9212 1 1 32 PRO HB3 H 12.650 -6.862 -0.060 1.00 . A A . 32 PRO HB3 1 1 15 9213 1 1 32 PRO HD2 H 9.162 -7.598 1.432 1.00 . A A . 32 PRO HD2 1 1 15 9214 1 1 32 PRO HD3 H 10.533 -6.541 1.880 1.00 . A A . 32 PRO HD3 1 1 15 9215 1 1 32 PRO HG2 H 10.566 -9.056 0.197 1.00 . A A . 32 PRO HG2 1 1 15 9216 1 1 32 PRO HG3 H 11.749 -8.485 1.409 1.00 . A A . 32 PRO HG3 1 1 15 9217 1 1 32 PRO N N 9.829 -6.291 -0.054 1.00 . A A . 32 PRO N 1 1 15 9218 1 1 32 PRO O O 10.225 -6.724 -3.434 1.00 . A A . 32 PRO O 1 1 15 9219 1 1 33 ALA C C 6.981 -7.809 -3.034 1.00 . A A . 33 ALA C 1 1 15 9220 1 1 33 ALA CA C 8.240 -8.669 -2.924 1.00 . A A . 33 ALA CA 1 1 15 9221 1 1 33 ALA CB C 7.857 -10.054 -2.404 1.00 . A A . 33 ALA CB 1 1 15 9222 1 1 33 ALA H H 9.091 -8.320 -1.005 1.00 . A A . 33 ALA H 1 1 15 9223 1 1 33 ALA HA H 8.696 -8.752 -3.911 1.00 . A A . 33 ALA HA 1 1 15 9224 1 1 33 ALA HB1 H 7.193 -10.542 -3.115 1.00 . A A . 33 ALA HB1 1 1 15 9225 1 1 33 ALA HB2 H 8.755 -10.654 -2.266 1.00 . A A . 33 ALA HB2 1 1 15 9226 1 1 33 ALA HB3 H 7.354 -9.952 -1.441 1.00 . A A . 33 ALA HB3 1 1 15 9227 1 1 33 ALA N N 9.189 -8.102 -1.988 1.00 . A A . 33 ALA N 1 1 15 9228 1 1 33 ALA O O 6.193 -7.995 -3.962 1.00 . A A . 33 ALA O 1 1 15 9229 1 1 34 GLY C C 5.161 -5.311 -3.114 1.00 . A A . 34 GLY C 1 1 15 9230 1 1 34 GLY CA C 5.453 -6.242 -1.961 1.00 . A A . 34 GLY CA 1 1 15 9231 1 1 34 GLY H H 7.473 -6.677 -1.429 1.00 . A A . 34 GLY H 1 1 15 9232 1 1 34 GLY HA2 H 5.372 -5.695 -1.026 1.00 . A A . 34 GLY HA2 1 1 15 9233 1 1 34 GLY HA3 H 4.671 -7.005 -1.981 1.00 . A A . 34 GLY HA3 1 1 15 9234 1 1 34 GLY N N 6.745 -6.894 -2.091 1.00 . A A . 34 GLY N 1 1 15 9235 1 1 34 GLY O O 3.990 -5.172 -3.428 1.00 . A A . 34 GLY O 1 1 15 9236 1 1 35 CYS C C 5.557 -4.816 -6.222 1.00 . A A . 35 CYS C 1 1 15 9237 1 1 35 CYS CA C 6.020 -3.993 -5.023 1.00 . A A . 35 CYS CA 1 1 15 9238 1 1 35 CYS CB C 7.374 -3.406 -5.368 1.00 . A A . 35 CYS CB 1 1 15 9239 1 1 35 CYS H H 7.099 -4.782 -3.402 1.00 . A A . 35 CYS H 1 1 15 9240 1 1 35 CYS HA H 5.315 -3.176 -4.873 1.00 . A A . 35 CYS HA 1 1 15 9241 1 1 35 CYS HB2 H 8.075 -4.232 -5.498 1.00 . A A . 35 CYS HB2 1 1 15 9242 1 1 35 CYS HB3 H 7.308 -2.902 -6.331 1.00 . A A . 35 CYS HB3 1 1 15 9243 1 1 35 CYS N N 6.168 -4.750 -3.786 1.00 . A A . 35 CYS N 1 1 15 9244 1 1 35 CYS O O 5.098 -4.223 -7.197 1.00 . A A . 35 CYS O 1 1 15 9245 1 1 35 CYS SG S 7.919 -2.190 -4.141 1.00 . A A . 35 CYS SG 1 1 15 9246 1 1 36 SER C C 3.729 -7.345 -7.125 1.00 . A A . 36 SER C 1 1 15 9247 1 1 36 SER CA C 5.216 -6.987 -7.275 1.00 . A A . 36 SER CA 1 1 15 9248 1 1 36 SER CB C 6.098 -8.232 -7.317 1.00 . A A . 36 SER CB 1 1 15 9249 1 1 36 SER H H 6.109 -6.656 -5.435 1.00 . A A . 36 SER H 1 1 15 9250 1 1 36 SER HA H 5.383 -6.425 -8.193 1.00 . A A . 36 SER HA 1 1 15 9251 1 1 36 SER HB2 H 5.934 -8.721 -8.264 1.00 . A A . 36 SER HB2 1 1 15 9252 1 1 36 SER HB3 H 7.133 -7.909 -7.268 1.00 . A A . 36 SER HB3 1 1 15 9253 1 1 36 SER HG H 5.956 -8.706 -5.409 1.00 . A A . 36 SER HG 1 1 15 9254 1 1 36 SER N N 5.681 -6.150 -6.191 1.00 . A A . 36 SER N 1 1 15 9255 1 1 36 SER O O 3.080 -7.773 -8.075 1.00 . A A . 36 SER O 1 1 15 9256 1 1 36 SER OG O 5.863 -9.160 -6.268 1.00 . A A . 36 SER OG 1 1 15 9257 1 1 37 ASN C C 0.851 -6.641 -6.015 1.00 . A A . 37 ASN C 1 1 15 9258 1 1 37 ASN CA C 1.873 -7.650 -5.498 1.00 . A A . 37 ASN CA 1 1 15 9259 1 1 37 ASN CB C 1.820 -7.735 -3.946 1.00 . A A . 37 ASN CB 1 1 15 9260 1 1 37 ASN CG C 1.714 -9.172 -3.474 1.00 . A A . 37 ASN CG 1 1 15 9261 1 1 37 ASN H H 3.831 -6.821 -5.219 1.00 . A A . 37 ASN H 1 1 15 9262 1 1 37 ASN HA H 1.669 -8.630 -5.933 1.00 . A A . 37 ASN HA 1 1 15 9263 1 1 37 ASN HB2 H 2.699 -7.275 -3.492 1.00 . A A . 37 ASN HB2 1 1 15 9264 1 1 37 ASN HB3 H 0.977 -7.177 -3.549 1.00 . A A . 37 ASN HB3 1 1 15 9265 1 1 37 ASN HD21 H -0.023 -8.880 -2.386 1.00 . A A . 37 ASN HD21 1 1 15 9266 1 1 37 ASN HD22 H 0.435 -10.522 -2.717 1.00 . A A . 37 ASN HD22 1 1 15 9267 1 1 37 ASN N N 3.200 -7.203 -5.908 1.00 . A A . 37 ASN N 1 1 15 9268 1 1 37 ASN ND2 N 0.686 -9.532 -2.722 1.00 . A A . 37 ASN ND2 1 1 15 9269 1 1 37 ASN O O 0.776 -5.564 -5.430 1.00 . A A . 37 ASN O 1 1 15 9270 1 1 37 ASN OD1 O 2.598 -9.978 -3.742 1.00 . A A . 37 ASN OD1 1 1 15 9271 1 1 38 SER C C -1.845 -5.365 -6.628 1.00 . A A . 38 SER C 1 1 15 9272 1 1 38 SER CA C -0.842 -5.932 -7.651 1.00 . A A . 38 SER CA 1 1 15 9273 1 1 38 SER CB C -1.564 -6.481 -8.883 1.00 . A A . 38 SER CB 1 1 15 9274 1 1 38 SER H H 0.096 -7.850 -7.490 1.00 . A A . 38 SER H 1 1 15 9275 1 1 38 SER HA H -0.216 -5.125 -8.029 1.00 . A A . 38 SER HA 1 1 15 9276 1 1 38 SER HB2 H -0.836 -6.939 -9.547 1.00 . A A . 38 SER HB2 1 1 15 9277 1 1 38 SER HB3 H -2.293 -7.233 -8.583 1.00 . A A . 38 SER HB3 1 1 15 9278 1 1 38 SER HG H -2.882 -5.063 -9.028 1.00 . A A . 38 SER HG 1 1 15 9279 1 1 38 SER N N 0.059 -6.931 -7.057 1.00 . A A . 38 SER N 1 1 15 9280 1 1 38 SER O O -2.315 -4.240 -6.795 1.00 . A A . 38 SER O 1 1 15 9281 1 1 38 SER OG O -2.196 -5.432 -9.601 1.00 . A A . 38 SER OG 1 1 15 9282 1 1 39 ASP C C -2.362 -4.317 -3.802 1.00 . A A . 39 ASP C 1 1 15 9283 1 1 39 ASP CA C -2.926 -5.610 -4.408 1.00 . A A . 39 ASP CA 1 1 15 9284 1 1 39 ASP CB C -3.005 -6.716 -3.349 1.00 . A A . 39 ASP CB 1 1 15 9285 1 1 39 ASP CG C -3.821 -6.343 -2.101 1.00 . A A . 39 ASP CG 1 1 15 9286 1 1 39 ASP H H -1.735 -7.018 -5.487 1.00 . A A . 39 ASP H 1 1 15 9287 1 1 39 ASP HA H -3.927 -5.413 -4.771 1.00 . A A . 39 ASP HA 1 1 15 9288 1 1 39 ASP HB2 H -3.455 -7.600 -3.804 1.00 . A A . 39 ASP HB2 1 1 15 9289 1 1 39 ASP HB3 H -1.988 -6.978 -3.049 1.00 . A A . 39 ASP HB3 1 1 15 9290 1 1 39 ASP N N -2.125 -6.090 -5.538 1.00 . A A . 39 ASP N 1 1 15 9291 1 1 39 ASP O O -3.110 -3.438 -3.387 1.00 . A A . 39 ASP O 1 1 15 9292 1 1 39 ASP OD1 O -4.968 -5.860 -2.242 1.00 . A A . 39 ASP OD1 1 1 15 9293 1 1 39 ASP OD2 O -3.385 -6.711 -0.981 1.00 . A A . 39 ASP OD2 1 1 15 9294 1 1 40 CYS C C 0.430 -2.222 -4.340 1.00 . A A . 40 CYS C 1 1 15 9295 1 1 40 CYS CA C -0.265 -3.068 -3.269 1.00 . A A . 40 CYS CA 1 1 15 9296 1 1 40 CYS CB C 0.736 -3.670 -2.262 1.00 . A A . 40 CYS CB 1 1 15 9297 1 1 40 CYS H H -0.510 -4.839 -4.371 1.00 . A A . 40 CYS H 1 1 15 9298 1 1 40 CYS HA H -0.932 -2.394 -2.728 1.00 . A A . 40 CYS HA 1 1 15 9299 1 1 40 CYS HB2 H 1.198 -4.573 -2.678 1.00 . A A . 40 CYS HB2 1 1 15 9300 1 1 40 CYS HB3 H 1.545 -2.961 -2.044 1.00 . A A . 40 CYS HB3 1 1 15 9301 1 1 40 CYS N N -1.040 -4.160 -3.842 1.00 . A A . 40 CYS N 1 1 15 9302 1 1 40 CYS O O 1.105 -1.265 -3.985 1.00 . A A . 40 CYS O 1 1 15 9303 1 1 40 CYS SG S -0.112 -4.056 -0.710 1.00 . A A . 40 CYS SG 1 1 15 9304 1 1 41 THR C C 0.701 -0.495 -6.908 1.00 . A A . 41 THR C 1 1 15 9305 1 1 41 THR CA C 1.096 -1.939 -6.682 1.00 . A A . 41 THR CA 1 1 15 9306 1 1 41 THR CB C 0.958 -2.820 -7.927 1.00 . A A . 41 THR CB 1 1 15 9307 1 1 41 THR CG2 C 1.273 -2.201 -9.280 1.00 . A A . 41 THR CG2 1 1 15 9308 1 1 41 THR H H -0.319 -3.301 -5.885 1.00 . A A . 41 THR H 1 1 15 9309 1 1 41 THR HA H 2.137 -1.927 -6.357 1.00 . A A . 41 THR HA 1 1 15 9310 1 1 41 THR HB H -0.076 -3.154 -7.980 1.00 . A A . 41 THR HB 1 1 15 9311 1 1 41 THR HG1 H 2.164 -3.961 -6.888 1.00 . A A . 41 THR HG1 1 1 15 9312 1 1 41 THR HG21 H 2.297 -1.828 -9.303 1.00 . A A . 41 THR HG21 1 1 15 9313 1 1 41 THR HG22 H 1.146 -2.984 -10.026 1.00 . A A . 41 THR HG22 1 1 15 9314 1 1 41 THR HG23 H 0.574 -1.395 -9.499 1.00 . A A . 41 THR HG23 1 1 15 9315 1 1 41 THR N N 0.297 -2.546 -5.625 1.00 . A A . 41 THR N 1 1 15 9316 1 1 41 THR O O 1.585 0.349 -6.925 1.00 . A A . 41 THR O 1 1 15 9317 1 1 41 THR OG1 O 1.845 -3.915 -7.808 1.00 . A A . 41 THR OG1 1 1 15 9318 1 1 42 ALA C C -0.591 2.109 -6.142 1.00 . A A . 42 ALA C 1 1 15 9319 1 1 42 ALA CA C -0.934 1.219 -7.338 1.00 . A A . 42 ALA CA 1 1 15 9320 1 1 42 ALA CB C -2.402 1.341 -7.713 1.00 . A A . 42 ALA CB 1 1 15 9321 1 1 42 ALA H H -1.311 -0.853 -6.864 1.00 . A A . 42 ALA H 1 1 15 9322 1 1 42 ALA HA H -0.341 1.557 -8.189 1.00 . A A . 42 ALA HA 1 1 15 9323 1 1 42 ALA HB1 H -2.611 0.701 -8.569 1.00 . A A . 42 ALA HB1 1 1 15 9324 1 1 42 ALA HB2 H -3.028 1.056 -6.868 1.00 . A A . 42 ALA HB2 1 1 15 9325 1 1 42 ALA HB3 H -2.594 2.379 -7.984 1.00 . A A . 42 ALA HB3 1 1 15 9326 1 1 42 ALA N N -0.584 -0.169 -7.059 1.00 . A A . 42 ALA N 1 1 15 9327 1 1 42 ALA O O -0.203 3.262 -6.331 1.00 . A A . 42 ALA O 1 1 15 9328 1 1 43 PHE C C 1.367 2.384 -3.921 1.00 . A A . 43 PHE C 1 1 15 9329 1 1 43 PHE CA C -0.142 2.173 -3.728 1.00 . A A . 43 PHE CA 1 1 15 9330 1 1 43 PHE CB C -0.537 1.339 -2.492 1.00 . A A . 43 PHE CB 1 1 15 9331 1 1 43 PHE CD1 C 1.217 1.642 -0.729 1.00 . A A . 43 PHE CD1 1 1 15 9332 1 1 43 PHE CD2 C -0.965 2.610 -0.315 1.00 . A A . 43 PHE CD2 1 1 15 9333 1 1 43 PHE CE1 C 1.688 2.151 0.486 1.00 . A A . 43 PHE CE1 1 1 15 9334 1 1 43 PHE CE2 C -0.511 3.085 0.929 1.00 . A A . 43 PHE CE2 1 1 15 9335 1 1 43 PHE CG C -0.092 1.896 -1.156 1.00 . A A . 43 PHE CG 1 1 15 9336 1 1 43 PHE CZ C 0.824 2.873 1.318 1.00 . A A . 43 PHE CZ 1 1 15 9337 1 1 43 PHE H H -0.995 0.601 -4.874 1.00 . A A . 43 PHE H 1 1 15 9338 1 1 43 PHE HA H -0.593 3.161 -3.630 1.00 . A A . 43 PHE HA 1 1 15 9339 1 1 43 PHE HB2 H -1.620 1.218 -2.475 1.00 . A A . 43 PHE HB2 1 1 15 9340 1 1 43 PHE HB3 H -0.116 0.341 -2.574 1.00 . A A . 43 PHE HB3 1 1 15 9341 1 1 43 PHE HD1 H 1.860 1.063 -1.356 1.00 . A A . 43 PHE HD1 1 1 15 9342 1 1 43 PHE HD2 H -1.985 2.790 -0.616 1.00 . A A . 43 PHE HD2 1 1 15 9343 1 1 43 PHE HE1 H 2.716 1.997 0.771 1.00 . A A . 43 PHE HE1 1 1 15 9344 1 1 43 PHE HE2 H -1.180 3.634 1.575 1.00 . A A . 43 PHE HE2 1 1 15 9345 1 1 43 PHE HZ H 1.204 3.256 2.251 1.00 . A A . 43 PHE HZ 1 1 15 9346 1 1 43 PHE N N -0.678 1.558 -4.927 1.00 . A A . 43 PHE N 1 1 15 9347 1 1 43 PHE O O 1.800 3.519 -4.080 1.00 . A A . 43 PHE O 1 1 15 9348 1 1 44 LEU C C 4.231 2.232 -5.133 1.00 . A A . 44 LEU C 1 1 15 9349 1 1 44 LEU CA C 3.651 1.491 -3.922 1.00 . A A . 44 LEU CA 1 1 15 9350 1 1 44 LEU CB C 4.338 0.132 -3.714 1.00 . A A . 44 LEU CB 1 1 15 9351 1 1 44 LEU CD1 C 4.461 -1.995 -2.420 1.00 . A A . 44 LEU CD1 1 1 15 9352 1 1 44 LEU CD2 C 4.285 0.190 -1.151 1.00 . A A . 44 LEU CD2 1 1 15 9353 1 1 44 LEU CG C 3.898 -0.576 -2.418 1.00 . A A . 44 LEU CG 1 1 15 9354 1 1 44 LEU H H 1.829 0.404 -3.743 1.00 . A A . 44 LEU H 1 1 15 9355 1 1 44 LEU HA H 3.876 2.125 -3.069 1.00 . A A . 44 LEU HA 1 1 15 9356 1 1 44 LEU HB2 H 4.166 -0.542 -4.555 1.00 . A A . 44 LEU HB2 1 1 15 9357 1 1 44 LEU HB3 H 5.404 0.315 -3.702 1.00 . A A . 44 LEU HB3 1 1 15 9358 1 1 44 LEU HD11 H 5.518 -1.978 -2.669 1.00 . A A . 44 LEU HD11 1 1 15 9359 1 1 44 LEU HD12 H 4.332 -2.471 -1.453 1.00 . A A . 44 LEU HD12 1 1 15 9360 1 1 44 LEU HD13 H 3.926 -2.569 -3.174 1.00 . A A . 44 LEU HD13 1 1 15 9361 1 1 44 LEU HD21 H 4.056 1.251 -1.208 1.00 . A A . 44 LEU HD21 1 1 15 9362 1 1 44 LEU HD22 H 3.711 -0.194 -0.309 1.00 . A A . 44 LEU HD22 1 1 15 9363 1 1 44 LEU HD23 H 5.342 0.057 -0.971 1.00 . A A . 44 LEU HD23 1 1 15 9364 1 1 44 LEU HG H 2.819 -0.671 -2.395 1.00 . A A . 44 LEU HG 1 1 15 9365 1 1 44 LEU N N 2.196 1.336 -3.933 1.00 . A A . 44 LEU N 1 1 15 9366 1 1 44 LEU O O 5.214 2.957 -4.971 1.00 . A A . 44 LEU O 1 1 15 9367 1 1 45 SER C C 3.870 4.417 -7.160 1.00 . A A . 45 SER C 1 1 15 9368 1 1 45 SER CA C 3.878 2.922 -7.500 1.00 . A A . 45 SER CA 1 1 15 9369 1 1 45 SER CB C 2.794 2.620 -8.552 1.00 . A A . 45 SER CB 1 1 15 9370 1 1 45 SER H H 2.884 1.420 -6.338 1.00 . A A . 45 SER H 1 1 15 9371 1 1 45 SER HA H 4.862 2.646 -7.882 1.00 . A A . 45 SER HA 1 1 15 9372 1 1 45 SER HB2 H 2.659 1.548 -8.678 1.00 . A A . 45 SER HB2 1 1 15 9373 1 1 45 SER HB3 H 1.840 3.031 -8.219 1.00 . A A . 45 SER HB3 1 1 15 9374 1 1 45 SER HG H 2.487 2.818 -10.464 1.00 . A A . 45 SER HG 1 1 15 9375 1 1 45 SER N N 3.611 2.125 -6.302 1.00 . A A . 45 SER N 1 1 15 9376 1 1 45 SER O O 4.760 5.174 -7.554 1.00 . A A . 45 SER O 1 1 15 9377 1 1 45 SER OG O 3.117 3.179 -9.808 1.00 . A A . 45 SER OG 1 1 15 9378 1 1 46 GLN C C 3.770 6.366 -4.762 1.00 . A A . 46 GLN C 1 1 15 9379 1 1 46 GLN CA C 2.749 6.201 -5.896 1.00 . A A . 46 GLN CA 1 1 15 9380 1 1 46 GLN CB C 1.254 6.446 -5.571 1.00 . A A . 46 GLN CB 1 1 15 9381 1 1 46 GLN CD C -0.956 6.802 -6.857 1.00 . A A . 46 GLN CD 1 1 15 9382 1 1 46 GLN CG C 0.564 6.774 -6.908 1.00 . A A . 46 GLN CG 1 1 15 9383 1 1 46 GLN H H 2.199 4.166 -6.062 1.00 . A A . 46 GLN H 1 1 15 9384 1 1 46 GLN HA H 3.042 6.904 -6.676 1.00 . A A . 46 GLN HA 1 1 15 9385 1 1 46 GLN HB2 H 0.803 5.559 -5.129 1.00 . A A . 46 GLN HB2 1 1 15 9386 1 1 46 GLN HB3 H 1.092 7.267 -4.877 1.00 . A A . 46 GLN HB3 1 1 15 9387 1 1 46 GLN HE21 H -1.058 4.808 -6.542 1.00 . A A . 46 GLN HE21 1 1 15 9388 1 1 46 GLN HE22 H -2.600 5.617 -6.718 1.00 . A A . 46 GLN HE22 1 1 15 9389 1 1 46 GLN HG2 H 0.920 7.748 -7.249 1.00 . A A . 46 GLN HG2 1 1 15 9390 1 1 46 GLN HG3 H 0.847 6.034 -7.658 1.00 . A A . 46 GLN HG3 1 1 15 9391 1 1 46 GLN N N 2.864 4.850 -6.409 1.00 . A A . 46 GLN N 1 1 15 9392 1 1 46 GLN NE2 N -1.597 5.665 -6.685 1.00 . A A . 46 GLN NE2 1 1 15 9393 1 1 46 GLN O O 4.779 7.060 -4.930 1.00 . A A . 46 GLN O 1 1 15 9394 1 1 46 GLN OE1 O -1.576 7.835 -7.108 1.00 . A A . 46 GLN OE1 1 1 15 9395 1 1 47 CYS C C 5.758 5.824 -2.443 1.00 . A A . 47 CYS C 1 1 15 9396 1 1 47 CYS CA C 4.240 6.002 -2.377 1.00 . A A . 47 CYS CA 1 1 15 9397 1 1 47 CYS CB C 3.640 5.194 -1.216 1.00 . A A . 47 CYS CB 1 1 15 9398 1 1 47 CYS H H 2.758 5.075 -3.597 1.00 . A A . 47 CYS H 1 1 15 9399 1 1 47 CYS HA H 4.043 7.057 -2.174 1.00 . A A . 47 CYS HA 1 1 15 9400 1 1 47 CYS HB2 H 4.169 4.238 -1.098 1.00 . A A . 47 CYS HB2 1 1 15 9401 1 1 47 CYS HB3 H 3.796 5.774 -0.306 1.00 . A A . 47 CYS HB3 1 1 15 9402 1 1 47 CYS N N 3.572 5.682 -3.636 1.00 . A A . 47 CYS N 1 1 15 9403 1 1 47 CYS O O 6.481 6.638 -1.874 1.00 . A A . 47 CYS O 1 1 15 9404 1 1 47 CYS SG S 1.861 4.874 -1.356 1.00 . A A . 47 CYS SG 1 1 15 9405 1 1 48 TYR C C 8.103 5.182 -4.731 1.00 . A A . 48 TYR C 1 1 15 9406 1 1 48 TYR CA C 7.691 4.616 -3.380 1.00 . A A . 48 TYR CA 1 1 15 9407 1 1 48 TYR CB C 8.112 3.162 -3.275 1.00 . A A . 48 TYR CB 1 1 15 9408 1 1 48 TYR CD1 C 9.403 2.966 -1.105 1.00 . A A . 48 TYR CD1 1 1 15 9409 1 1 48 TYR CD2 C 7.083 2.235 -1.197 1.00 . A A . 48 TYR CD2 1 1 15 9410 1 1 48 TYR CE1 C 9.492 2.529 0.227 1.00 . A A . 48 TYR CE1 1 1 15 9411 1 1 48 TYR CE2 C 7.197 1.736 0.104 1.00 . A A . 48 TYR CE2 1 1 15 9412 1 1 48 TYR CG C 8.210 2.771 -1.827 1.00 . A A . 48 TYR CG 1 1 15 9413 1 1 48 TYR CZ C 8.402 1.864 0.825 1.00 . A A . 48 TYR CZ 1 1 15 9414 1 1 48 TYR H H 5.613 4.204 -3.642 1.00 . A A . 48 TYR H 1 1 15 9415 1 1 48 TYR HA H 8.270 5.076 -2.585 1.00 . A A . 48 TYR HA 1 1 15 9416 1 1 48 TYR HB2 H 7.420 2.508 -3.803 1.00 . A A . 48 TYR HB2 1 1 15 9417 1 1 48 TYR HB3 H 9.095 3.038 -3.732 1.00 . A A . 48 TYR HB3 1 1 15 9418 1 1 48 TYR HD1 H 10.260 3.441 -1.562 1.00 . A A . 48 TYR HD1 1 1 15 9419 1 1 48 TYR HD2 H 6.162 2.130 -1.750 1.00 . A A . 48 TYR HD2 1 1 15 9420 1 1 48 TYR HE1 H 10.411 2.662 0.780 1.00 . A A . 48 TYR HE1 1 1 15 9421 1 1 48 TYR HE2 H 6.368 1.199 0.506 1.00 . A A . 48 TYR HE2 1 1 15 9422 1 1 48 TYR HH H 8.429 0.396 2.113 1.00 . A A . 48 TYR HH 1 1 15 9423 1 1 48 TYR N N 6.260 4.799 -3.136 1.00 . A A . 48 TYR N 1 1 15 9424 1 1 48 TYR O O 9.159 5.802 -4.828 1.00 . A A . 48 TYR O 1 1 15 9425 1 1 48 TYR OH O 8.508 1.363 2.083 1.00 . A A . 48 TYR OH 1 1 15 9426 1 1 49 GLY C C 7.661 3.518 -7.736 1.00 . A A . 49 GLY C 1 1 15 9427 1 1 49 GLY CA C 7.749 4.935 -7.157 1.00 . A A . 49 GLY CA 1 1 15 9428 1 1 49 GLY H H 6.396 4.519 -5.611 1.00 . A A . 49 GLY H 1 1 15 9429 1 1 49 GLY HA2 H 8.785 5.267 -7.219 1.00 . A A . 49 GLY HA2 1 1 15 9430 1 1 49 GLY HA3 H 7.145 5.612 -7.759 1.00 . A A . 49 GLY HA3 1 1 15 9431 1 1 49 GLY N N 7.297 4.956 -5.769 1.00 . A A . 49 GLY N 1 1 15 9432 1 1 49 GLY O O 7.721 3.352 -8.954 1.00 . A A . 49 GLY O 1 1 15 9433 1 1 50 GLY C C 9.059 0.628 -7.071 1.00 . A A . 50 GLY C 1 1 15 9434 1 1 50 GLY CA C 7.602 1.087 -7.191 1.00 . A A . 50 GLY CA 1 1 15 9435 1 1 50 GLY H H 7.277 2.736 -5.926 1.00 . A A . 50 GLY H 1 1 15 9436 1 1 50 GLY HA2 H 7.247 0.894 -8.204 1.00 . A A . 50 GLY HA2 1 1 15 9437 1 1 50 GLY HA3 H 6.982 0.518 -6.502 1.00 . A A . 50 GLY HA3 1 1 15 9438 1 1 50 GLY N N 7.474 2.504 -6.884 1.00 . A A . 50 GLY N 1 1 15 9439 1 1 50 GLY O O 9.963 1.278 -7.601 1.00 . A A . 50 GLY O 1 1 15 9440 1 1 51 CYS C C 10.879 -1.611 -7.811 1.00 . A A . 51 CYS C 1 1 15 9441 1 1 51 CYS CA C 10.572 -1.194 -6.381 1.00 . A A . 51 CYS CA 1 1 15 9442 1 1 51 CYS CB C 10.570 -2.491 -5.562 1.00 . A A . 51 CYS CB 1 1 15 9443 1 1 51 CYS H H 8.537 -0.917 -5.859 1.00 . A A . 51 CYS H 1 1 15 9444 1 1 51 CYS HA H 11.356 -0.537 -6.008 1.00 . A A . 51 CYS HA 1 1 15 9445 1 1 51 CYS HB2 H 10.046 -3.244 -6.148 1.00 . A A . 51 CYS HB2 1 1 15 9446 1 1 51 CYS HB3 H 11.606 -2.828 -5.519 1.00 . A A . 51 CYS HB3 1 1 15 9447 1 1 51 CYS N N 9.299 -0.475 -6.350 1.00 . A A . 51 CYS N 1 1 15 9448 1 1 51 CYS O O 12.039 -1.446 -8.236 1.00 . A A . 51 CYS O 1 1 15 9449 1 1 51 CYS OXT O 9.976 -2.194 -8.457 1.00 . A A . 51 CYS OXT 1 1 15 9450 1 1 51 CYS SG S 9.895 -2.550 -3.888 1.00 . A A . 51 CYS SG 1 1 16 9451 1 1 1 GLY C C -7.361 -6.234 -0.846 1.00 . A A . 1 GLY C 1 1 16 9452 1 1 1 GLY CA C -7.094 -7.431 -1.733 1.00 . A A . 1 GLY CA 1 1 16 9453 1 1 1 GLY H1 H -8.165 -6.668 -3.290 1.00 . A A . 1 GLY H1 1 1 16 9454 1 1 1 GLY H2 H -6.563 -6.324 -3.359 1.00 . A A . 1 GLY H2 1 1 16 9455 1 1 1 GLY H3 H -7.093 -7.833 -3.743 1.00 . A A . 1 GLY H3 1 1 16 9456 1 1 1 GLY HA2 H -6.082 -7.793 -1.564 1.00 . A A . 1 GLY HA2 1 1 16 9457 1 1 1 GLY HA3 H -7.809 -8.214 -1.499 1.00 . A A . 1 GLY HA3 1 1 16 9458 1 1 1 GLY N N -7.243 -7.044 -3.136 1.00 . A A . 1 GLY N 1 1 16 9459 1 1 1 GLY O O -8.286 -5.468 -1.120 1.00 . A A . 1 GLY O 1 1 16 9460 1 1 2 GLU C C -6.488 -3.653 0.636 1.00 . A A . 2 GLU C 1 1 16 9461 1 1 2 GLU CA C -6.761 -5.039 1.218 1.00 . A A . 2 GLU CA 1 1 16 9462 1 1 2 GLU CB C -5.914 -5.358 2.463 1.00 . A A . 2 GLU CB 1 1 16 9463 1 1 2 GLU CD C -3.534 -6.178 3.094 1.00 . A A . 2 GLU CD 1 1 16 9464 1 1 2 GLU CG C -4.404 -5.289 2.193 1.00 . A A . 2 GLU CG 1 1 16 9465 1 1 2 GLU H H -5.757 -6.664 0.317 1.00 . A A . 2 GLU H 1 1 16 9466 1 1 2 GLU HA H -7.796 -5.049 1.523 1.00 . A A . 2 GLU HA 1 1 16 9467 1 1 2 GLU HB2 H -6.169 -4.671 3.270 1.00 . A A . 2 GLU HB2 1 1 16 9468 1 1 2 GLU HB3 H -6.174 -6.369 2.773 1.00 . A A . 2 GLU HB3 1 1 16 9469 1 1 2 GLU HG2 H -4.277 -5.616 1.169 1.00 . A A . 2 GLU HG2 1 1 16 9470 1 1 2 GLU HG3 H -4.067 -4.255 2.258 1.00 . A A . 2 GLU HG3 1 1 16 9471 1 1 2 GLU N N -6.583 -6.085 0.222 1.00 . A A . 2 GLU N 1 1 16 9472 1 1 2 GLU O O -7.283 -2.733 0.843 1.00 . A A . 2 GLU O 1 1 16 9473 1 1 2 GLU OE1 O -3.999 -6.631 4.163 1.00 . A A . 2 GLU OE1 1 1 16 9474 1 1 2 GLU OE2 O -2.387 -6.496 2.693 1.00 . A A . 2 GLU OE2 1 1 16 9475 1 1 3 CYS C C -5.771 -1.671 -1.704 1.00 . A A . 3 CYS C 1 1 16 9476 1 1 3 CYS CA C -4.983 -2.149 -0.488 1.00 . A A . 3 CYS CA 1 1 16 9477 1 1 3 CYS CB C -3.489 -2.058 -0.719 1.00 . A A . 3 CYS CB 1 1 16 9478 1 1 3 CYS H H -4.823 -4.283 -0.368 1.00 . A A . 3 CYS H 1 1 16 9479 1 1 3 CYS HA H -5.192 -1.491 0.356 1.00 . A A . 3 CYS HA 1 1 16 9480 1 1 3 CYS HB2 H -2.972 -2.625 0.055 1.00 . A A . 3 CYS HB2 1 1 16 9481 1 1 3 CYS HB3 H -3.238 -2.469 -1.686 1.00 . A A . 3 CYS HB3 1 1 16 9482 1 1 3 CYS N N -5.387 -3.484 -0.099 1.00 . A A . 3 CYS N 1 1 16 9483 1 1 3 CYS O O -6.109 -0.491 -1.784 1.00 . A A . 3 CYS O 1 1 16 9484 1 1 3 CYS SG S -2.968 -0.337 -0.634 1.00 . A A . 3 CYS SG 1 1 16 9485 1 1 4 GLU C C -8.390 -1.734 -3.094 1.00 . A A . 4 GLU C 1 1 16 9486 1 1 4 GLU CA C -7.083 -2.272 -3.682 1.00 . A A . 4 GLU CA 1 1 16 9487 1 1 4 GLU CB C -7.343 -3.517 -4.548 1.00 . A A . 4 GLU CB 1 1 16 9488 1 1 4 GLU CD C -6.224 -5.115 -6.225 1.00 . A A . 4 GLU CD 1 1 16 9489 1 1 4 GLU CG C -6.218 -3.729 -5.572 1.00 . A A . 4 GLU CG 1 1 16 9490 1 1 4 GLU H H -5.764 -3.527 -2.540 1.00 . A A . 4 GLU H 1 1 16 9491 1 1 4 GLU HA H -6.649 -1.488 -4.307 1.00 . A A . 4 GLU HA 1 1 16 9492 1 1 4 GLU HB2 H -7.443 -4.384 -3.895 1.00 . A A . 4 GLU HB2 1 1 16 9493 1 1 4 GLU HB3 H -8.277 -3.393 -5.097 1.00 . A A . 4 GLU HB3 1 1 16 9494 1 1 4 GLU HG2 H -6.316 -2.970 -6.348 1.00 . A A . 4 GLU HG2 1 1 16 9495 1 1 4 GLU HG3 H -5.258 -3.585 -5.089 1.00 . A A . 4 GLU HG3 1 1 16 9496 1 1 4 GLU N N -6.148 -2.585 -2.607 1.00 . A A . 4 GLU N 1 1 16 9497 1 1 4 GLU O O -8.956 -0.796 -3.649 1.00 . A A . 4 GLU O 1 1 16 9498 1 1 4 GLU OE1 O -6.510 -6.134 -5.555 1.00 . A A . 4 GLU OE1 1 1 16 9499 1 1 4 GLU OE2 O -5.897 -5.229 -7.426 1.00 . A A . 4 GLU OE2 1 1 16 9500 1 1 5 GLN C C -9.850 -0.393 -0.786 1.00 . A A . 5 GLN C 1 1 16 9501 1 1 5 GLN CA C -10.064 -1.818 -1.293 1.00 . A A . 5 GLN CA 1 1 16 9502 1 1 5 GLN CB C -10.417 -2.767 -0.134 1.00 . A A . 5 GLN CB 1 1 16 9503 1 1 5 GLN CD C -12.383 -1.696 1.068 1.00 . A A . 5 GLN CD 1 1 16 9504 1 1 5 GLN CG C -11.919 -2.840 0.172 1.00 . A A . 5 GLN CG 1 1 16 9505 1 1 5 GLN H H -8.271 -2.964 -1.489 1.00 . A A . 5 GLN H 1 1 16 9506 1 1 5 GLN HA H -10.874 -1.805 -2.025 1.00 . A A . 5 GLN HA 1 1 16 9507 1 1 5 GLN HB2 H -10.066 -3.769 -0.359 1.00 . A A . 5 GLN HB2 1 1 16 9508 1 1 5 GLN HB3 H -9.888 -2.454 0.762 1.00 . A A . 5 GLN HB3 1 1 16 9509 1 1 5 GLN HE21 H -13.167 -0.641 -0.488 1.00 . A A . 5 GLN HE21 1 1 16 9510 1 1 5 GLN HE22 H -13.236 0.134 1.076 1.00 . A A . 5 GLN HE22 1 1 16 9511 1 1 5 GLN HG2 H -12.494 -2.863 -0.753 1.00 . A A . 5 GLN HG2 1 1 16 9512 1 1 5 GLN HG3 H -12.112 -3.775 0.701 1.00 . A A . 5 GLN HG3 1 1 16 9513 1 1 5 GLN N N -8.857 -2.289 -1.967 1.00 . A A . 5 GLN N 1 1 16 9514 1 1 5 GLN NE2 N -13.030 -0.682 0.523 1.00 . A A . 5 GLN NE2 1 1 16 9515 1 1 5 GLN O O -10.689 0.474 -1.019 1.00 . A A . 5 GLN O 1 1 16 9516 1 1 5 GLN OE1 O -12.179 -1.735 2.280 1.00 . A A . 5 GLN OE1 1 1 16 9517 1 1 6 CYS C C -8.357 2.224 -0.641 1.00 . A A . 6 CYS C 1 1 16 9518 1 1 6 CYS CA C -8.438 1.159 0.457 1.00 . A A . 6 CYS CA 1 1 16 9519 1 1 6 CYS CB C -7.162 1.104 1.298 1.00 . A A . 6 CYS CB 1 1 16 9520 1 1 6 CYS H H -8.104 -0.932 0.073 1.00 . A A . 6 CYS H 1 1 16 9521 1 1 6 CYS HA H -9.267 1.418 1.115 1.00 . A A . 6 CYS HA 1 1 16 9522 1 1 6 CYS HB2 H -7.086 0.120 1.754 1.00 . A A . 6 CYS HB2 1 1 16 9523 1 1 6 CYS HB3 H -6.288 1.242 0.658 1.00 . A A . 6 CYS HB3 1 1 16 9524 1 1 6 CYS N N -8.731 -0.153 -0.101 1.00 . A A . 6 CYS N 1 1 16 9525 1 1 6 CYS O O -8.916 3.309 -0.487 1.00 . A A . 6 CYS O 1 1 16 9526 1 1 6 CYS SG S -7.175 2.343 2.618 1.00 . A A . 6 CYS SG 1 1 16 9527 1 1 7 PHE C C -9.121 3.106 -3.448 1.00 . A A . 7 PHE C 1 1 16 9528 1 1 7 PHE CA C -7.718 2.792 -2.936 1.00 . A A . 7 PHE CA 1 1 16 9529 1 1 7 PHE CB C -6.857 2.210 -4.063 1.00 . A A . 7 PHE CB 1 1 16 9530 1 1 7 PHE CD1 C -4.463 2.755 -3.483 1.00 . A A . 7 PHE CD1 1 1 16 9531 1 1 7 PHE CD2 C -5.611 4.130 -5.139 1.00 . A A . 7 PHE CD2 1 1 16 9532 1 1 7 PHE CE1 C -3.350 3.609 -3.574 1.00 . A A . 7 PHE CE1 1 1 16 9533 1 1 7 PHE CE2 C -4.472 4.945 -5.258 1.00 . A A . 7 PHE CE2 1 1 16 9534 1 1 7 PHE CG C -5.601 3.024 -4.266 1.00 . A A . 7 PHE CG 1 1 16 9535 1 1 7 PHE CZ C -3.338 4.691 -4.469 1.00 . A A . 7 PHE CZ 1 1 16 9536 1 1 7 PHE H H -7.283 0.998 -1.847 1.00 . A A . 7 PHE H 1 1 16 9537 1 1 7 PHE HA H -7.281 3.740 -2.613 1.00 . A A . 7 PHE HA 1 1 16 9538 1 1 7 PHE HB2 H -6.600 1.172 -3.850 1.00 . A A . 7 PHE HB2 1 1 16 9539 1 1 7 PHE HB3 H -7.425 2.209 -4.996 1.00 . A A . 7 PHE HB3 1 1 16 9540 1 1 7 PHE HD1 H -4.476 1.954 -2.748 1.00 . A A . 7 PHE HD1 1 1 16 9541 1 1 7 PHE HD2 H -6.503 4.403 -5.686 1.00 . A A . 7 PHE HD2 1 1 16 9542 1 1 7 PHE HE1 H -2.514 3.493 -2.906 1.00 . A A . 7 PHE HE1 1 1 16 9543 1 1 7 PHE HE2 H -4.503 5.811 -5.902 1.00 . A A . 7 PHE HE2 1 1 16 9544 1 1 7 PHE HZ H -2.478 5.356 -4.494 1.00 . A A . 7 PHE HZ 1 1 16 9545 1 1 7 PHE N N -7.742 1.901 -1.783 1.00 . A A . 7 PHE N 1 1 16 9546 1 1 7 PHE O O -9.373 4.253 -3.826 1.00 . A A . 7 PHE O 1 1 16 9547 1 1 8 SER C C -12.086 3.376 -2.921 1.00 . A A . 8 SER C 1 1 16 9548 1 1 8 SER CA C -11.413 2.359 -3.850 1.00 . A A . 8 SER CA 1 1 16 9549 1 1 8 SER CB C -12.182 1.035 -3.924 1.00 . A A . 8 SER CB 1 1 16 9550 1 1 8 SER H H -9.787 1.196 -3.146 1.00 . A A . 8 SER H 1 1 16 9551 1 1 8 SER HA H -11.413 2.799 -4.848 1.00 . A A . 8 SER HA 1 1 16 9552 1 1 8 SER HB2 H -12.044 0.453 -3.007 1.00 . A A . 8 SER HB2 1 1 16 9553 1 1 8 SER HB3 H -13.239 1.254 -4.057 1.00 . A A . 8 SER HB3 1 1 16 9554 1 1 8 SER HG H -12.471 -0.179 -5.447 1.00 . A A . 8 SER HG 1 1 16 9555 1 1 8 SER N N -10.031 2.127 -3.461 1.00 . A A . 8 SER N 1 1 16 9556 1 1 8 SER O O -12.886 4.174 -3.409 1.00 . A A . 8 SER O 1 1 16 9557 1 1 8 SER OG O -11.723 0.284 -5.038 1.00 . A A . 8 SER OG 1 1 16 9558 1 1 9 ASP C C -11.478 5.824 -0.913 1.00 . A A . 9 ASP C 1 1 16 9559 1 1 9 ASP CA C -12.211 4.481 -0.712 1.00 . A A . 9 ASP CA 1 1 16 9560 1 1 9 ASP CB C -12.028 3.956 0.726 1.00 . A A . 9 ASP CB 1 1 16 9561 1 1 9 ASP CG C -13.048 4.527 1.715 1.00 . A A . 9 ASP CG 1 1 16 9562 1 1 9 ASP H H -10.986 2.828 -1.299 1.00 . A A . 9 ASP H 1 1 16 9563 1 1 9 ASP HA H -13.276 4.619 -0.896 1.00 . A A . 9 ASP HA 1 1 16 9564 1 1 9 ASP HB2 H -12.143 2.869 0.726 1.00 . A A . 9 ASP HB2 1 1 16 9565 1 1 9 ASP HB3 H -11.017 4.164 1.078 1.00 . A A . 9 ASP HB3 1 1 16 9566 1 1 9 ASP N N -11.700 3.461 -1.641 1.00 . A A . 9 ASP N 1 1 16 9567 1 1 9 ASP O O -11.293 6.617 0.015 1.00 . A A . 9 ASP O 1 1 16 9568 1 1 9 ASP OD1 O -12.816 5.576 2.365 1.00 . A A . 9 ASP OD1 1 1 16 9569 1 1 9 ASP OD2 O -14.054 3.824 1.980 1.00 . A A . 9 ASP OD2 1 1 16 9570 1 1 10 GLY C C -8.998 7.384 -1.795 1.00 . A A . 10 GLY C 1 1 16 9571 1 1 10 GLY CA C -10.345 7.325 -2.523 1.00 . A A . 10 GLY CA 1 1 16 9572 1 1 10 GLY H H -11.307 5.466 -2.877 1.00 . A A . 10 GLY H 1 1 16 9573 1 1 10 GLY HA2 H -10.911 8.225 -2.288 1.00 . A A . 10 GLY HA2 1 1 16 9574 1 1 10 GLY HA3 H -10.156 7.314 -3.596 1.00 . A A . 10 GLY HA3 1 1 16 9575 1 1 10 GLY N N -11.138 6.159 -2.160 1.00 . A A . 10 GLY N 1 1 16 9576 1 1 10 GLY O O -8.529 8.495 -1.518 1.00 . A A . 10 GLY O 1 1 16 9577 1 1 11 GLY C C -5.979 6.676 -1.537 1.00 . A A . 11 GLY C 1 1 16 9578 1 1 11 GLY CA C -7.157 6.207 -0.681 1.00 . A A . 11 GLY CA 1 1 16 9579 1 1 11 GLY H H -8.831 5.355 -1.639 1.00 . A A . 11 GLY H 1 1 16 9580 1 1 11 GLY HA2 H -6.981 5.179 -0.374 1.00 . A A . 11 GLY HA2 1 1 16 9581 1 1 11 GLY HA3 H -7.253 6.829 0.203 1.00 . A A . 11 GLY HA3 1 1 16 9582 1 1 11 GLY N N -8.410 6.248 -1.416 1.00 . A A . 11 GLY N 1 1 16 9583 1 1 11 GLY O O -6.039 6.598 -2.762 1.00 . A A . 11 GLY O 1 1 16 9584 1 1 12 ASP C C -2.537 6.560 -0.771 1.00 . A A . 12 ASP C 1 1 16 9585 1 1 12 ASP CA C -3.603 7.363 -1.524 1.00 . A A . 12 ASP CA 1 1 16 9586 1 1 12 ASP CB C -3.260 8.857 -1.615 1.00 . A A . 12 ASP CB 1 1 16 9587 1 1 12 ASP CG C -3.746 9.504 -2.900 1.00 . A A . 12 ASP CG 1 1 16 9588 1 1 12 ASP H H -4.933 7.138 0.114 1.00 . A A . 12 ASP H 1 1 16 9589 1 1 12 ASP HA H -3.632 6.977 -2.545 1.00 . A A . 12 ASP HA 1 1 16 9590 1 1 12 ASP HB2 H -3.676 9.375 -0.752 1.00 . A A . 12 ASP HB2 1 1 16 9591 1 1 12 ASP HB3 H -2.179 8.997 -1.600 1.00 . A A . 12 ASP HB3 1 1 16 9592 1 1 12 ASP N N -4.909 7.159 -0.892 1.00 . A A . 12 ASP N 1 1 16 9593 1 1 12 ASP O O -2.430 5.352 -0.965 1.00 . A A . 12 ASP O 1 1 16 9594 1 1 12 ASP OD1 O -3.098 9.303 -3.954 1.00 . A A . 12 ASP OD1 1 1 16 9595 1 1 12 ASP OD2 O -4.625 10.389 -2.799 1.00 . A A . 12 ASP OD2 1 1 16 9596 1 1 13 CYS C C -0.786 6.760 2.353 1.00 . A A . 13 CYS C 1 1 16 9597 1 1 13 CYS CA C -0.672 6.576 0.847 1.00 . A A . 13 CYS CA 1 1 16 9598 1 1 13 CYS CB C 0.647 7.138 0.294 1.00 . A A . 13 CYS CB 1 1 16 9599 1 1 13 CYS H H -1.952 8.182 0.285 1.00 . A A . 13 CYS H 1 1 16 9600 1 1 13 CYS HA H -0.675 5.504 0.663 1.00 . A A . 13 CYS HA 1 1 16 9601 1 1 13 CYS HB2 H 0.614 8.223 0.264 1.00 . A A . 13 CYS HB2 1 1 16 9602 1 1 13 CYS HB3 H 1.464 6.877 0.964 1.00 . A A . 13 CYS HB3 1 1 16 9603 1 1 13 CYS N N -1.815 7.182 0.169 1.00 . A A . 13 CYS N 1 1 16 9604 1 1 13 CYS O O -0.681 5.778 3.089 1.00 . A A . 13 CYS O 1 1 16 9605 1 1 13 CYS SG S 1.058 6.541 -1.361 1.00 . A A . 13 CYS SG 1 1 16 9606 1 1 14 THR C C -2.471 7.541 4.728 1.00 . A A . 14 THR C 1 1 16 9607 1 1 14 THR CA C -1.219 8.264 4.241 1.00 . A A . 14 THR CA 1 1 16 9608 1 1 14 THR CB C -1.292 9.785 4.469 1.00 . A A . 14 THR CB 1 1 16 9609 1 1 14 THR CG2 C -1.278 10.158 5.955 1.00 . A A . 14 THR CG2 1 1 16 9610 1 1 14 THR H H -1.086 8.772 2.188 1.00 . A A . 14 THR H 1 1 16 9611 1 1 14 THR HA H -0.364 7.867 4.784 1.00 . A A . 14 THR HA 1 1 16 9612 1 1 14 THR HB H -2.201 10.178 4.013 1.00 . A A . 14 THR HB 1 1 16 9613 1 1 14 THR HG1 H -0.269 11.359 3.953 1.00 . A A . 14 THR HG1 1 1 16 9614 1 1 14 THR HG21 H -2.127 9.704 6.466 1.00 . A A . 14 THR HG21 1 1 16 9615 1 1 14 THR HG22 H -0.357 9.812 6.423 1.00 . A A . 14 THR HG22 1 1 16 9616 1 1 14 THR HG23 H -1.352 11.241 6.066 1.00 . A A . 14 THR HG23 1 1 16 9617 1 1 14 THR N N -1.028 7.982 2.826 1.00 . A A . 14 THR N 1 1 16 9618 1 1 14 THR O O -2.392 6.736 5.657 1.00 . A A . 14 THR O 1 1 16 9619 1 1 14 THR OG1 O -0.174 10.390 3.847 1.00 . A A . 14 THR OG1 1 1 16 9620 1 1 15 THR C C -5.226 5.895 4.359 1.00 . A A . 15 THR C 1 1 16 9621 1 1 15 THR CA C -4.918 7.388 4.605 1.00 . A A . 15 THR CA 1 1 16 9622 1 1 15 THR CB C -5.895 8.335 3.860 1.00 . A A . 15 THR CB 1 1 16 9623 1 1 15 THR CG2 C -6.141 7.950 2.393 1.00 . A A . 15 THR CG2 1 1 16 9624 1 1 15 THR H H -3.604 8.391 3.278 1.00 . A A . 15 THR H 1 1 16 9625 1 1 15 THR HA H -4.957 7.596 5.677 1.00 . A A . 15 THR HA 1 1 16 9626 1 1 15 THR HB H -5.428 9.315 3.825 1.00 . A A . 15 THR HB 1 1 16 9627 1 1 15 THR HG1 H -7.581 9.250 4.082 1.00 . A A . 15 THR HG1 1 1 16 9628 1 1 15 THR HG21 H -5.196 7.774 1.883 1.00 . A A . 15 THR HG21 1 1 16 9629 1 1 15 THR HG22 H -6.756 7.052 2.337 1.00 . A A . 15 THR HG22 1 1 16 9630 1 1 15 THR HG23 H -6.662 8.754 1.874 1.00 . A A . 15 THR HG23 1 1 16 9631 1 1 15 THR N N -3.613 7.768 4.074 1.00 . A A . 15 THR N 1 1 16 9632 1 1 15 THR O O -6.393 5.502 4.327 1.00 . A A . 15 THR O 1 1 16 9633 1 1 15 THR OG1 O -7.121 8.515 4.530 1.00 . A A . 15 THR OG1 1 1 16 9634 1 1 16 CYS C C -2.951 2.923 4.621 1.00 . A A . 16 CYS C 1 1 16 9635 1 1 16 CYS CA C -4.229 3.600 4.099 1.00 . A A . 16 CYS CA 1 1 16 9636 1 1 16 CYS CB C -4.352 3.400 2.578 1.00 . A A . 16 CYS CB 1 1 16 9637 1 1 16 CYS H H -3.295 5.438 4.567 1.00 . A A . 16 CYS H 1 1 16 9638 1 1 16 CYS HA H -5.081 3.124 4.598 1.00 . A A . 16 CYS HA 1 1 16 9639 1 1 16 CYS HB2 H -3.604 4.008 2.070 1.00 . A A . 16 CYS HB2 1 1 16 9640 1 1 16 CYS HB3 H -4.146 2.360 2.336 1.00 . A A . 16 CYS HB3 1 1 16 9641 1 1 16 CYS N N -4.204 5.032 4.396 1.00 . A A . 16 CYS N 1 1 16 9642 1 1 16 CYS O O -2.984 1.730 4.924 1.00 . A A . 16 CYS O 1 1 16 9643 1 1 16 CYS SG S -5.980 3.805 1.895 1.00 . A A . 16 CYS SG 1 1 16 9644 1 1 17 PHE C C -1.291 3.356 7.181 1.00 . A A . 17 PHE C 1 1 16 9645 1 1 17 PHE CA C -0.801 3.228 5.736 1.00 . A A . 17 PHE CA 1 1 16 9646 1 1 17 PHE CB C 0.478 4.056 5.548 1.00 . A A . 17 PHE CB 1 1 16 9647 1 1 17 PHE CD1 C 2.051 2.199 6.106 1.00 . A A . 17 PHE CD1 1 1 16 9648 1 1 17 PHE CD2 C 2.178 4.206 7.459 1.00 . A A . 17 PHE CD2 1 1 16 9649 1 1 17 PHE CE1 C 3.017 1.575 6.909 1.00 . A A . 17 PHE CE1 1 1 16 9650 1 1 17 PHE CE2 C 3.172 3.594 8.248 1.00 . A A . 17 PHE CE2 1 1 16 9651 1 1 17 PHE CG C 1.615 3.501 6.379 1.00 . A A . 17 PHE CG 1 1 16 9652 1 1 17 PHE CZ C 3.583 2.277 7.975 1.00 . A A . 17 PHE CZ 1 1 16 9653 1 1 17 PHE H H -1.762 4.597 4.443 1.00 . A A . 17 PHE H 1 1 16 9654 1 1 17 PHE HA H -0.582 2.178 5.536 1.00 . A A . 17 PHE HA 1 1 16 9655 1 1 17 PHE HB2 H 0.773 4.016 4.499 1.00 . A A . 17 PHE HB2 1 1 16 9656 1 1 17 PHE HB3 H 0.289 5.098 5.811 1.00 . A A . 17 PHE HB3 1 1 16 9657 1 1 17 PHE HD1 H 1.625 1.680 5.265 1.00 . A A . 17 PHE HD1 1 1 16 9658 1 1 17 PHE HD2 H 1.848 5.209 7.692 1.00 . A A . 17 PHE HD2 1 1 16 9659 1 1 17 PHE HE1 H 3.329 0.560 6.705 1.00 . A A . 17 PHE HE1 1 1 16 9660 1 1 17 PHE HE2 H 3.605 4.122 9.086 1.00 . A A . 17 PHE HE2 1 1 16 9661 1 1 17 PHE HZ H 4.317 1.768 8.578 1.00 . A A . 17 PHE HZ 1 1 16 9662 1 1 17 PHE N N -1.847 3.661 4.816 1.00 . A A . 17 PHE N 1 1 16 9663 1 1 17 PHE O O -1.047 2.474 8.007 1.00 . A A . 17 PHE O 1 1 16 9664 1 1 18 ASN C C -1.694 4.618 9.951 1.00 . A A . 18 ASN C 1 1 16 9665 1 1 18 ASN CA C -2.629 4.784 8.748 1.00 . A A . 18 ASN CA 1 1 16 9666 1 1 18 ASN CB C -3.892 3.952 8.944 1.00 . A A . 18 ASN CB 1 1 16 9667 1 1 18 ASN CG C -4.877 4.628 9.895 1.00 . A A . 18 ASN CG 1 1 16 9668 1 1 18 ASN H H -2.079 5.166 6.755 1.00 . A A . 18 ASN H 1 1 16 9669 1 1 18 ASN HA H -2.904 5.835 8.674 1.00 . A A . 18 ASN HA 1 1 16 9670 1 1 18 ASN HB2 H -4.388 3.770 7.990 1.00 . A A . 18 ASN HB2 1 1 16 9671 1 1 18 ASN HB3 H -3.517 3.018 9.362 1.00 . A A . 18 ASN HB3 1 1 16 9672 1 1 18 ASN HD21 H -5.908 2.896 10.268 1.00 . A A . 18 ASN HD21 1 1 16 9673 1 1 18 ASN HD22 H -6.532 4.370 10.994 1.00 . A A . 18 ASN HD22 1 1 16 9674 1 1 18 ASN N N -2.005 4.449 7.471 1.00 . A A . 18 ASN N 1 1 16 9675 1 1 18 ASN ND2 N -5.795 3.889 10.492 1.00 . A A . 18 ASN ND2 1 1 16 9676 1 1 18 ASN O O -2.068 4.115 11.017 1.00 . A A . 18 ASN O 1 1 16 9677 1 1 18 ASN OD1 O -4.811 5.830 10.130 1.00 . A A . 18 ASN OD1 1 1 16 9678 1 1 19 ASN C C 0.833 3.314 11.105 1.00 . A A . 19 ASN C 1 1 16 9679 1 1 19 ASN CA C 0.691 4.756 10.619 1.00 . A A . 19 ASN CA 1 1 16 9680 1 1 19 ASN CB C 0.941 5.843 11.669 1.00 . A A . 19 ASN CB 1 1 16 9681 1 1 19 ASN CG C 2.417 5.873 12.061 1.00 . A A . 19 ASN CG 1 1 16 9682 1 1 19 ASN H H -0.259 5.498 8.886 1.00 . A A . 19 ASN H 1 1 16 9683 1 1 19 ASN HA H 1.477 4.856 9.900 1.00 . A A . 19 ASN HA 1 1 16 9684 1 1 19 ASN HB2 H 0.663 6.809 11.251 1.00 . A A . 19 ASN HB2 1 1 16 9685 1 1 19 ASN HB3 H 0.339 5.647 12.556 1.00 . A A . 19 ASN HB3 1 1 16 9686 1 1 19 ASN HD21 H 2.751 7.625 11.071 1.00 . A A . 19 ASN HD21 1 1 16 9687 1 1 19 ASN HD22 H 4.142 6.937 11.891 1.00 . A A . 19 ASN HD22 1 1 16 9688 1 1 19 ASN N N -0.446 5.009 9.759 1.00 . A A . 19 ASN N 1 1 16 9689 1 1 19 ASN ND2 N 3.161 6.878 11.628 1.00 . A A . 19 ASN ND2 1 1 16 9690 1 1 19 ASN O O 0.672 3.007 12.286 1.00 . A A . 19 ASN O 1 1 16 9691 1 1 19 ASN OD1 O 2.903 4.977 12.739 1.00 . A A . 19 ASN OD1 1 1 16 9692 1 1 20 GLY C C 0.483 0.056 10.837 1.00 . A A . 20 GLY C 1 1 16 9693 1 1 20 GLY CA C 1.558 1.063 10.432 1.00 . A A . 20 GLY CA 1 1 16 9694 1 1 20 GLY H H 1.059 2.701 9.193 1.00 . A A . 20 GLY H 1 1 16 9695 1 1 20 GLY HA2 H 2.323 1.130 11.207 1.00 . A A . 20 GLY HA2 1 1 16 9696 1 1 20 GLY HA3 H 2.048 0.691 9.535 1.00 . A A . 20 GLY HA3 1 1 16 9697 1 1 20 GLY N N 1.035 2.397 10.159 1.00 . A A . 20 GLY N 1 1 16 9698 1 1 20 GLY O O 0.786 -1.122 11.038 1.00 . A A . 20 GLY O 1 1 16 9699 1 1 21 THR C C -3.028 -0.271 10.272 1.00 . A A . 21 THR C 1 1 16 9700 1 1 21 THR CA C -1.906 -0.309 11.340 1.00 . A A . 21 THR CA 1 1 16 9701 1 1 21 THR CB C -2.209 0.233 12.740 1.00 . A A . 21 THR CB 1 1 16 9702 1 1 21 THR CG2 C -3.649 0.175 13.209 1.00 . A A . 21 THR CG2 1 1 16 9703 1 1 21 THR H H -0.996 1.464 10.855 1.00 . A A . 21 THR H 1 1 16 9704 1 1 21 THR HA H -1.616 -1.332 11.489 1.00 . A A . 21 THR HA 1 1 16 9705 1 1 21 THR HB H -1.933 1.271 12.717 1.00 . A A . 21 THR HB 1 1 16 9706 1 1 21 THR HG1 H -0.820 0.302 14.073 1.00 . A A . 21 THR HG1 1 1 16 9707 1 1 21 THR HG21 H -4.018 -0.849 13.181 1.00 . A A . 21 THR HG21 1 1 16 9708 1 1 21 THR HG22 H -3.721 0.569 14.222 1.00 . A A . 21 THR HG22 1 1 16 9709 1 1 21 THR HG23 H -4.223 0.812 12.544 1.00 . A A . 21 THR HG23 1 1 16 9710 1 1 21 THR N N -0.779 0.480 10.897 1.00 . A A . 21 THR N 1 1 16 9711 1 1 21 THR O O -4.093 -0.859 10.472 1.00 . A A . 21 THR O 1 1 16 9712 1 1 21 THR OG1 O -1.373 -0.403 13.685 1.00 . A A . 21 THR OG1 1 1 16 9713 1 1 22 GLY C C -3.751 -0.823 7.180 1.00 . A A . 22 GLY C 1 1 16 9714 1 1 22 GLY CA C -3.760 0.460 8.015 1.00 . A A . 22 GLY CA 1 1 16 9715 1 1 22 GLY H H -1.922 0.840 8.960 1.00 . A A . 22 GLY H 1 1 16 9716 1 1 22 GLY HA2 H -3.486 1.295 7.372 1.00 . A A . 22 GLY HA2 1 1 16 9717 1 1 22 GLY HA3 H -4.769 0.628 8.385 1.00 . A A . 22 GLY HA3 1 1 16 9718 1 1 22 GLY N N -2.820 0.406 9.134 1.00 . A A . 22 GLY N 1 1 16 9719 1 1 22 GLY O O -2.917 -1.706 7.416 1.00 . A A . 22 GLY O 1 1 16 9720 1 1 23 PRO C C -3.465 -2.326 4.565 1.00 . A A . 23 PRO C 1 1 16 9721 1 1 23 PRO CA C -4.756 -2.119 5.347 1.00 . A A . 23 PRO CA 1 1 16 9722 1 1 23 PRO CB C -5.960 -1.900 4.427 1.00 . A A . 23 PRO CB 1 1 16 9723 1 1 23 PRO CD C -5.593 0.083 5.740 1.00 . A A . 23 PRO CD 1 1 16 9724 1 1 23 PRO CG C -6.115 -0.383 4.384 1.00 . A A . 23 PRO CG 1 1 16 9725 1 1 23 PRO HA H -4.934 -2.995 5.971 1.00 . A A . 23 PRO HA 1 1 16 9726 1 1 23 PRO HB2 H -5.797 -2.307 3.428 1.00 . A A . 23 PRO HB2 1 1 16 9727 1 1 23 PRO HB3 H -6.846 -2.350 4.873 1.00 . A A . 23 PRO HB3 1 1 16 9728 1 1 23 PRO HD2 H -5.136 1.064 5.652 1.00 . A A . 23 PRO HD2 1 1 16 9729 1 1 23 PRO HD3 H -6.415 0.156 6.436 1.00 . A A . 23 PRO HD3 1 1 16 9730 1 1 23 PRO HG2 H -5.486 0.023 3.592 1.00 . A A . 23 PRO HG2 1 1 16 9731 1 1 23 PRO HG3 H -7.157 -0.096 4.240 1.00 . A A . 23 PRO HG3 1 1 16 9732 1 1 23 PRO N N -4.649 -0.933 6.183 1.00 . A A . 23 PRO N 1 1 16 9733 1 1 23 PRO O O -2.947 -3.440 4.546 1.00 . A A . 23 PRO O 1 1 16 9734 1 1 24 CYS C C -0.534 -0.781 4.266 1.00 . A A . 24 CYS C 1 1 16 9735 1 1 24 CYS CA C -1.609 -1.322 3.325 1.00 . A A . 24 CYS CA 1 1 16 9736 1 1 24 CYS CB C -1.660 -0.628 1.953 1.00 . A A . 24 CYS CB 1 1 16 9737 1 1 24 CYS H H -3.283 -0.339 4.122 1.00 . A A . 24 CYS H 1 1 16 9738 1 1 24 CYS HA H -1.359 -2.364 3.125 1.00 . A A . 24 CYS HA 1 1 16 9739 1 1 24 CYS HB2 H -0.933 0.177 1.903 1.00 . A A . 24 CYS HB2 1 1 16 9740 1 1 24 CYS HB3 H -1.363 -1.378 1.226 1.00 . A A . 24 CYS HB3 1 1 16 9741 1 1 24 CYS N N -2.889 -1.263 3.999 1.00 . A A . 24 CYS N 1 1 16 9742 1 1 24 CYS O O 0.177 0.160 3.930 1.00 . A A . 24 CYS O 1 1 16 9743 1 1 24 CYS SG S -3.214 0.048 1.342 1.00 . A A . 24 CYS SG 1 1 16 9744 1 1 25 ALA C C 1.878 -2.115 5.990 1.00 . A A . 25 ALA C 1 1 16 9745 1 1 25 ALA CA C 0.762 -1.131 6.307 1.00 . A A . 25 ALA CA 1 1 16 9746 1 1 25 ALA CB C 0.408 -1.207 7.780 1.00 . A A . 25 ALA CB 1 1 16 9747 1 1 25 ALA H H -1.034 -2.116 5.710 1.00 . A A . 25 ALA H 1 1 16 9748 1 1 25 ALA HA H 1.135 -0.135 6.120 1.00 . A A . 25 ALA HA 1 1 16 9749 1 1 25 ALA HB1 H -0.011 -2.180 8.028 1.00 . A A . 25 ALA HB1 1 1 16 9750 1 1 25 ALA HB2 H -0.302 -0.419 8.020 1.00 . A A . 25 ALA HB2 1 1 16 9751 1 1 25 ALA HB3 H 1.336 -1.067 8.337 1.00 . A A . 25 ALA HB3 1 1 16 9752 1 1 25 ALA N N -0.398 -1.369 5.458 1.00 . A A . 25 ALA N 1 1 16 9753 1 1 25 ALA O O 3.029 -1.720 5.804 1.00 . A A . 25 ALA O 1 1 16 9754 1 1 26 ASN C C 3.257 -4.225 4.320 1.00 . A A . 26 ASN C 1 1 16 9755 1 1 26 ASN CA C 2.527 -4.442 5.648 1.00 . A A . 26 ASN CA 1 1 16 9756 1 1 26 ASN CB C 1.870 -5.827 5.654 1.00 . A A . 26 ASN CB 1 1 16 9757 1 1 26 ASN CG C 1.033 -6.091 4.404 1.00 . A A . 26 ASN CG 1 1 16 9758 1 1 26 ASN H H 0.583 -3.662 6.128 1.00 . A A . 26 ASN H 1 1 16 9759 1 1 26 ASN HA H 3.270 -4.397 6.448 1.00 . A A . 26 ASN HA 1 1 16 9760 1 1 26 ASN HB2 H 2.670 -6.567 5.685 1.00 . A A . 26 ASN HB2 1 1 16 9761 1 1 26 ASN HB3 H 1.269 -5.956 6.554 1.00 . A A . 26 ASN HB3 1 1 16 9762 1 1 26 ASN HD21 H -0.688 -5.415 5.273 1.00 . A A . 26 ASN HD21 1 1 16 9763 1 1 26 ASN HD22 H -0.871 -6.008 3.652 1.00 . A A . 26 ASN HD22 1 1 16 9764 1 1 26 ASN N N 1.540 -3.402 5.914 1.00 . A A . 26 ASN N 1 1 16 9765 1 1 26 ASN ND2 N -0.250 -5.772 4.435 1.00 . A A . 26 ASN ND2 1 1 16 9766 1 1 26 ASN O O 4.394 -4.663 4.171 1.00 . A A . 26 ASN O 1 1 16 9767 1 1 26 ASN OD1 O 1.553 -6.589 3.405 1.00 . A A . 26 ASN OD1 1 1 16 9768 1 1 27 CYS C C 4.326 -2.216 2.109 1.00 . A A . 27 CYS C 1 1 16 9769 1 1 27 CYS CA C 3.191 -3.241 2.064 1.00 . A A . 27 CYS CA 1 1 16 9770 1 1 27 CYS CB C 2.090 -2.899 1.052 1.00 . A A . 27 CYS CB 1 1 16 9771 1 1 27 CYS H H 1.689 -3.207 3.575 1.00 . A A . 27 CYS H 1 1 16 9772 1 1 27 CYS HA H 3.627 -4.154 1.664 1.00 . A A . 27 CYS HA 1 1 16 9773 1 1 27 CYS HB2 H 1.606 -1.942 1.255 1.00 . A A . 27 CYS HB2 1 1 16 9774 1 1 27 CYS HB3 H 2.566 -2.803 0.077 1.00 . A A . 27 CYS HB3 1 1 16 9775 1 1 27 CYS N N 2.621 -3.528 3.373 1.00 . A A . 27 CYS N 1 1 16 9776 1 1 27 CYS O O 4.804 -1.866 1.044 1.00 . A A . 27 CYS O 1 1 16 9777 1 1 27 CYS SG S 0.890 -4.261 0.957 1.00 . A A . 27 CYS SG 1 1 16 9778 1 1 28 LEU C C 7.103 -1.356 3.927 1.00 . A A . 28 LEU C 1 1 16 9779 1 1 28 LEU CA C 5.845 -0.728 3.354 1.00 . A A . 28 LEU CA 1 1 16 9780 1 1 28 LEU CB C 5.400 0.408 4.280 1.00 . A A . 28 LEU CB 1 1 16 9781 1 1 28 LEU CD1 C 4.843 2.154 2.494 1.00 . A A . 28 LEU CD1 1 1 16 9782 1 1 28 LEU CD2 C 3.073 0.663 3.212 1.00 . A A . 28 LEU CD2 1 1 16 9783 1 1 28 LEU CG C 4.350 1.338 3.679 1.00 . A A . 28 LEU CG 1 1 16 9784 1 1 28 LEU H H 4.162 -1.697 4.088 1.00 . A A . 28 LEU H 1 1 16 9785 1 1 28 LEU HA H 6.089 -0.327 2.371 1.00 . A A . 28 LEU HA 1 1 16 9786 1 1 28 LEU HB2 H 4.992 -0.010 5.208 1.00 . A A . 28 LEU HB2 1 1 16 9787 1 1 28 LEU HB3 H 6.273 1.009 4.545 1.00 . A A . 28 LEU HB3 1 1 16 9788 1 1 28 LEU HD11 H 5.857 2.510 2.679 1.00 . A A . 28 LEU HD11 1 1 16 9789 1 1 28 LEU HD12 H 4.827 1.504 1.622 1.00 . A A . 28 LEU HD12 1 1 16 9790 1 1 28 LEU HD13 H 4.158 2.975 2.308 1.00 . A A . 28 LEU HD13 1 1 16 9791 1 1 28 LEU HD21 H 2.740 -0.030 3.978 1.00 . A A . 28 LEU HD21 1 1 16 9792 1 1 28 LEU HD22 H 2.310 1.419 3.078 1.00 . A A . 28 LEU HD22 1 1 16 9793 1 1 28 LEU HD23 H 3.248 0.150 2.261 1.00 . A A . 28 LEU HD23 1 1 16 9794 1 1 28 LEU HG H 4.081 1.986 4.486 1.00 . A A . 28 LEU HG 1 1 16 9795 1 1 28 LEU N N 4.756 -1.692 3.267 1.00 . A A . 28 LEU N 1 1 16 9796 1 1 28 LEU O O 8.191 -1.193 3.381 1.00 . A A . 28 LEU O 1 1 16 9797 1 1 29 ALA C C 8.574 -3.795 5.121 1.00 . A A . 29 ALA C 1 1 16 9798 1 1 29 ALA CA C 8.108 -2.520 5.822 1.00 . A A . 29 ALA CA 1 1 16 9799 1 1 29 ALA CB C 7.706 -2.728 7.282 1.00 . A A . 29 ALA CB 1 1 16 9800 1 1 29 ALA H H 6.049 -2.125 5.469 1.00 . A A . 29 ALA H 1 1 16 9801 1 1 29 ALA HA H 8.925 -1.798 5.794 1.00 . A A . 29 ALA HA 1 1 16 9802 1 1 29 ALA HB1 H 8.554 -3.141 7.824 1.00 . A A . 29 ALA HB1 1 1 16 9803 1 1 29 ALA HB2 H 7.436 -1.769 7.731 1.00 . A A . 29 ALA HB2 1 1 16 9804 1 1 29 ALA HB3 H 6.856 -3.406 7.357 1.00 . A A . 29 ALA HB3 1 1 16 9805 1 1 29 ALA N N 6.973 -1.992 5.090 1.00 . A A . 29 ALA N 1 1 16 9806 1 1 29 ALA O O 9.618 -3.805 4.460 1.00 . A A . 29 ALA O 1 1 16 9807 1 1 30 GLY C C 7.381 -5.977 3.099 1.00 . A A . 30 GLY C 1 1 16 9808 1 1 30 GLY CA C 7.973 -6.093 4.493 1.00 . A A . 30 GLY CA 1 1 16 9809 1 1 30 GLY H H 6.912 -4.792 5.746 1.00 . A A . 30 GLY H 1 1 16 9810 1 1 30 GLY HA2 H 7.483 -6.901 5.033 1.00 . A A . 30 GLY HA2 1 1 16 9811 1 1 30 GLY HA3 H 9.033 -6.315 4.429 1.00 . A A . 30 GLY HA3 1 1 16 9812 1 1 30 GLY N N 7.765 -4.851 5.205 1.00 . A A . 30 GLY N 1 1 16 9813 1 1 30 GLY O O 6.346 -6.600 2.836 1.00 . A A . 30 GLY O 1 1 16 9814 1 1 31 TYR C C 8.698 -5.417 -0.209 1.00 . A A . 31 TYR C 1 1 16 9815 1 1 31 TYR CA C 7.600 -5.097 0.825 1.00 . A A . 31 TYR CA 1 1 16 9816 1 1 31 TYR CB C 7.087 -3.647 0.700 1.00 . A A . 31 TYR CB 1 1 16 9817 1 1 31 TYR CD1 C 9.405 -2.576 0.478 1.00 . A A . 31 TYR CD1 1 1 16 9818 1 1 31 TYR CD2 C 7.501 -1.620 -0.688 1.00 . A A . 31 TYR CD2 1 1 16 9819 1 1 31 TYR CE1 C 10.234 -1.597 -0.111 1.00 . A A . 31 TYR CE1 1 1 16 9820 1 1 31 TYR CE2 C 8.314 -0.659 -1.303 1.00 . A A . 31 TYR CE2 1 1 16 9821 1 1 31 TYR CG C 8.029 -2.573 0.189 1.00 . A A . 31 TYR CG 1 1 16 9822 1 1 31 TYR CZ C 9.695 -0.647 -1.017 1.00 . A A . 31 TYR CZ 1 1 16 9823 1 1 31 TYR H H 8.889 -4.751 2.488 1.00 . A A . 31 TYR H 1 1 16 9824 1 1 31 TYR HA H 6.772 -5.751 0.613 1.00 . A A . 31 TYR HA 1 1 16 9825 1 1 31 TYR HB2 H 6.246 -3.681 0.016 1.00 . A A . 31 TYR HB2 1 1 16 9826 1 1 31 TYR HB3 H 6.704 -3.283 1.656 1.00 . A A . 31 TYR HB3 1 1 16 9827 1 1 31 TYR HD1 H 9.802 -3.391 1.080 1.00 . A A . 31 TYR HD1 1 1 16 9828 1 1 31 TYR HD2 H 6.451 -1.672 -0.894 1.00 . A A . 31 TYR HD2 1 1 16 9829 1 1 31 TYR HE1 H 11.288 -1.592 0.101 1.00 . A A . 31 TYR HE1 1 1 16 9830 1 1 31 TYR HE2 H 7.868 0.085 -1.961 1.00 . A A . 31 TYR HE2 1 1 16 9831 1 1 31 TYR HH H 11.385 0.357 -1.307 1.00 . A A . 31 TYR HH 1 1 16 9832 1 1 31 TYR N N 8.029 -5.209 2.214 1.00 . A A . 31 TYR N 1 1 16 9833 1 1 31 TYR O O 8.740 -4.785 -1.269 1.00 . A A . 31 TYR O 1 1 16 9834 1 1 31 TYR OH O 10.494 0.236 -1.674 1.00 . A A . 31 TYR OH 1 1 16 9835 1 1 32 PRO C C 10.093 -7.220 -2.379 1.00 . A A . 32 PRO C 1 1 16 9836 1 1 32 PRO CA C 10.561 -6.757 -0.997 1.00 . A A . 32 PRO CA 1 1 16 9837 1 1 32 PRO CB C 11.422 -7.806 -0.297 1.00 . A A . 32 PRO CB 1 1 16 9838 1 1 32 PRO CD C 9.325 -7.581 0.892 1.00 . A A . 32 PRO CD 1 1 16 9839 1 1 32 PRO CG C 10.448 -8.567 0.601 1.00 . A A . 32 PRO CG 1 1 16 9840 1 1 32 PRO HA H 11.123 -5.824 -1.092 1.00 . A A . 32 PRO HA 1 1 16 9841 1 1 32 PRO HB2 H 11.902 -8.469 -1.014 1.00 . A A . 32 PRO HB2 1 1 16 9842 1 1 32 PRO HB3 H 12.170 -7.306 0.320 1.00 . A A . 32 PRO HB3 1 1 16 9843 1 1 32 PRO HD2 H 8.347 -8.063 0.850 1.00 . A A . 32 PRO HD2 1 1 16 9844 1 1 32 PRO HD3 H 9.491 -7.161 1.879 1.00 . A A . 32 PRO HD3 1 1 16 9845 1 1 32 PRO HG2 H 10.059 -9.446 0.081 1.00 . A A . 32 PRO HG2 1 1 16 9846 1 1 32 PRO HG3 H 10.936 -8.830 1.533 1.00 . A A . 32 PRO HG3 1 1 16 9847 1 1 32 PRO N N 9.421 -6.541 -0.112 1.00 . A A . 32 PRO N 1 1 16 9848 1 1 32 PRO O O 10.726 -6.931 -3.392 1.00 . A A . 32 PRO O 1 1 16 9849 1 1 33 ALA C C 7.070 -7.355 -3.897 1.00 . A A . 33 ALA C 1 1 16 9850 1 1 33 ALA CA C 8.199 -8.334 -3.562 1.00 . A A . 33 ALA CA 1 1 16 9851 1 1 33 ALA CB C 7.578 -9.682 -3.224 1.00 . A A . 33 ALA CB 1 1 16 9852 1 1 33 ALA H H 8.537 -8.143 -1.511 1.00 . A A . 33 ALA H 1 1 16 9853 1 1 33 ALA HA H 8.859 -8.433 -4.426 1.00 . A A . 33 ALA HA 1 1 16 9854 1 1 33 ALA HB1 H 7.049 -10.059 -4.093 1.00 . A A . 33 ALA HB1 1 1 16 9855 1 1 33 ALA HB2 H 8.348 -10.394 -2.928 1.00 . A A . 33 ALA HB2 1 1 16 9856 1 1 33 ALA HB3 H 6.863 -9.537 -2.414 1.00 . A A . 33 ALA HB3 1 1 16 9857 1 1 33 ALA N N 8.954 -7.914 -2.401 1.00 . A A . 33 ALA N 1 1 16 9858 1 1 33 ALA O O 6.252 -7.666 -4.762 1.00 . A A . 33 ALA O 1 1 16 9859 1 1 34 GLY C C 5.235 -4.999 -4.495 1.00 . A A . 34 GLY C 1 1 16 9860 1 1 34 GLY CA C 5.707 -5.451 -3.115 1.00 . A A . 34 GLY CA 1 1 16 9861 1 1 34 GLY H H 7.672 -5.989 -2.526 1.00 . A A . 34 GLY H 1 1 16 9862 1 1 34 GLY HA2 H 5.861 -4.576 -2.491 1.00 . A A . 34 GLY HA2 1 1 16 9863 1 1 34 GLY HA3 H 4.919 -6.051 -2.659 1.00 . A A . 34 GLY HA3 1 1 16 9864 1 1 34 GLY N N 6.924 -6.252 -3.153 1.00 . A A . 34 GLY N 1 1 16 9865 1 1 34 GLY O O 4.033 -5.030 -4.734 1.00 . A A . 34 GLY O 1 1 16 9866 1 1 35 CYS C C 5.042 -5.414 -7.549 1.00 . A A . 35 CYS C 1 1 16 9867 1 1 35 CYS CA C 5.780 -4.304 -6.792 1.00 . A A . 35 CYS CA 1 1 16 9868 1 1 35 CYS CB C 7.022 -4.017 -7.639 1.00 . A A . 35 CYS CB 1 1 16 9869 1 1 35 CYS H H 7.107 -4.575 -5.121 1.00 . A A . 35 CYS H 1 1 16 9870 1 1 35 CYS HA H 5.139 -3.423 -6.731 1.00 . A A . 35 CYS HA 1 1 16 9871 1 1 35 CYS HB2 H 7.645 -4.913 -7.669 1.00 . A A . 35 CYS HB2 1 1 16 9872 1 1 35 CYS HB3 H 6.678 -3.853 -8.663 1.00 . A A . 35 CYS HB3 1 1 16 9873 1 1 35 CYS N N 6.144 -4.669 -5.421 1.00 . A A . 35 CYS N 1 1 16 9874 1 1 35 CYS O O 4.383 -5.154 -8.561 1.00 . A A . 35 CYS O 1 1 16 9875 1 1 35 CYS SG S 7.994 -2.561 -7.213 1.00 . A A . 35 CYS SG 1 1 16 9876 1 1 36 SER C C 3.276 -8.199 -6.950 1.00 . A A . 36 SER C 1 1 16 9877 1 1 36 SER CA C 4.548 -7.812 -7.712 1.00 . A A . 36 SER CA 1 1 16 9878 1 1 36 SER CB C 5.564 -8.953 -7.777 1.00 . A A . 36 SER CB 1 1 16 9879 1 1 36 SER H H 5.721 -6.827 -6.268 1.00 . A A . 36 SER H 1 1 16 9880 1 1 36 SER HA H 4.287 -7.531 -8.728 1.00 . A A . 36 SER HA 1 1 16 9881 1 1 36 SER HB2 H 6.569 -8.530 -7.776 1.00 . A A . 36 SER HB2 1 1 16 9882 1 1 36 SER HB3 H 5.456 -9.601 -6.907 1.00 . A A . 36 SER HB3 1 1 16 9883 1 1 36 SER HG H 5.305 -9.080 -9.714 1.00 . A A . 36 SER HG 1 1 16 9884 1 1 36 SER N N 5.183 -6.660 -7.110 1.00 . A A . 36 SER N 1 1 16 9885 1 1 36 SER O O 2.425 -8.894 -7.508 1.00 . A A . 36 SER O 1 1 16 9886 1 1 36 SER OG O 5.404 -9.701 -8.964 1.00 . A A . 36 SER OG 1 1 16 9887 1 1 37 ASN C C 0.861 -6.825 -5.665 1.00 . A A . 37 ASN C 1 1 16 9888 1 1 37 ASN CA C 1.804 -7.834 -5.030 1.00 . A A . 37 ASN CA 1 1 16 9889 1 1 37 ASN CB C 1.934 -7.570 -3.509 1.00 . A A . 37 ASN CB 1 1 16 9890 1 1 37 ASN CG C 1.845 -8.847 -2.712 1.00 . A A . 37 ASN CG 1 1 16 9891 1 1 37 ASN H H 3.722 -6.989 -5.387 1.00 . A A . 37 ASN H 1 1 16 9892 1 1 37 ASN HA H 1.414 -8.840 -5.189 1.00 . A A . 37 ASN HA 1 1 16 9893 1 1 37 ASN HB2 H 2.826 -6.997 -3.262 1.00 . A A . 37 ASN HB2 1 1 16 9894 1 1 37 ASN HB3 H 1.101 -6.963 -3.157 1.00 . A A . 37 ASN HB3 1 1 16 9895 1 1 37 ASN HD21 H -0.119 -8.942 -3.103 1.00 . A A . 37 ASN HD21 1 1 16 9896 1 1 37 ASN HD22 H 0.446 -10.147 -1.977 1.00 . A A . 37 ASN HD22 1 1 16 9897 1 1 37 ASN N N 3.069 -7.683 -5.733 1.00 . A A . 37 ASN N 1 1 16 9898 1 1 37 ASN ND2 N 0.646 -9.383 -2.606 1.00 . A A . 37 ASN ND2 1 1 16 9899 1 1 37 ASN O O 0.700 -5.743 -5.121 1.00 . A A . 37 ASN O 1 1 16 9900 1 1 37 ASN OD1 O 2.839 -9.356 -2.199 1.00 . A A . 37 ASN OD1 1 1 16 9901 1 1 38 SER C C -1.653 -5.566 -6.699 1.00 . A A . 38 SER C 1 1 16 9902 1 1 38 SER CA C -0.625 -6.292 -7.594 1.00 . A A . 38 SER CA 1 1 16 9903 1 1 38 SER CB C -1.306 -7.159 -8.668 1.00 . A A . 38 SER CB 1 1 16 9904 1 1 38 SER H H 0.427 -8.096 -7.148 1.00 . A A . 38 SER H 1 1 16 9905 1 1 38 SER HA H 0.010 -5.548 -8.106 1.00 . A A . 38 SER HA 1 1 16 9906 1 1 38 SER HB2 H -0.600 -7.910 -9.020 1.00 . A A . 38 SER HB2 1 1 16 9907 1 1 38 SER HB3 H -2.164 -7.676 -8.237 1.00 . A A . 38 SER HB3 1 1 16 9908 1 1 38 SER HG H -1.351 -6.834 -10.590 1.00 . A A . 38 SER HG 1 1 16 9909 1 1 38 SER N N 0.241 -7.166 -6.800 1.00 . A A . 38 SER N 1 1 16 9910 1 1 38 SER O O -1.988 -4.415 -6.974 1.00 . A A . 38 SER O 1 1 16 9911 1 1 38 SER OG O -1.710 -6.396 -9.789 1.00 . A A . 38 SER OG 1 1 16 9912 1 1 39 ASP C C -2.399 -4.306 -3.987 1.00 . A A . 39 ASP C 1 1 16 9913 1 1 39 ASP CA C -2.970 -5.596 -4.587 1.00 . A A . 39 ASP CA 1 1 16 9914 1 1 39 ASP CB C -3.215 -6.621 -3.474 1.00 . A A . 39 ASP CB 1 1 16 9915 1 1 39 ASP CG C -4.068 -6.089 -2.319 1.00 . A A . 39 ASP CG 1 1 16 9916 1 1 39 ASP H H -1.738 -7.123 -5.415 1.00 . A A . 39 ASP H 1 1 16 9917 1 1 39 ASP HA H -3.924 -5.360 -5.048 1.00 . A A . 39 ASP HA 1 1 16 9918 1 1 39 ASP HB2 H -3.720 -7.488 -3.899 1.00 . A A . 39 ASP HB2 1 1 16 9919 1 1 39 ASP HB3 H -2.251 -6.957 -3.079 1.00 . A A . 39 ASP HB3 1 1 16 9920 1 1 39 ASP N N -2.101 -6.194 -5.603 1.00 . A A . 39 ASP N 1 1 16 9921 1 1 39 ASP O O -3.124 -3.333 -3.801 1.00 . A A . 39 ASP O 1 1 16 9922 1 1 39 ASP OD1 O -5.084 -5.394 -2.549 1.00 . A A . 39 ASP OD1 1 1 16 9923 1 1 39 ASP OD2 O -3.834 -6.549 -1.179 1.00 . A A . 39 ASP OD2 1 1 16 9924 1 1 40 CYS C C 0.493 -2.427 -4.185 1.00 . A A . 40 CYS C 1 1 16 9925 1 1 40 CYS CA C -0.354 -3.156 -3.143 1.00 . A A . 40 CYS CA 1 1 16 9926 1 1 40 CYS CB C 0.507 -3.670 -1.977 1.00 . A A . 40 CYS CB 1 1 16 9927 1 1 40 CYS H H -0.529 -5.023 -4.094 1.00 . A A . 40 CYS H 1 1 16 9928 1 1 40 CYS HA H -1.054 -2.420 -2.747 1.00 . A A . 40 CYS HA 1 1 16 9929 1 1 40 CYS HB2 H 0.911 -4.664 -2.208 1.00 . A A . 40 CYS HB2 1 1 16 9930 1 1 40 CYS HB3 H 1.361 -3.008 -1.810 1.00 . A A . 40 CYS HB3 1 1 16 9931 1 1 40 CYS N N -1.096 -4.272 -3.717 1.00 . A A . 40 CYS N 1 1 16 9932 1 1 40 CYS O O 0.963 -1.330 -3.907 1.00 . A A . 40 CYS O 1 1 16 9933 1 1 40 CYS SG S -0.448 -3.693 -0.443 1.00 . A A . 40 CYS SG 1 1 16 9934 1 1 41 THR C C 1.222 -0.999 -6.754 1.00 . A A . 41 THR C 1 1 16 9935 1 1 41 THR CA C 1.565 -2.435 -6.378 1.00 . A A . 41 THR CA 1 1 16 9936 1 1 41 THR CB C 1.517 -3.348 -7.593 1.00 . A A . 41 THR CB 1 1 16 9937 1 1 41 THR CG2 C 2.259 -2.844 -8.808 1.00 . A A . 41 THR CG2 1 1 16 9938 1 1 41 THR H H 0.380 -3.932 -5.543 1.00 . A A . 41 THR H 1 1 16 9939 1 1 41 THR HA H 2.578 -2.446 -5.973 1.00 . A A . 41 THR HA 1 1 16 9940 1 1 41 THR HB H 0.474 -3.496 -7.875 1.00 . A A . 41 THR HB 1 1 16 9941 1 1 41 THR HG1 H 2.690 -4.833 -7.987 1.00 . A A . 41 THR HG1 1 1 16 9942 1 1 41 THR HG21 H 3.308 -2.692 -8.567 1.00 . A A . 41 THR HG21 1 1 16 9943 1 1 41 THR HG22 H 2.142 -3.617 -9.559 1.00 . A A . 41 THR HG22 1 1 16 9944 1 1 41 THR HG23 H 1.823 -1.913 -9.166 1.00 . A A . 41 THR HG23 1 1 16 9945 1 1 41 THR N N 0.681 -2.980 -5.377 1.00 . A A . 41 THR N 1 1 16 9946 1 1 41 THR O O 2.154 -0.210 -6.852 1.00 . A A . 41 THR O 1 1 16 9947 1 1 41 THR OG1 O 2.090 -4.587 -7.268 1.00 . A A . 41 THR OG1 1 1 16 9948 1 1 42 ALA C C -0.209 1.704 -6.350 1.00 . A A . 42 ALA C 1 1 16 9949 1 1 42 ALA CA C -0.402 0.686 -7.467 1.00 . A A . 42 ALA CA 1 1 16 9950 1 1 42 ALA CB C -1.835 0.731 -8.005 1.00 . A A . 42 ALA CB 1 1 16 9951 1 1 42 ALA H H -0.794 -1.285 -6.733 1.00 . A A . 42 ALA H 1 1 16 9952 1 1 42 ALA HA H 0.271 0.964 -8.276 1.00 . A A . 42 ALA HA 1 1 16 9953 1 1 42 ALA HB1 H -1.924 0.103 -8.890 1.00 . A A . 42 ALA HB1 1 1 16 9954 1 1 42 ALA HB2 H -2.092 1.760 -8.266 1.00 . A A . 42 ALA HB2 1 1 16 9955 1 1 42 ALA HB3 H -2.531 0.386 -7.248 1.00 . A A . 42 ALA HB3 1 1 16 9956 1 1 42 ALA N N -0.048 -0.655 -7.006 1.00 . A A . 42 ALA N 1 1 16 9957 1 1 42 ALA O O 0.326 2.780 -6.607 1.00 . A A . 42 ALA O 1 1 16 9958 1 1 43 PHE C C 1.217 2.375 -3.888 1.00 . A A . 43 PHE C 1 1 16 9959 1 1 43 PHE CA C -0.278 2.103 -3.916 1.00 . A A . 43 PHE CA 1 1 16 9960 1 1 43 PHE CB C -0.774 1.313 -2.691 1.00 . A A . 43 PHE CB 1 1 16 9961 1 1 43 PHE CD1 C 0.889 1.423 -0.807 1.00 . A A . 43 PHE CD1 1 1 16 9962 1 1 43 PHE CD2 C -1.240 2.525 -0.482 1.00 . A A . 43 PHE CD2 1 1 16 9963 1 1 43 PHE CE1 C 1.299 1.816 0.472 1.00 . A A . 43 PHE CE1 1 1 16 9964 1 1 43 PHE CE2 C -0.846 2.893 0.817 1.00 . A A . 43 PHE CE2 1 1 16 9965 1 1 43 PHE CG C -0.362 1.802 -1.312 1.00 . A A . 43 PHE CG 1 1 16 9966 1 1 43 PHE CZ C 0.430 2.551 1.291 1.00 . A A . 43 PHE CZ 1 1 16 9967 1 1 43 PHE H H -0.997 0.420 -5.005 1.00 . A A . 43 PHE H 1 1 16 9968 1 1 43 PHE HA H -0.776 3.068 -3.970 1.00 . A A . 43 PHE HA 1 1 16 9969 1 1 43 PHE HB2 H -1.859 1.238 -2.742 1.00 . A A . 43 PHE HB2 1 1 16 9970 1 1 43 PHE HB3 H -0.373 0.309 -2.769 1.00 . A A . 43 PHE HB3 1 1 16 9971 1 1 43 PHE HD1 H 1.540 0.818 -1.407 1.00 . A A . 43 PHE HD1 1 1 16 9972 1 1 43 PHE HD2 H -2.232 2.776 -0.822 1.00 . A A . 43 PHE HD2 1 1 16 9973 1 1 43 PHE HE1 H 2.284 1.552 0.811 1.00 . A A . 43 PHE HE1 1 1 16 9974 1 1 43 PHE HE2 H -1.525 3.443 1.448 1.00 . A A . 43 PHE HE2 1 1 16 9975 1 1 43 PHE HZ H 0.746 2.832 2.282 1.00 . A A . 43 PHE HZ 1 1 16 9976 1 1 43 PHE N N -0.587 1.343 -5.119 1.00 . A A . 43 PHE N 1 1 16 9977 1 1 43 PHE O O 1.639 3.527 -3.899 1.00 . A A . 43 PHE O 1 1 16 9978 1 1 44 LEU C C 4.062 2.247 -5.026 1.00 . A A . 44 LEU C 1 1 16 9979 1 1 44 LEU CA C 3.477 1.509 -3.819 1.00 . A A . 44 LEU CA 1 1 16 9980 1 1 44 LEU CB C 4.162 0.159 -3.655 1.00 . A A . 44 LEU CB 1 1 16 9981 1 1 44 LEU CD1 C 4.360 -2.057 -2.567 1.00 . A A . 44 LEU CD1 1 1 16 9982 1 1 44 LEU CD2 C 4.101 0.073 -1.111 1.00 . A A . 44 LEU CD2 1 1 16 9983 1 1 44 LEU CG C 3.760 -0.652 -2.419 1.00 . A A . 44 LEU CG 1 1 16 9984 1 1 44 LEU H H 1.662 0.388 -3.818 1.00 . A A . 44 LEU H 1 1 16 9985 1 1 44 LEU HA H 3.654 2.120 -2.941 1.00 . A A . 44 LEU HA 1 1 16 9986 1 1 44 LEU HB2 H 3.943 -0.441 -4.532 1.00 . A A . 44 LEU HB2 1 1 16 9987 1 1 44 LEU HB3 H 5.228 0.347 -3.629 1.00 . A A . 44 LEU HB3 1 1 16 9988 1 1 44 LEU HD11 H 5.430 -1.995 -2.763 1.00 . A A . 44 LEU HD11 1 1 16 9989 1 1 44 LEU HD12 H 4.173 -2.647 -1.671 1.00 . A A . 44 LEU HD12 1 1 16 9990 1 1 44 LEU HD13 H 3.910 -2.555 -3.434 1.00 . A A . 44 LEU HD13 1 1 16 9991 1 1 44 LEU HD21 H 3.807 1.119 -1.135 1.00 . A A . 44 LEU HD21 1 1 16 9992 1 1 44 LEU HD22 H 3.529 -0.378 -0.304 1.00 . A A . 44 LEU HD22 1 1 16 9993 1 1 44 LEU HD23 H 5.162 0.010 -0.901 1.00 . A A . 44 LEU HD23 1 1 16 9994 1 1 44 LEU HG H 2.687 -0.778 -2.404 1.00 . A A . 44 LEU HG 1 1 16 9995 1 1 44 LEU N N 2.042 1.330 -3.905 1.00 . A A . 44 LEU N 1 1 16 9996 1 1 44 LEU O O 5.003 3.021 -4.863 1.00 . A A . 44 LEU O 1 1 16 9997 1 1 45 SER C C 3.624 4.343 -7.226 1.00 . A A . 45 SER C 1 1 16 9998 1 1 45 SER CA C 3.902 2.843 -7.400 1.00 . A A . 45 SER CA 1 1 16 9999 1 1 45 SER CB C 3.273 2.261 -8.676 1.00 . A A . 45 SER CB 1 1 16 10000 1 1 45 SER H H 2.755 1.408 -6.313 1.00 . A A . 45 SER H 1 1 16 10001 1 1 45 SER HA H 4.974 2.729 -7.478 1.00 . A A . 45 SER HA 1 1 16 10002 1 1 45 SER HB2 H 2.526 1.516 -8.427 1.00 . A A . 45 SER HB2 1 1 16 10003 1 1 45 SER HB3 H 2.757 3.039 -9.229 1.00 . A A . 45 SER HB3 1 1 16 10004 1 1 45 SER HG H 4.926 2.361 -9.683 1.00 . A A . 45 SER HG 1 1 16 10005 1 1 45 SER N N 3.505 2.082 -6.222 1.00 . A A . 45 SER N 1 1 16 10006 1 1 45 SER O O 4.209 5.155 -7.942 1.00 . A A . 45 SER O 1 1 16 10007 1 1 45 SER OG O 4.268 1.673 -9.505 1.00 . A A . 45 SER OG 1 1 16 10008 1 1 46 GLN C C 3.712 6.292 -4.592 1.00 . A A . 46 GLN C 1 1 16 10009 1 1 46 GLN CA C 2.730 6.104 -5.760 1.00 . A A . 46 GLN CA 1 1 16 10010 1 1 46 GLN CB C 1.254 6.447 -5.492 1.00 . A A . 46 GLN CB 1 1 16 10011 1 1 46 GLN CD C -0.801 7.199 -6.818 1.00 . A A . 46 GLN CD 1 1 16 10012 1 1 46 GLN CG C 0.461 6.348 -6.809 1.00 . A A . 46 GLN CG 1 1 16 10013 1 1 46 GLN H H 2.320 4.039 -5.697 1.00 . A A . 46 GLN H 1 1 16 10014 1 1 46 GLN HA H 3.067 6.778 -6.544 1.00 . A A . 46 GLN HA 1 1 16 10015 1 1 46 GLN HB2 H 0.820 5.772 -4.756 1.00 . A A . 46 GLN HB2 1 1 16 10016 1 1 46 GLN HB3 H 1.173 7.460 -5.110 1.00 . A A . 46 GLN HB3 1 1 16 10017 1 1 46 GLN HE21 H -2.004 5.591 -6.693 1.00 . A A . 46 GLN HE21 1 1 16 10018 1 1 46 GLN HE22 H -2.801 7.155 -6.652 1.00 . A A . 46 GLN HE22 1 1 16 10019 1 1 46 GLN HG2 H 1.083 6.695 -7.634 1.00 . A A . 46 GLN HG2 1 1 16 10020 1 1 46 GLN HG3 H 0.207 5.307 -7.003 1.00 . A A . 46 GLN HG3 1 1 16 10021 1 1 46 GLN N N 2.823 4.739 -6.237 1.00 . A A . 46 GLN N 1 1 16 10022 1 1 46 GLN NE2 N -1.974 6.587 -6.859 1.00 . A A . 46 GLN NE2 1 1 16 10023 1 1 46 GLN O O 4.707 7.000 -4.767 1.00 . A A . 46 GLN O 1 1 16 10024 1 1 46 GLN OE1 O -0.729 8.419 -6.926 1.00 . A A . 46 GLN OE1 1 1 16 10025 1 1 47 CYS C C 5.762 5.718 -2.311 1.00 . A A . 47 CYS C 1 1 16 10026 1 1 47 CYS CA C 4.242 5.906 -2.202 1.00 . A A . 47 CYS CA 1 1 16 10027 1 1 47 CYS CB C 3.703 5.073 -1.022 1.00 . A A . 47 CYS CB 1 1 16 10028 1 1 47 CYS H H 2.694 5.026 -3.390 1.00 . A A . 47 CYS H 1 1 16 10029 1 1 47 CYS HA H 4.054 6.956 -1.973 1.00 . A A . 47 CYS HA 1 1 16 10030 1 1 47 CYS HB2 H 4.257 4.126 -0.939 1.00 . A A . 47 CYS HB2 1 1 16 10031 1 1 47 CYS HB3 H 3.895 5.649 -0.117 1.00 . A A . 47 CYS HB3 1 1 16 10032 1 1 47 CYS N N 3.517 5.620 -3.448 1.00 . A A . 47 CYS N 1 1 16 10033 1 1 47 CYS O O 6.526 6.455 -1.687 1.00 . A A . 47 CYS O 1 1 16 10034 1 1 47 CYS SG S 1.924 4.728 -1.037 1.00 . A A . 47 CYS SG 1 1 16 10035 1 1 48 TYR C C 7.986 4.971 -4.816 1.00 . A A . 48 TYR C 1 1 16 10036 1 1 48 TYR CA C 7.619 4.500 -3.415 1.00 . A A . 48 TYR CA 1 1 16 10037 1 1 48 TYR CB C 7.964 3.030 -3.249 1.00 . A A . 48 TYR CB 1 1 16 10038 1 1 48 TYR CD1 C 9.372 3.013 -1.147 1.00 . A A . 48 TYR CD1 1 1 16 10039 1 1 48 TYR CD2 C 7.079 2.192 -1.067 1.00 . A A . 48 TYR CD2 1 1 16 10040 1 1 48 TYR CE1 C 9.536 2.717 0.216 1.00 . A A . 48 TYR CE1 1 1 16 10041 1 1 48 TYR CE2 C 7.282 1.788 0.256 1.00 . A A . 48 TYR CE2 1 1 16 10042 1 1 48 TYR CG C 8.148 2.735 -1.785 1.00 . A A . 48 TYR CG 1 1 16 10043 1 1 48 TYR CZ C 8.485 2.094 0.925 1.00 . A A . 48 TYR CZ 1 1 16 10044 1 1 48 TYR H H 5.528 4.186 -3.592 1.00 . A A . 48 TYR H 1 1 16 10045 1 1 48 TYR HA H 8.257 4.984 -2.687 1.00 . A A . 48 TYR HA 1 1 16 10046 1 1 48 TYR HB2 H 7.195 2.392 -3.681 1.00 . A A . 48 TYR HB2 1 1 16 10047 1 1 48 TYR HB3 H 8.896 2.812 -3.770 1.00 . A A . 48 TYR HB3 1 1 16 10048 1 1 48 TYR HD1 H 10.200 3.424 -1.713 1.00 . A A . 48 TYR HD1 1 1 16 10049 1 1 48 TYR HD2 H 6.155 1.964 -1.574 1.00 . A A . 48 TYR HD2 1 1 16 10050 1 1 48 TYR HE1 H 10.483 2.922 0.691 1.00 . A A . 48 TYR HE1 1 1 16 10051 1 1 48 TYR HE2 H 6.539 1.164 0.707 1.00 . A A . 48 TYR HE2 1 1 16 10052 1 1 48 TYR HH H 9.411 2.236 2.616 1.00 . A A . 48 TYR HH 1 1 16 10053 1 1 48 TYR N N 6.215 4.744 -3.099 1.00 . A A . 48 TYR N 1 1 16 10054 1 1 48 TYR O O 9.160 5.194 -5.090 1.00 . A A . 48 TYR O 1 1 16 10055 1 1 48 TYR OH O 8.617 1.813 2.247 1.00 . A A . 48 TYR OH 1 1 16 10056 1 1 49 GLY C C 7.228 3.810 -7.795 1.00 . A A . 49 GLY C 1 1 16 10057 1 1 49 GLY CA C 7.262 5.198 -7.151 1.00 . A A . 49 GLY CA 1 1 16 10058 1 1 49 GLY H H 6.078 4.856 -5.425 1.00 . A A . 49 GLY H 1 1 16 10059 1 1 49 GLY HA2 H 8.241 5.637 -7.327 1.00 . A A . 49 GLY HA2 1 1 16 10060 1 1 49 GLY HA3 H 6.517 5.841 -7.614 1.00 . A A . 49 GLY HA3 1 1 16 10061 1 1 49 GLY N N 7.013 5.107 -5.716 1.00 . A A . 49 GLY N 1 1 16 10062 1 1 49 GLY O O 6.892 3.681 -8.973 1.00 . A A . 49 GLY O 1 1 16 10063 1 1 50 GLY C C 8.894 0.902 -7.538 1.00 . A A . 50 GLY C 1 1 16 10064 1 1 50 GLY CA C 7.454 1.369 -7.407 1.00 . A A . 50 GLY CA 1 1 16 10065 1 1 50 GLY H H 7.717 2.941 -6.046 1.00 . A A . 50 GLY H 1 1 16 10066 1 1 50 GLY HA2 H 6.942 1.246 -8.359 1.00 . A A . 50 GLY HA2 1 1 16 10067 1 1 50 GLY HA3 H 6.933 0.783 -6.652 1.00 . A A . 50 GLY HA3 1 1 16 10068 1 1 50 GLY N N 7.462 2.760 -7.002 1.00 . A A . 50 GLY N 1 1 16 10069 1 1 50 GLY O O 9.541 1.290 -8.508 1.00 . A A . 50 GLY O 1 1 16 10070 1 1 51 CYS C C 11.705 -0.585 -7.255 1.00 . A A . 51 CYS C 1 1 16 10071 1 1 51 CYS CA C 10.639 -0.412 -6.165 1.00 . A A . 51 CYS CA 1 1 16 10072 1 1 51 CYS CB C 10.390 -1.727 -5.395 1.00 . A A . 51 CYS CB 1 1 16 10073 1 1 51 CYS H H 8.599 -0.193 -5.917 1.00 . A A . 51 CYS H 1 1 16 10074 1 1 51 CYS HA H 11.029 0.316 -5.453 1.00 . A A . 51 CYS HA 1 1 16 10075 1 1 51 CYS HB2 H 11.341 -2.031 -4.961 1.00 . A A . 51 CYS HB2 1 1 16 10076 1 1 51 CYS HB3 H 9.722 -1.507 -4.563 1.00 . A A . 51 CYS HB3 1 1 16 10077 1 1 51 CYS N N 9.318 0.063 -6.585 1.00 . A A . 51 CYS N 1 1 16 10078 1 1 51 CYS O O 12.350 -1.657 -7.343 1.00 . A A . 51 CYS O 1 1 16 10079 1 1 51 CYS OXT O 11.975 0.396 -7.976 1.00 . A A . 51 CYS OXT 1 1 16 10080 1 1 51 CYS SG S 9.736 -3.167 -6.329 1.00 . A A . 51 CYS SG 1 1 17 10081 1 1 1 GLY C C -8.230 -5.598 -0.911 1.00 . A A . 1 GLY C 1 1 17 10082 1 1 1 GLY CA C -7.964 -6.820 -1.765 1.00 . A A . 1 GLY CA 1 1 17 10083 1 1 1 GLY H1 H -8.902 -6.032 -3.403 1.00 . A A . 1 GLY H1 1 1 17 10084 1 1 1 GLY H2 H -7.263 -5.832 -3.403 1.00 . A A . 1 GLY H2 1 1 17 10085 1 1 1 GLY H3 H -7.901 -7.297 -3.758 1.00 . A A . 1 GLY H3 1 1 17 10086 1 1 1 GLY HA2 H -6.967 -7.197 -1.553 1.00 . A A . 1 GLY HA2 1 1 17 10087 1 1 1 GLY HA3 H -8.704 -7.584 -1.537 1.00 . A A . 1 GLY HA3 1 1 17 10088 1 1 1 GLY N N -8.018 -6.475 -3.187 1.00 . A A . 1 GLY N 1 1 17 10089 1 1 1 GLY O O -8.797 -4.615 -1.387 1.00 . A A . 1 GLY O 1 1 17 10090 1 1 2 GLU C C -7.426 -3.269 0.895 1.00 . A A . 2 GLU C 1 1 17 10091 1 1 2 GLU CA C -8.080 -4.581 1.330 1.00 . A A . 2 GLU CA 1 1 17 10092 1 1 2 GLU CB C -7.669 -4.986 2.757 1.00 . A A . 2 GLU CB 1 1 17 10093 1 1 2 GLU CD C -6.037 -6.459 4.073 1.00 . A A . 2 GLU CD 1 1 17 10094 1 1 2 GLU CG C -6.230 -5.499 2.886 1.00 . A A . 2 GLU CG 1 1 17 10095 1 1 2 GLU H H -7.337 -6.472 0.685 1.00 . A A . 2 GLU H 1 1 17 10096 1 1 2 GLU HA H -9.146 -4.415 1.366 1.00 . A A . 2 GLU HA 1 1 17 10097 1 1 2 GLU HB2 H -7.784 -4.112 3.400 1.00 . A A . 2 GLU HB2 1 1 17 10098 1 1 2 GLU HB3 H -8.353 -5.765 3.094 1.00 . A A . 2 GLU HB3 1 1 17 10099 1 1 2 GLU HG2 H -6.002 -6.021 1.966 1.00 . A A . 2 GLU HG2 1 1 17 10100 1 1 2 GLU HG3 H -5.545 -4.656 2.972 1.00 . A A . 2 GLU HG3 1 1 17 10101 1 1 2 GLU N N -7.853 -5.657 0.366 1.00 . A A . 2 GLU N 1 1 17 10102 1 1 2 GLU O O -7.981 -2.194 1.144 1.00 . A A . 2 GLU O 1 1 17 10103 1 1 2 GLU OE1 O -6.016 -5.998 5.239 1.00 . A A . 2 GLU OE1 1 1 17 10104 1 1 2 GLU OE2 O -5.920 -7.690 3.852 1.00 . A A . 2 GLU OE2 1 1 17 10105 1 1 3 CYS C C -6.090 -1.597 -1.485 1.00 . A A . 3 CYS C 1 1 17 10106 1 1 3 CYS CA C -5.534 -2.160 -0.169 1.00 . A A . 3 CYS CA 1 1 17 10107 1 1 3 CYS CB C -4.048 -2.489 -0.268 1.00 . A A . 3 CYS CB 1 1 17 10108 1 1 3 CYS H H -5.884 -4.256 0.009 1.00 . A A . 3 CYS H 1 1 17 10109 1 1 3 CYS HA H -5.647 -1.410 0.619 1.00 . A A . 3 CYS HA 1 1 17 10110 1 1 3 CYS HB2 H -3.694 -2.790 0.718 1.00 . A A . 3 CYS HB2 1 1 17 10111 1 1 3 CYS HB3 H -3.902 -3.328 -0.946 1.00 . A A . 3 CYS HB3 1 1 17 10112 1 1 3 CYS N N -6.262 -3.346 0.242 1.00 . A A . 3 CYS N 1 1 17 10113 1 1 3 CYS O O -6.157 -0.377 -1.658 1.00 . A A . 3 CYS O 1 1 17 10114 1 1 3 CYS SG S -3.060 -1.084 -0.834 1.00 . A A . 3 CYS SG 1 1 17 10115 1 1 4 GLU C C -8.575 -1.350 -3.190 1.00 . A A . 4 GLU C 1 1 17 10116 1 1 4 GLU CA C -7.256 -2.008 -3.603 1.00 . A A . 4 GLU CA 1 1 17 10117 1 1 4 GLU CB C -7.492 -3.175 -4.573 1.00 . A A . 4 GLU CB 1 1 17 10118 1 1 4 GLU CD C -6.228 -4.923 -6.003 1.00 . A A . 4 GLU CD 1 1 17 10119 1 1 4 GLU CG C -6.192 -3.561 -5.298 1.00 . A A . 4 GLU CG 1 1 17 10120 1 1 4 GLU H H -6.329 -3.450 -2.315 1.00 . A A . 4 GLU H 1 1 17 10121 1 1 4 GLU HA H -6.673 -1.248 -4.124 1.00 . A A . 4 GLU HA 1 1 17 10122 1 1 4 GLU HB2 H -7.890 -4.015 -4.010 1.00 . A A . 4 GLU HB2 1 1 17 10123 1 1 4 GLU HB3 H -8.228 -2.887 -5.324 1.00 . A A . 4 GLU HB3 1 1 17 10124 1 1 4 GLU HG2 H -5.959 -2.794 -6.037 1.00 . A A . 4 GLU HG2 1 1 17 10125 1 1 4 GLU HG3 H -5.369 -3.572 -4.587 1.00 . A A . 4 GLU HG3 1 1 17 10126 1 1 4 GLU N N -6.520 -2.455 -2.417 1.00 . A A . 4 GLU N 1 1 17 10127 1 1 4 GLU O O -8.942 -0.319 -3.750 1.00 . A A . 4 GLU O 1 1 17 10128 1 1 4 GLU OE1 O -6.911 -5.864 -5.540 1.00 . A A . 4 GLU OE1 1 1 17 10129 1 1 4 GLU OE2 O -5.465 -5.101 -6.979 1.00 . A A . 4 GLU OE2 1 1 17 10130 1 1 5 GLN C C -10.186 0.075 -1.075 1.00 . A A . 5 GLN C 1 1 17 10131 1 1 5 GLN CA C -10.492 -1.307 -1.652 1.00 . A A . 5 GLN CA 1 1 17 10132 1 1 5 GLN CB C -11.133 -2.261 -0.626 1.00 . A A . 5 GLN CB 1 1 17 10133 1 1 5 GLN CD C -12.547 -0.627 0.750 1.00 . A A . 5 GLN CD 1 1 17 10134 1 1 5 GLN CG C -12.547 -1.835 -0.188 1.00 . A A . 5 GLN CG 1 1 17 10135 1 1 5 GLN H H -8.946 -2.770 -1.794 1.00 . A A . 5 GLN H 1 1 17 10136 1 1 5 GLN HA H -11.192 -1.168 -2.478 1.00 . A A . 5 GLN HA 1 1 17 10137 1 1 5 GLN HB2 H -11.213 -3.248 -1.078 1.00 . A A . 5 GLN HB2 1 1 17 10138 1 1 5 GLN HB3 H -10.491 -2.357 0.250 1.00 . A A . 5 GLN HB3 1 1 17 10139 1 1 5 GLN HE21 H -13.895 0.430 -0.383 1.00 . A A . 5 GLN HE21 1 1 17 10140 1 1 5 GLN HE22 H -13.344 1.198 1.072 1.00 . A A . 5 GLN HE22 1 1 17 10141 1 1 5 GLN HG2 H -13.152 -1.629 -1.072 1.00 . A A . 5 GLN HG2 1 1 17 10142 1 1 5 GLN HG3 H -13.008 -2.666 0.345 1.00 . A A . 5 GLN HG3 1 1 17 10143 1 1 5 GLN N N -9.275 -1.897 -2.192 1.00 . A A . 5 GLN N 1 1 17 10144 1 1 5 GLN NE2 N -13.336 0.393 0.463 1.00 . A A . 5 GLN NE2 1 1 17 10145 1 1 5 GLN O O -10.893 1.018 -1.410 1.00 . A A . 5 GLN O 1 1 17 10146 1 1 5 GLN OE1 O -11.805 -0.596 1.727 1.00 . A A . 5 GLN OE1 1 1 17 10147 1 1 6 CYS C C -8.535 2.548 -0.777 1.00 . A A . 6 CYS C 1 1 17 10148 1 1 6 CYS CA C -8.761 1.503 0.317 1.00 . A A . 6 CYS CA 1 1 17 10149 1 1 6 CYS CB C -7.517 1.338 1.197 1.00 . A A . 6 CYS CB 1 1 17 10150 1 1 6 CYS H H -8.605 -0.610 -0.005 1.00 . A A . 6 CYS H 1 1 17 10151 1 1 6 CYS HA H -9.598 1.839 0.937 1.00 . A A . 6 CYS HA 1 1 17 10152 1 1 6 CYS HB2 H -7.684 0.471 1.830 1.00 . A A . 6 CYS HB2 1 1 17 10153 1 1 6 CYS HB3 H -6.644 1.149 0.575 1.00 . A A . 6 CYS HB3 1 1 17 10154 1 1 6 CYS N N -9.130 0.216 -0.265 1.00 . A A . 6 CYS N 1 1 17 10155 1 1 6 CYS O O -9.071 3.651 -0.702 1.00 . A A . 6 CYS O 1 1 17 10156 1 1 6 CYS SG S -7.178 2.751 2.282 1.00 . A A . 6 CYS SG 1 1 17 10157 1 1 7 PHE C C -8.969 3.428 -3.615 1.00 . A A . 7 PHE C 1 1 17 10158 1 1 7 PHE CA C -7.628 3.054 -2.996 1.00 . A A . 7 PHE CA 1 1 17 10159 1 1 7 PHE CB C -6.706 2.416 -4.033 1.00 . A A . 7 PHE CB 1 1 17 10160 1 1 7 PHE CD1 C -4.382 2.863 -3.155 1.00 . A A . 7 PHE CD1 1 1 17 10161 1 1 7 PHE CD2 C -5.193 4.170 -5.038 1.00 . A A . 7 PHE CD2 1 1 17 10162 1 1 7 PHE CE1 C -3.174 3.570 -3.207 1.00 . A A . 7 PHE CE1 1 1 17 10163 1 1 7 PHE CE2 C -3.998 4.908 -5.054 1.00 . A A . 7 PHE CE2 1 1 17 10164 1 1 7 PHE CG C -5.381 3.135 -4.104 1.00 . A A . 7 PHE CG 1 1 17 10165 1 1 7 PHE CZ C -2.974 4.588 -4.151 1.00 . A A . 7 PHE CZ 1 1 17 10166 1 1 7 PHE H H -7.397 1.255 -1.847 1.00 . A A . 7 PHE H 1 1 17 10167 1 1 7 PHE HA H -7.165 3.977 -2.661 1.00 . A A . 7 PHE HA 1 1 17 10168 1 1 7 PHE HB2 H -6.560 1.364 -3.799 1.00 . A A . 7 PHE HB2 1 1 17 10169 1 1 7 PHE HB3 H -7.171 2.459 -5.018 1.00 . A A . 7 PHE HB3 1 1 17 10170 1 1 7 PHE HD1 H -4.546 2.142 -2.366 1.00 . A A . 7 PHE HD1 1 1 17 10171 1 1 7 PHE HD2 H -5.991 4.437 -5.711 1.00 . A A . 7 PHE HD2 1 1 17 10172 1 1 7 PHE HE1 H -2.411 3.390 -2.470 1.00 . A A . 7 PHE HE1 1 1 17 10173 1 1 7 PHE HE2 H -3.875 5.741 -5.732 1.00 . A A . 7 PHE HE2 1 1 17 10174 1 1 7 PHE HZ H -2.052 5.151 -4.138 1.00 . A A . 7 PHE HZ 1 1 17 10175 1 1 7 PHE N N -7.793 2.188 -1.832 1.00 . A A . 7 PHE N 1 1 17 10176 1 1 7 PHE O O -9.196 4.605 -3.896 1.00 . A A . 7 PHE O 1 1 17 10177 1 1 8 SER C C -12.085 3.485 -3.460 1.00 . A A . 8 SER C 1 1 17 10178 1 1 8 SER CA C -11.182 2.609 -4.334 1.00 . A A . 8 SER CA 1 1 17 10179 1 1 8 SER CB C -11.806 1.231 -4.571 1.00 . A A . 8 SER CB 1 1 17 10180 1 1 8 SER H H -9.584 1.514 -3.473 1.00 . A A . 8 SER H 1 1 17 10181 1 1 8 SER HA H -11.095 3.114 -5.296 1.00 . A A . 8 SER HA 1 1 17 10182 1 1 8 SER HB2 H -12.020 0.752 -3.614 1.00 . A A . 8 SER HB2 1 1 17 10183 1 1 8 SER HB3 H -12.740 1.365 -5.110 1.00 . A A . 8 SER HB3 1 1 17 10184 1 1 8 SER HG H -10.202 0.117 -4.801 1.00 . A A . 8 SER HG 1 1 17 10185 1 1 8 SER N N -9.849 2.443 -3.780 1.00 . A A . 8 SER N 1 1 17 10186 1 1 8 SER O O -13.174 3.845 -3.913 1.00 . A A . 8 SER O 1 1 17 10187 1 1 8 SER OG O -10.955 0.410 -5.354 1.00 . A A . 8 SER OG 1 1 17 10188 1 1 9 ASP C C -11.514 6.173 -1.369 1.00 . A A . 9 ASP C 1 1 17 10189 1 1 9 ASP CA C -12.325 4.871 -1.423 1.00 . A A . 9 ASP CA 1 1 17 10190 1 1 9 ASP CB C -12.550 4.280 -0.025 1.00 . A A . 9 ASP CB 1 1 17 10191 1 1 9 ASP CG C -13.660 4.988 0.749 1.00 . A A . 9 ASP CG 1 1 17 10192 1 1 9 ASP H H -10.792 3.493 -1.889 1.00 . A A . 9 ASP H 1 1 17 10193 1 1 9 ASP HA H -13.297 5.106 -1.852 1.00 . A A . 9 ASP HA 1 1 17 10194 1 1 9 ASP HB2 H -12.820 3.225 -0.113 1.00 . A A . 9 ASP HB2 1 1 17 10195 1 1 9 ASP HB3 H -11.618 4.320 0.546 1.00 . A A . 9 ASP HB3 1 1 17 10196 1 1 9 ASP N N -11.661 3.875 -2.254 1.00 . A A . 9 ASP N 1 1 17 10197 1 1 9 ASP O O -11.495 6.880 -0.361 1.00 . A A . 9 ASP O 1 1 17 10198 1 1 9 ASP OD1 O -14.538 5.661 0.148 1.00 . A A . 9 ASP OD1 1 1 17 10199 1 1 9 ASP OD2 O -13.770 4.750 1.971 1.00 . A A . 9 ASP OD2 1 1 17 10200 1 1 10 GLY C C -8.801 7.551 -1.673 1.00 . A A . 10 GLY C 1 1 17 10201 1 1 10 GLY CA C -10.001 7.685 -2.604 1.00 . A A . 10 GLY CA 1 1 17 10202 1 1 10 GLY H H -10.861 5.864 -3.251 1.00 . A A . 10 GLY H 1 1 17 10203 1 1 10 GLY HA2 H -10.533 8.594 -2.359 1.00 . A A . 10 GLY HA2 1 1 17 10204 1 1 10 GLY HA3 H -9.641 7.766 -3.628 1.00 . A A . 10 GLY HA3 1 1 17 10205 1 1 10 GLY N N -10.891 6.537 -2.495 1.00 . A A . 10 GLY N 1 1 17 10206 1 1 10 GLY O O -8.448 8.492 -0.958 1.00 . A A . 10 GLY O 1 1 17 10207 1 1 11 GLY C C -5.796 6.903 -1.655 1.00 . A A . 11 GLY C 1 1 17 10208 1 1 11 GLY CA C -6.933 6.157 -0.968 1.00 . A A . 11 GLY CA 1 1 17 10209 1 1 11 GLY H H -8.548 5.635 -2.248 1.00 . A A . 11 GLY H 1 1 17 10210 1 1 11 GLY HA2 H -6.705 5.094 -0.965 1.00 . A A . 11 GLY HA2 1 1 17 10211 1 1 11 GLY HA3 H -7.049 6.474 0.060 1.00 . A A . 11 GLY HA3 1 1 17 10212 1 1 11 GLY N N -8.178 6.378 -1.671 1.00 . A A . 11 GLY N 1 1 17 10213 1 1 11 GLY O O -5.830 7.089 -2.878 1.00 . A A . 11 GLY O 1 1 17 10214 1 1 12 ASP C C -2.507 6.554 -0.718 1.00 . A A . 12 ASP C 1 1 17 10215 1 1 12 ASP CA C -3.435 7.517 -1.457 1.00 . A A . 12 ASP CA 1 1 17 10216 1 1 12 ASP CB C -2.946 8.992 -1.361 1.00 . A A . 12 ASP CB 1 1 17 10217 1 1 12 ASP CG C -3.321 9.789 -0.098 1.00 . A A . 12 ASP CG 1 1 17 10218 1 1 12 ASP H H -4.831 7.146 0.103 1.00 . A A . 12 ASP H 1 1 17 10219 1 1 12 ASP HA H -3.426 7.201 -2.508 1.00 . A A . 12 ASP HA 1 1 17 10220 1 1 12 ASP HB2 H -1.861 9.024 -1.489 1.00 . A A . 12 ASP HB2 1 1 17 10221 1 1 12 ASP HB3 H -3.374 9.528 -2.206 1.00 . A A . 12 ASP HB3 1 1 17 10222 1 1 12 ASP N N -4.763 7.284 -0.898 1.00 . A A . 12 ASP N 1 1 17 10223 1 1 12 ASP O O -2.470 5.377 -1.037 1.00 . A A . 12 ASP O 1 1 17 10224 1 1 12 ASP OD1 O -2.829 9.467 1.012 1.00 . A A . 12 ASP OD1 1 1 17 10225 1 1 12 ASP OD2 O -4.079 10.782 -0.195 1.00 . A A . 12 ASP OD2 1 1 17 10226 1 1 13 CYS C C -1.135 6.574 2.561 1.00 . A A . 13 CYS C 1 1 17 10227 1 1 13 CYS CA C -0.881 6.237 1.106 1.00 . A A . 13 CYS CA 1 1 17 10228 1 1 13 CYS CB C 0.550 6.605 0.699 1.00 . A A . 13 CYS CB 1 1 17 10229 1 1 13 CYS H H -1.992 7.966 0.602 1.00 . A A . 13 CYS H 1 1 17 10230 1 1 13 CYS HA H -1.041 5.176 0.941 1.00 . A A . 13 CYS HA 1 1 17 10231 1 1 13 CYS HB2 H 0.760 7.611 1.047 1.00 . A A . 13 CYS HB2 1 1 17 10232 1 1 13 CYS HB3 H 1.238 5.931 1.215 1.00 . A A . 13 CYS HB3 1 1 17 10233 1 1 13 CYS N N -1.832 7.003 0.331 1.00 . A A . 13 CYS N 1 1 17 10234 1 1 13 CYS O O -1.399 5.701 3.379 1.00 . A A . 13 CYS O 1 1 17 10235 1 1 13 CYS SG S 0.886 6.558 -1.078 1.00 . A A . 13 CYS SG 1 1 17 10236 1 1 14 THR C C -2.723 8.314 4.672 1.00 . A A . 14 THR C 1 1 17 10237 1 1 14 THR CA C -1.256 8.368 4.222 1.00 . A A . 14 THR CA 1 1 17 10238 1 1 14 THR CB C -0.658 9.774 4.250 1.00 . A A . 14 THR CB 1 1 17 10239 1 1 14 THR CG2 C -0.557 10.316 5.664 1.00 . A A . 14 THR CG2 1 1 17 10240 1 1 14 THR H H -0.949 8.552 2.145 1.00 . A A . 14 THR H 1 1 17 10241 1 1 14 THR HA H -0.682 7.731 4.900 1.00 . A A . 14 THR HA 1 1 17 10242 1 1 14 THR HB H -1.259 10.434 3.626 1.00 . A A . 14 THR HB 1 1 17 10243 1 1 14 THR HG1 H 0.643 9.789 2.791 1.00 . A A . 14 THR HG1 1 1 17 10244 1 1 14 THR HG21 H -0.011 9.612 6.286 1.00 . A A . 14 THR HG21 1 1 17 10245 1 1 14 THR HG22 H -0.043 11.273 5.660 1.00 . A A . 14 THR HG22 1 1 17 10246 1 1 14 THR HG23 H -1.557 10.452 6.070 1.00 . A A . 14 THR HG23 1 1 17 10247 1 1 14 THR N N -1.099 7.865 2.875 1.00 . A A . 14 THR N 1 1 17 10248 1 1 14 THR O O -2.990 8.292 5.873 1.00 . A A . 14 THR O 1 1 17 10249 1 1 14 THR OG1 O 0.670 9.733 3.769 1.00 . A A . 14 THR OG1 1 1 17 10250 1 1 15 THR C C -5.273 6.310 3.816 1.00 . A A . 15 THR C 1 1 17 10251 1 1 15 THR CA C -5.052 7.812 4.111 1.00 . A A . 15 THR CA 1 1 17 10252 1 1 15 THR CB C -5.983 8.784 3.339 1.00 . A A . 15 THR CB 1 1 17 10253 1 1 15 THR CG2 C -6.032 8.545 1.838 1.00 . A A . 15 THR CG2 1 1 17 10254 1 1 15 THR H H -3.447 8.368 2.785 1.00 . A A . 15 THR H 1 1 17 10255 1 1 15 THR HA H -5.221 7.971 5.174 1.00 . A A . 15 THR HA 1 1 17 10256 1 1 15 THR HB H -5.591 9.787 3.474 1.00 . A A . 15 THR HB 1 1 17 10257 1 1 15 THR HG1 H -7.337 8.656 4.738 1.00 . A A . 15 THR HG1 1 1 17 10258 1 1 15 THR HG21 H -5.029 8.421 1.455 1.00 . A A . 15 THR HG21 1 1 17 10259 1 1 15 THR HG22 H -6.608 7.646 1.648 1.00 . A A . 15 THR HG22 1 1 17 10260 1 1 15 THR HG23 H -6.507 9.389 1.338 1.00 . A A . 15 THR HG23 1 1 17 10261 1 1 15 THR N N -3.683 8.189 3.753 1.00 . A A . 15 THR N 1 1 17 10262 1 1 15 THR O O -6.395 5.884 3.563 1.00 . A A . 15 THR O 1 1 17 10263 1 1 15 THR OG1 O -7.324 8.789 3.769 1.00 . A A . 15 THR OG1 1 1 17 10264 1 1 16 CYS C C -3.084 3.352 4.557 1.00 . A A . 16 CYS C 1 1 17 10265 1 1 16 CYS CA C -4.273 4.014 3.828 1.00 . A A . 16 CYS CA 1 1 17 10266 1 1 16 CYS CB C -4.239 3.643 2.321 1.00 . A A . 16 CYS CB 1 1 17 10267 1 1 16 CYS H H -3.341 5.857 4.217 1.00 . A A . 16 CYS H 1 1 17 10268 1 1 16 CYS HA H -5.184 3.606 4.274 1.00 . A A . 16 CYS HA 1 1 17 10269 1 1 16 CYS HB2 H -3.434 4.204 1.842 1.00 . A A . 16 CYS HB2 1 1 17 10270 1 1 16 CYS HB3 H -4.008 2.582 2.228 1.00 . A A . 16 CYS HB3 1 1 17 10271 1 1 16 CYS N N -4.249 5.468 4.008 1.00 . A A . 16 CYS N 1 1 17 10272 1 1 16 CYS O O -2.712 2.243 4.171 1.00 . A A . 16 CYS O 1 1 17 10273 1 1 16 CYS SG S -5.754 3.886 1.353 1.00 . A A . 16 CYS SG 1 1 17 10274 1 1 17 PHE C C -1.629 3.171 7.786 1.00 . A A . 17 PHE C 1 1 17 10275 1 1 17 PHE CA C -1.320 3.383 6.301 1.00 . A A . 17 PHE CA 1 1 17 10276 1 1 17 PHE CB C 0.011 4.110 6.040 1.00 . A A . 17 PHE CB 1 1 17 10277 1 1 17 PHE CD1 C 1.497 2.066 6.400 1.00 . A A . 17 PHE CD1 1 1 17 10278 1 1 17 PHE CD2 C 2.100 4.153 7.491 1.00 . A A . 17 PHE CD2 1 1 17 10279 1 1 17 PHE CE1 C 2.602 1.419 6.987 1.00 . A A . 17 PHE CE1 1 1 17 10280 1 1 17 PHE CE2 C 3.218 3.516 8.060 1.00 . A A . 17 PHE CE2 1 1 17 10281 1 1 17 PHE CG C 1.229 3.429 6.656 1.00 . A A . 17 PHE CG 1 1 17 10282 1 1 17 PHE CZ C 3.471 2.154 7.807 1.00 . A A . 17 PHE CZ 1 1 17 10283 1 1 17 PHE H H -2.788 4.875 5.880 1.00 . A A . 17 PHE H 1 1 17 10284 1 1 17 PHE HA H -1.129 2.405 5.903 1.00 . A A . 17 PHE HA 1 1 17 10285 1 1 17 PHE HB2 H 0.175 4.163 4.963 1.00 . A A . 17 PHE HB2 1 1 17 10286 1 1 17 PHE HB3 H -0.050 5.131 6.402 1.00 . A A . 17 PHE HB3 1 1 17 10287 1 1 17 PHE HD1 H 0.842 1.506 5.753 1.00 . A A . 17 PHE HD1 1 1 17 10288 1 1 17 PHE HD2 H 1.911 5.197 7.716 1.00 . A A . 17 PHE HD2 1 1 17 10289 1 1 17 PHE HE1 H 2.807 0.364 6.808 1.00 . A A . 17 PHE HE1 1 1 17 10290 1 1 17 PHE HE2 H 3.879 4.078 8.699 1.00 . A A . 17 PHE HE2 1 1 17 10291 1 1 17 PHE HZ H 4.325 1.656 8.241 1.00 . A A . 17 PHE HZ 1 1 17 10292 1 1 17 PHE N N -2.448 3.978 5.563 1.00 . A A . 17 PHE N 1 1 17 10293 1 1 17 PHE O O -1.140 2.202 8.380 1.00 . A A . 17 PHE O 1 1 17 10294 1 1 18 ASN C C -1.454 4.110 10.685 1.00 . A A . 18 ASN C 1 1 17 10295 1 1 18 ASN CA C -2.734 4.062 9.835 1.00 . A A . 18 ASN CA 1 1 17 10296 1 1 18 ASN CB C -3.585 2.848 10.208 1.00 . A A . 18 ASN CB 1 1 17 10297 1 1 18 ASN CG C -4.560 3.155 11.340 1.00 . A A . 18 ASN CG 1 1 17 10298 1 1 18 ASN H H -2.738 4.853 7.869 1.00 . A A . 18 ASN H 1 1 17 10299 1 1 18 ASN HA H -3.310 4.964 10.041 1.00 . A A . 18 ASN HA 1 1 17 10300 1 1 18 ASN HB2 H -4.166 2.518 9.346 1.00 . A A . 18 ASN HB2 1 1 17 10301 1 1 18 ASN HB3 H -2.889 2.056 10.477 1.00 . A A . 18 ASN HB3 1 1 17 10302 1 1 18 ASN HD21 H -3.183 2.992 12.861 1.00 . A A . 18 ASN HD21 1 1 17 10303 1 1 18 ASN HD22 H -4.824 3.317 13.324 1.00 . A A . 18 ASN HD22 1 1 17 10304 1 1 18 ASN N N -2.450 4.034 8.396 1.00 . A A . 18 ASN N 1 1 17 10305 1 1 18 ASN ND2 N -4.142 3.180 12.591 1.00 . A A . 18 ASN ND2 1 1 17 10306 1 1 18 ASN O O -1.427 3.642 11.826 1.00 . A A . 18 ASN O 1 1 17 10307 1 1 18 ASN OD1 O -5.740 3.369 11.086 1.00 . A A . 18 ASN OD1 1 1 17 10308 1 1 19 ASN C C 1.509 3.105 10.978 1.00 . A A . 19 ASN C 1 1 17 10309 1 1 19 ASN CA C 0.995 4.521 10.675 1.00 . A A . 19 ASN CA 1 1 17 10310 1 1 19 ASN CB C 1.171 5.539 11.806 1.00 . A A . 19 ASN CB 1 1 17 10311 1 1 19 ASN CG C 2.626 5.748 12.185 1.00 . A A . 19 ASN CG 1 1 17 10312 1 1 19 ASN H H -0.448 5.006 9.199 1.00 . A A . 19 ASN H 1 1 17 10313 1 1 19 ASN HA H 1.610 4.865 9.867 1.00 . A A . 19 ASN HA 1 1 17 10314 1 1 19 ASN HB2 H 0.788 6.488 11.437 1.00 . A A . 19 ASN HB2 1 1 17 10315 1 1 19 ASN HB3 H 0.599 5.226 12.677 1.00 . A A . 19 ASN HB3 1 1 17 10316 1 1 19 ASN HD21 H 2.332 5.205 14.120 1.00 . A A . 19 ASN HD21 1 1 17 10317 1 1 19 ASN HD22 H 3.974 5.629 13.704 1.00 . A A . 19 ASN HD22 1 1 17 10318 1 1 19 ASN N N -0.351 4.596 10.121 1.00 . A A . 19 ASN N 1 1 17 10319 1 1 19 ASN ND2 N 3.000 5.515 13.431 1.00 . A A . 19 ASN ND2 1 1 17 10320 1 1 19 ASN O O 2.385 2.932 11.830 1.00 . A A . 19 ASN O 1 1 17 10321 1 1 19 ASN OD1 O 3.427 6.143 11.338 1.00 . A A . 19 ASN OD1 1 1 17 10322 1 1 20 GLY C C 0.584 -0.327 10.719 1.00 . A A . 20 GLY C 1 1 17 10323 1 1 20 GLY CA C 1.559 0.747 10.255 1.00 . A A . 20 GLY CA 1 1 17 10324 1 1 20 GLY H H 0.349 2.272 9.530 1.00 . A A . 20 GLY H 1 1 17 10325 1 1 20 GLY HA2 H 2.449 0.726 10.863 1.00 . A A . 20 GLY HA2 1 1 17 10326 1 1 20 GLY HA3 H 1.857 0.491 9.244 1.00 . A A . 20 GLY HA3 1 1 17 10327 1 1 20 GLY N N 1.021 2.094 10.255 1.00 . A A . 20 GLY N 1 1 17 10328 1 1 20 GLY O O 1.036 -1.332 11.266 1.00 . A A . 20 GLY O 1 1 17 10329 1 1 21 THR C C -2.945 -1.156 9.867 1.00 . A A . 21 THR C 1 1 17 10330 1 1 21 THR CA C -1.710 -1.192 10.795 1.00 . A A . 21 THR CA 1 1 17 10331 1 1 21 THR CB C -1.992 -1.224 12.305 1.00 . A A . 21 THR CB 1 1 17 10332 1 1 21 THR CG2 C -2.947 -0.115 12.675 1.00 . A A . 21 THR CG2 1 1 17 10333 1 1 21 THR H H -1.036 0.706 10.066 1.00 . A A . 21 THR H 1 1 17 10334 1 1 21 THR HA H -1.238 -2.130 10.613 1.00 . A A . 21 THR HA 1 1 17 10335 1 1 21 THR HB H -1.059 -1.079 12.849 1.00 . A A . 21 THR HB 1 1 17 10336 1 1 21 THR HG1 H -2.206 -2.613 13.635 1.00 . A A . 21 THR HG1 1 1 17 10337 1 1 21 THR HG21 H -2.531 0.810 12.303 1.00 . A A . 21 THR HG21 1 1 17 10338 1 1 21 THR HG22 H -3.907 -0.301 12.202 1.00 . A A . 21 THR HG22 1 1 17 10339 1 1 21 THR HG23 H -3.048 -0.068 13.754 1.00 . A A . 21 THR HG23 1 1 17 10340 1 1 21 THR N N -0.723 -0.148 10.502 1.00 . A A . 21 THR N 1 1 17 10341 1 1 21 THR O O -3.899 -1.918 10.063 1.00 . A A . 21 THR O 1 1 17 10342 1 1 21 THR OG1 O -2.532 -2.462 12.719 1.00 . A A . 21 THR OG1 1 1 17 10343 1 1 22 GLY C C -3.914 -1.366 6.851 1.00 . A A . 22 GLY C 1 1 17 10344 1 1 22 GLY CA C -4.011 -0.208 7.863 1.00 . A A . 22 GLY CA 1 1 17 10345 1 1 22 GLY H H -2.125 0.257 8.636 1.00 . A A . 22 GLY H 1 1 17 10346 1 1 22 GLY HA2 H -3.918 0.747 7.347 1.00 . A A . 22 GLY HA2 1 1 17 10347 1 1 22 GLY HA3 H -4.988 -0.242 8.345 1.00 . A A . 22 GLY HA3 1 1 17 10348 1 1 22 GLY N N -2.954 -0.278 8.860 1.00 . A A . 22 GLY N 1 1 17 10349 1 1 22 GLY O O -3.279 -2.390 7.127 1.00 . A A . 22 GLY O 1 1 17 10350 1 1 23 PRO C C -3.321 -2.589 4.018 1.00 . A A . 23 PRO C 1 1 17 10351 1 1 23 PRO CA C -4.662 -2.310 4.707 1.00 . A A . 23 PRO CA 1 1 17 10352 1 1 23 PRO CB C -5.757 -1.844 3.748 1.00 . A A . 23 PRO CB 1 1 17 10353 1 1 23 PRO CD C -5.179 -0.007 5.194 1.00 . A A . 23 PRO CD 1 1 17 10354 1 1 23 PRO CG C -5.705 -0.317 3.801 1.00 . A A . 23 PRO CG 1 1 17 10355 1 1 23 PRO HA H -4.985 -3.221 5.210 1.00 . A A . 23 PRO HA 1 1 17 10356 1 1 23 PRO HB2 H -5.584 -2.216 2.741 1.00 . A A . 23 PRO HB2 1 1 17 10357 1 1 23 PRO HB3 H -6.724 -2.182 4.125 1.00 . A A . 23 PRO HB3 1 1 17 10358 1 1 23 PRO HD2 H -4.458 0.802 5.136 1.00 . A A . 23 PRO HD2 1 1 17 10359 1 1 23 PRO HD3 H -5.995 0.312 5.841 1.00 . A A . 23 PRO HD3 1 1 17 10360 1 1 23 PRO HG2 H -5.022 0.071 3.043 1.00 . A A . 23 PRO HG2 1 1 17 10361 1 1 23 PRO HG3 H -6.695 0.106 3.684 1.00 . A A . 23 PRO HG3 1 1 17 10362 1 1 23 PRO N N -4.552 -1.232 5.677 1.00 . A A . 23 PRO N 1 1 17 10363 1 1 23 PRO O O -2.816 -3.710 4.060 1.00 . A A . 23 PRO O 1 1 17 10364 1 1 24 CYS C C -0.404 -1.203 3.884 1.00 . A A . 24 CYS C 1 1 17 10365 1 1 24 CYS CA C -1.395 -1.621 2.796 1.00 . A A . 24 CYS CA 1 1 17 10366 1 1 24 CYS CB C -1.351 -0.658 1.593 1.00 . A A . 24 CYS CB 1 1 17 10367 1 1 24 CYS H H -3.154 -0.668 3.474 1.00 . A A . 24 CYS H 1 1 17 10368 1 1 24 CYS HA H -1.159 -2.633 2.460 1.00 . A A . 24 CYS HA 1 1 17 10369 1 1 24 CYS HB2 H -2.224 -0.001 1.602 1.00 . A A . 24 CYS HB2 1 1 17 10370 1 1 24 CYS HB3 H -0.472 -0.021 1.666 1.00 . A A . 24 CYS HB3 1 1 17 10371 1 1 24 CYS N N -2.726 -1.577 3.383 1.00 . A A . 24 CYS N 1 1 17 10372 1 1 24 CYS O O -0.037 -0.032 3.958 1.00 . A A . 24 CYS O 1 1 17 10373 1 1 24 CYS SG S -1.242 -1.432 -0.026 1.00 . A A . 24 CYS SG 1 1 17 10374 1 1 25 ALA C C 2.093 -2.606 5.937 1.00 . A A . 25 ALA C 1 1 17 10375 1 1 25 ALA CA C 0.853 -1.734 5.927 1.00 . A A . 25 ALA CA 1 1 17 10376 1 1 25 ALA CB C 0.135 -1.754 7.275 1.00 . A A . 25 ALA CB 1 1 17 10377 1 1 25 ALA H H -0.410 -3.029 4.771 1.00 . A A . 25 ALA H 1 1 17 10378 1 1 25 ALA HA H 1.203 -0.716 5.789 1.00 . A A . 25 ALA HA 1 1 17 10379 1 1 25 ALA HB1 H 0.873 -1.679 8.073 1.00 . A A . 25 ALA HB1 1 1 17 10380 1 1 25 ALA HB2 H -0.432 -2.676 7.393 1.00 . A A . 25 ALA HB2 1 1 17 10381 1 1 25 ALA HB3 H -0.536 -0.899 7.352 1.00 . A A . 25 ALA HB3 1 1 17 10382 1 1 25 ALA N N -0.041 -2.083 4.821 1.00 . A A . 25 ALA N 1 1 17 10383 1 1 25 ALA O O 3.206 -2.077 6.036 1.00 . A A . 25 ALA O 1 1 17 10384 1 1 26 ASN C C 3.791 -4.557 4.322 1.00 . A A . 26 ASN C 1 1 17 10385 1 1 26 ASN CA C 3.107 -4.793 5.667 1.00 . A A . 26 ASN CA 1 1 17 10386 1 1 26 ASN CB C 2.732 -6.279 5.780 1.00 . A A . 26 ASN CB 1 1 17 10387 1 1 26 ASN CG C 2.331 -6.690 7.189 1.00 . A A . 26 ASN CG 1 1 17 10388 1 1 26 ASN H H 1.008 -4.328 5.715 1.00 . A A . 26 ASN H 1 1 17 10389 1 1 26 ASN HA H 3.806 -4.510 6.457 1.00 . A A . 26 ASN HA 1 1 17 10390 1 1 26 ASN HB2 H 1.921 -6.515 5.088 1.00 . A A . 26 ASN HB2 1 1 17 10391 1 1 26 ASN HB3 H 3.602 -6.865 5.484 1.00 . A A . 26 ASN HB3 1 1 17 10392 1 1 26 ASN HD21 H 3.575 -8.303 7.192 1.00 . A A . 26 ASN HD21 1 1 17 10393 1 1 26 ASN HD22 H 2.644 -8.026 8.651 1.00 . A A . 26 ASN HD22 1 1 17 10394 1 1 26 ASN N N 1.941 -3.924 5.805 1.00 . A A . 26 ASN N 1 1 17 10395 1 1 26 ASN ND2 N 2.934 -7.729 7.732 1.00 . A A . 26 ASN ND2 1 1 17 10396 1 1 26 ASN O O 4.978 -4.851 4.163 1.00 . A A . 26 ASN O 1 1 17 10397 1 1 26 ASN OD1 O 1.473 -6.077 7.811 1.00 . A A . 26 ASN OD1 1 1 17 10398 1 1 27 CYS C C 4.574 -2.435 2.134 1.00 . A A . 27 CYS C 1 1 17 10399 1 1 27 CYS CA C 3.557 -3.584 2.060 1.00 . A A . 27 CYS CA 1 1 17 10400 1 1 27 CYS CB C 2.381 -3.313 1.103 1.00 . A A . 27 CYS CB 1 1 17 10401 1 1 27 CYS H H 2.063 -3.856 3.542 1.00 . A A . 27 CYS H 1 1 17 10402 1 1 27 CYS HA H 4.085 -4.431 1.624 1.00 . A A . 27 CYS HA 1 1 17 10403 1 1 27 CYS HB2 H 1.865 -2.375 1.320 1.00 . A A . 27 CYS HB2 1 1 17 10404 1 1 27 CYS HB3 H 2.802 -3.211 0.101 1.00 . A A . 27 CYS HB3 1 1 17 10405 1 1 27 CYS N N 3.051 -3.990 3.363 1.00 . A A . 27 CYS N 1 1 17 10406 1 1 27 CYS O O 5.075 -2.055 1.085 1.00 . A A . 27 CYS O 1 1 17 10407 1 1 27 CYS SG S 1.240 -4.738 1.120 1.00 . A A . 27 CYS SG 1 1 17 10408 1 1 28 LEU C C 7.132 -1.140 3.986 1.00 . A A . 28 LEU C 1 1 17 10409 1 1 28 LEU CA C 5.776 -0.723 3.448 1.00 . A A . 28 LEU CA 1 1 17 10410 1 1 28 LEU CB C 5.155 0.289 4.414 1.00 . A A . 28 LEU CB 1 1 17 10411 1 1 28 LEU CD1 C 4.576 2.109 2.775 1.00 . A A . 28 LEU CD1 1 1 17 10412 1 1 28 LEU CD2 C 2.937 0.312 3.113 1.00 . A A . 28 LEU CD2 1 1 17 10413 1 1 28 LEU CG C 4.035 1.119 3.795 1.00 . A A . 28 LEU CG 1 1 17 10414 1 1 28 LEU H H 4.250 -1.973 4.110 1.00 . A A . 28 LEU H 1 1 17 10415 1 1 28 LEU HA H 5.935 -0.252 2.477 1.00 . A A . 28 LEU HA 1 1 17 10416 1 1 28 LEU HB2 H 4.763 -0.227 5.292 1.00 . A A . 28 LEU HB2 1 1 17 10417 1 1 28 LEU HB3 H 5.935 0.971 4.762 1.00 . A A . 28 LEU HB3 1 1 17 10418 1 1 28 LEU HD11 H 5.540 2.505 3.091 1.00 . A A . 28 LEU HD11 1 1 17 10419 1 1 28 LEU HD12 H 4.703 1.573 1.843 1.00 . A A . 28 LEU HD12 1 1 17 10420 1 1 28 LEU HD13 H 3.871 2.925 2.630 1.00 . A A . 28 LEU HD13 1 1 17 10421 1 1 28 LEU HD21 H 2.629 -0.501 3.762 1.00 . A A . 28 LEU HD21 1 1 17 10422 1 1 28 LEU HD22 H 2.084 0.957 2.954 1.00 . A A . 28 LEU HD22 1 1 17 10423 1 1 28 LEU HD23 H 3.291 -0.065 2.148 1.00 . A A . 28 LEU HD23 1 1 17 10424 1 1 28 LEU HG H 3.584 1.636 4.617 1.00 . A A . 28 LEU HG 1 1 17 10425 1 1 28 LEU N N 4.870 -1.858 3.314 1.00 . A A . 28 LEU N 1 1 17 10426 1 1 28 LEU O O 8.148 -0.846 3.357 1.00 . A A . 28 LEU O 1 1 17 10427 1 1 29 ALA C C 9.296 -2.866 5.238 1.00 . A A . 29 ALA C 1 1 17 10428 1 1 29 ALA CA C 8.337 -1.940 5.984 1.00 . A A . 29 ALA CA 1 1 17 10429 1 1 29 ALA CB C 7.940 -2.489 7.363 1.00 . A A . 29 ALA CB 1 1 17 10430 1 1 29 ALA H H 6.247 -1.937 5.615 1.00 . A A . 29 ALA H 1 1 17 10431 1 1 29 ALA HA H 8.836 -0.978 6.130 1.00 . A A . 29 ALA HA 1 1 17 10432 1 1 29 ALA HB1 H 8.842 -2.692 7.941 1.00 . A A . 29 ALA HB1 1 1 17 10433 1 1 29 ALA HB2 H 7.361 -3.410 7.264 1.00 . A A . 29 ALA HB2 1 1 17 10434 1 1 29 ALA HB3 H 7.342 -1.747 7.897 1.00 . A A . 29 ALA HB3 1 1 17 10435 1 1 29 ALA N N 7.137 -1.741 5.183 1.00 . A A . 29 ALA N 1 1 17 10436 1 1 29 ALA O O 10.295 -2.423 4.675 1.00 . A A . 29 ALA O 1 1 17 10437 1 1 30 GLY C C 9.069 -5.404 3.168 1.00 . A A . 30 GLY C 1 1 17 10438 1 1 30 GLY CA C 9.734 -5.144 4.491 1.00 . A A . 30 GLY CA 1 1 17 10439 1 1 30 GLY H H 8.091 -4.439 5.620 1.00 . A A . 30 GLY H 1 1 17 10440 1 1 30 GLY HA2 H 9.773 -6.059 5.079 1.00 . A A . 30 GLY HA2 1 1 17 10441 1 1 30 GLY HA3 H 10.745 -4.792 4.313 1.00 . A A . 30 GLY HA3 1 1 17 10442 1 1 30 GLY N N 8.956 -4.151 5.191 1.00 . A A . 30 GLY N 1 1 17 10443 1 1 30 GLY O O 8.443 -6.452 3.028 1.00 . A A . 30 GLY O 1 1 17 10444 1 1 31 TYR C C 9.348 -4.877 -0.312 1.00 . A A . 31 TYR C 1 1 17 10445 1 1 31 TYR CA C 8.478 -4.619 0.938 1.00 . A A . 31 TYR CA 1 1 17 10446 1 1 31 TYR CB C 7.748 -3.272 0.776 1.00 . A A . 31 TYR CB 1 1 17 10447 1 1 31 TYR CD1 C 9.945 -1.993 0.360 1.00 . A A . 31 TYR CD1 1 1 17 10448 1 1 31 TYR CD2 C 7.875 -1.185 -0.597 1.00 . A A . 31 TYR CD2 1 1 17 10449 1 1 31 TYR CE1 C 10.630 -0.918 -0.232 1.00 . A A . 31 TYR CE1 1 1 17 10450 1 1 31 TYR CE2 C 8.549 -0.132 -1.234 1.00 . A A . 31 TYR CE2 1 1 17 10451 1 1 31 TYR CG C 8.549 -2.104 0.214 1.00 . A A . 31 TYR CG 1 1 17 10452 1 1 31 TYR CZ C 9.942 0.011 -1.041 1.00 . A A . 31 TYR CZ 1 1 17 10453 1 1 31 TYR H H 9.678 -3.617 2.404 1.00 . A A . 31 TYR H 1 1 17 10454 1 1 31 TYR HA H 7.741 -5.403 0.976 1.00 . A A . 31 TYR HA 1 1 17 10455 1 1 31 TYR HB2 H 6.940 -3.479 0.080 1.00 . A A . 31 TYR HB2 1 1 17 10456 1 1 31 TYR HB3 H 7.295 -2.915 1.709 1.00 . A A . 31 TYR HB3 1 1 17 10457 1 1 31 TYR HD1 H 10.504 -2.774 0.853 1.00 . A A . 31 TYR HD1 1 1 17 10458 1 1 31 TYR HD2 H 6.824 -1.341 -0.740 1.00 . A A . 31 TYR HD2 1 1 17 10459 1 1 31 TYR HE1 H 11.695 -0.839 -0.113 1.00 . A A . 31 TYR HE1 1 1 17 10460 1 1 31 TYR HE2 H 7.978 0.543 -1.872 1.00 . A A . 31 TYR HE2 1 1 17 10461 1 1 31 TYR HH H 10.096 1.478 -2.282 1.00 . A A . 31 TYR HH 1 1 17 10462 1 1 31 TYR N N 9.187 -4.481 2.209 1.00 . A A . 31 TYR N 1 1 17 10463 1 1 31 TYR O O 8.997 -4.412 -1.399 1.00 . A A . 31 TYR O 1 1 17 10464 1 1 31 TYR OH O 10.651 0.995 -1.661 1.00 . A A . 31 TYR OH 1 1 17 10465 1 1 32 PRO C C 10.526 -6.691 -2.640 1.00 . A A . 32 PRO C 1 1 17 10466 1 1 32 PRO CA C 11.188 -5.971 -1.455 1.00 . A A . 32 PRO CA 1 1 17 10467 1 1 32 PRO CB C 12.413 -6.716 -0.918 1.00 . A A . 32 PRO CB 1 1 17 10468 1 1 32 PRO CD C 10.720 -6.679 0.774 1.00 . A A . 32 PRO CD 1 1 17 10469 1 1 32 PRO CG C 11.833 -7.558 0.214 1.00 . A A . 32 PRO CG 1 1 17 10470 1 1 32 PRO HA H 11.477 -4.962 -1.752 1.00 . A A . 32 PRO HA 1 1 17 10471 1 1 32 PRO HB2 H 12.899 -7.327 -1.681 1.00 . A A . 32 PRO HB2 1 1 17 10472 1 1 32 PRO HB3 H 13.119 -5.993 -0.507 1.00 . A A . 32 PRO HB3 1 1 17 10473 1 1 32 PRO HD2 H 9.891 -7.281 1.140 1.00 . A A . 32 PRO HD2 1 1 17 10474 1 1 32 PRO HD3 H 11.129 -6.053 1.564 1.00 . A A . 32 PRO HD3 1 1 17 10475 1 1 32 PRO HG2 H 11.412 -8.473 -0.195 1.00 . A A . 32 PRO HG2 1 1 17 10476 1 1 32 PRO HG3 H 12.583 -7.782 0.969 1.00 . A A . 32 PRO HG3 1 1 17 10477 1 1 32 PRO N N 10.281 -5.842 -0.319 1.00 . A A . 32 PRO N 1 1 17 10478 1 1 32 PRO O O 11.116 -6.808 -3.716 1.00 . A A . 32 PRO O 1 1 17 10479 1 1 33 ALA C C 7.117 -7.181 -3.557 1.00 . A A . 33 ALA C 1 1 17 10480 1 1 33 ALA CA C 8.465 -7.887 -3.399 1.00 . A A . 33 ALA CA 1 1 17 10481 1 1 33 ALA CB C 8.250 -9.319 -2.918 1.00 . A A . 33 ALA CB 1 1 17 10482 1 1 33 ALA H H 8.908 -7.072 -1.522 1.00 . A A . 33 ALA H 1 1 17 10483 1 1 33 ALA HA H 8.953 -7.912 -4.377 1.00 . A A . 33 ALA HA 1 1 17 10484 1 1 33 ALA HB1 H 7.602 -9.853 -3.612 1.00 . A A . 33 ALA HB1 1 1 17 10485 1 1 33 ALA HB2 H 9.201 -9.840 -2.850 1.00 . A A . 33 ALA HB2 1 1 17 10486 1 1 33 ALA HB3 H 7.777 -9.288 -1.936 1.00 . A A . 33 ALA HB3 1 1 17 10487 1 1 33 ALA N N 9.314 -7.211 -2.437 1.00 . A A . 33 ALA N 1 1 17 10488 1 1 33 ALA O O 6.269 -7.674 -4.299 1.00 . A A . 33 ALA O 1 1 17 10489 1 1 34 GLY C C 5.042 -5.027 -4.197 1.00 . A A . 34 GLY C 1 1 17 10490 1 1 34 GLY CA C 5.525 -5.486 -2.822 1.00 . A A . 34 GLY CA 1 1 17 10491 1 1 34 GLY H H 7.595 -5.612 -2.323 1.00 . A A . 34 GLY H 1 1 17 10492 1 1 34 GLY HA2 H 5.501 -4.650 -2.124 1.00 . A A . 34 GLY HA2 1 1 17 10493 1 1 34 GLY HA3 H 4.844 -6.258 -2.476 1.00 . A A . 34 GLY HA3 1 1 17 10494 1 1 34 GLY N N 6.865 -6.065 -2.859 1.00 . A A . 34 GLY N 1 1 17 10495 1 1 34 GLY O O 3.854 -5.091 -4.502 1.00 . A A . 34 GLY O 1 1 17 10496 1 1 35 CYS C C 5.227 -5.455 -7.305 1.00 . A A . 35 CYS C 1 1 17 10497 1 1 35 CYS CA C 5.831 -4.323 -6.461 1.00 . A A . 35 CYS CA 1 1 17 10498 1 1 35 CYS CB C 7.232 -4.038 -7.003 1.00 . A A . 35 CYS CB 1 1 17 10499 1 1 35 CYS H H 6.933 -4.652 -4.702 1.00 . A A . 35 CYS H 1 1 17 10500 1 1 35 CYS HA H 5.207 -3.432 -6.523 1.00 . A A . 35 CYS HA 1 1 17 10501 1 1 35 CYS HB2 H 7.672 -5.005 -7.253 1.00 . A A . 35 CYS HB2 1 1 17 10502 1 1 35 CYS HB3 H 7.155 -3.450 -7.918 1.00 . A A . 35 CYS HB3 1 1 17 10503 1 1 35 CYS N N 5.991 -4.678 -5.059 1.00 . A A . 35 CYS N 1 1 17 10504 1 1 35 CYS O O 4.797 -5.229 -8.435 1.00 . A A . 35 CYS O 1 1 17 10505 1 1 35 CYS SG S 8.338 -3.198 -5.840 1.00 . A A . 35 CYS SG 1 1 17 10506 1 1 36 SER C C 3.428 -8.345 -6.652 1.00 . A A . 36 SER C 1 1 17 10507 1 1 36 SER CA C 4.690 -7.877 -7.388 1.00 . A A . 36 SER CA 1 1 17 10508 1 1 36 SER CB C 5.766 -8.960 -7.340 1.00 . A A . 36 SER CB 1 1 17 10509 1 1 36 SER H H 5.655 -6.840 -5.880 1.00 . A A . 36 SER H 1 1 17 10510 1 1 36 SER HA H 4.429 -7.673 -8.425 1.00 . A A . 36 SER HA 1 1 17 10511 1 1 36 SER HB2 H 6.298 -8.907 -6.390 1.00 . A A . 36 SER HB2 1 1 17 10512 1 1 36 SER HB3 H 5.295 -9.935 -7.444 1.00 . A A . 36 SER HB3 1 1 17 10513 1 1 36 SER HG H 7.189 -7.941 -8.223 1.00 . A A . 36 SER HG 1 1 17 10514 1 1 36 SER N N 5.252 -6.685 -6.793 1.00 . A A . 36 SER N 1 1 17 10515 1 1 36 SER O O 2.710 -9.194 -7.182 1.00 . A A . 36 SER O 1 1 17 10516 1 1 36 SER OG O 6.705 -8.780 -8.379 1.00 . A A . 36 SER OG 1 1 17 10517 1 1 37 ASN C C 0.876 -7.086 -5.442 1.00 . A A . 37 ASN C 1 1 17 10518 1 1 37 ASN CA C 1.881 -8.004 -4.756 1.00 . A A . 37 ASN CA 1 1 17 10519 1 1 37 ASN CB C 2.014 -7.612 -3.260 1.00 . A A . 37 ASN CB 1 1 17 10520 1 1 37 ASN CG C 1.183 -8.487 -2.350 1.00 . A A . 37 ASN CG 1 1 17 10521 1 1 37 ASN H H 3.704 -7.024 -5.141 1.00 . A A . 37 ASN H 1 1 17 10522 1 1 37 ASN HA H 1.571 -9.049 -4.842 1.00 . A A . 37 ASN HA 1 1 17 10523 1 1 37 ASN HB2 H 3.034 -7.568 -2.913 1.00 . A A . 37 ASN HB2 1 1 17 10524 1 1 37 ASN HB3 H 1.714 -6.594 -3.097 1.00 . A A . 37 ASN HB3 1 1 17 10525 1 1 37 ASN HD21 H -0.469 -7.344 -2.627 1.00 . A A . 37 ASN HD21 1 1 17 10526 1 1 37 ASN HD22 H -0.670 -8.729 -1.582 1.00 . A A . 37 ASN HD22 1 1 17 10527 1 1 37 ASN N N 3.135 -7.797 -5.464 1.00 . A A . 37 ASN N 1 1 17 10528 1 1 37 ASN ND2 N -0.083 -8.158 -2.186 1.00 . A A . 37 ASN ND2 1 1 17 10529 1 1 37 ASN O O 0.802 -5.920 -5.065 1.00 . A A . 37 ASN O 1 1 17 10530 1 1 37 ASN OD1 O 1.688 -9.439 -1.759 1.00 . A A . 37 ASN OD1 1 1 17 10531 1 1 38 SER C C -1.663 -5.785 -6.375 1.00 . A A . 38 SER C 1 1 17 10532 1 1 38 SER CA C -0.667 -6.564 -7.255 1.00 . A A . 38 SER CA 1 1 17 10533 1 1 38 SER CB C -1.313 -7.283 -8.419 1.00 . A A . 38 SER CB 1 1 17 10534 1 1 38 SER H H 0.256 -8.453 -6.828 1.00 . A A . 38 SER H 1 1 17 10535 1 1 38 SER HA H -0.025 -5.835 -7.738 1.00 . A A . 38 SER HA 1 1 17 10536 1 1 38 SER HB2 H -2.016 -7.989 -8.009 1.00 . A A . 38 SER HB2 1 1 17 10537 1 1 38 SER HB3 H -1.830 -6.565 -9.059 1.00 . A A . 38 SER HB3 1 1 17 10538 1 1 38 SER HG H 0.474 -7.351 -9.180 1.00 . A A . 38 SER HG 1 1 17 10539 1 1 38 SER N N 0.157 -7.504 -6.481 1.00 . A A . 38 SER N 1 1 17 10540 1 1 38 SER O O -1.846 -4.590 -6.600 1.00 . A A . 38 SER O 1 1 17 10541 1 1 38 SER OG O -0.297 -7.959 -9.147 1.00 . A A . 38 SER OG 1 1 17 10542 1 1 39 ASP C C -2.338 -4.545 -3.579 1.00 . A A . 39 ASP C 1 1 17 10543 1 1 39 ASP CA C -3.050 -5.681 -4.327 1.00 . A A . 39 ASP CA 1 1 17 10544 1 1 39 ASP CB C -3.611 -6.698 -3.329 1.00 . A A . 39 ASP CB 1 1 17 10545 1 1 39 ASP CG C -4.603 -6.148 -2.288 1.00 . A A . 39 ASP CG 1 1 17 10546 1 1 39 ASP H H -2.002 -7.365 -5.154 1.00 . A A . 39 ASP H 1 1 17 10547 1 1 39 ASP HA H -3.889 -5.248 -4.863 1.00 . A A . 39 ASP HA 1 1 17 10548 1 1 39 ASP HB2 H -4.113 -7.485 -3.889 1.00 . A A . 39 ASP HB2 1 1 17 10549 1 1 39 ASP HB3 H -2.771 -7.153 -2.803 1.00 . A A . 39 ASP HB3 1 1 17 10550 1 1 39 ASP N N -2.186 -6.379 -5.296 1.00 . A A . 39 ASP N 1 1 17 10551 1 1 39 ASP O O -2.989 -3.597 -3.155 1.00 . A A . 39 ASP O 1 1 17 10552 1 1 39 ASP OD1 O -5.521 -5.366 -2.607 1.00 . A A . 39 ASP OD1 1 1 17 10553 1 1 39 ASP OD2 O -4.575 -6.690 -1.156 1.00 . A A . 39 ASP OD2 1 1 17 10554 1 1 40 CYS C C 0.591 -2.708 -3.983 1.00 . A A . 40 CYS C 1 1 17 10555 1 1 40 CYS CA C -0.176 -3.502 -2.918 1.00 . A A . 40 CYS CA 1 1 17 10556 1 1 40 CYS CB C 0.778 -4.056 -1.845 1.00 . A A . 40 CYS CB 1 1 17 10557 1 1 40 CYS H H -0.499 -5.304 -3.965 1.00 . A A . 40 CYS H 1 1 17 10558 1 1 40 CYS HA H -0.826 -2.780 -2.428 1.00 . A A . 40 CYS HA 1 1 17 10559 1 1 40 CYS HB2 H 1.371 -4.907 -2.204 1.00 . A A . 40 CYS HB2 1 1 17 10560 1 1 40 CYS HB3 H 1.494 -3.273 -1.598 1.00 . A A . 40 CYS HB3 1 1 17 10561 1 1 40 CYS N N -1.003 -4.579 -3.470 1.00 . A A . 40 CYS N 1 1 17 10562 1 1 40 CYS O O 1.210 -1.697 -3.663 1.00 . A A . 40 CYS O 1 1 17 10563 1 1 40 CYS SG S -0.137 -4.475 -0.339 1.00 . A A . 40 CYS SG 1 1 17 10564 1 1 41 THR C C 0.956 -1.164 -6.628 1.00 . A A . 41 THR C 1 1 17 10565 1 1 41 THR CA C 1.415 -2.579 -6.277 1.00 . A A . 41 THR CA 1 1 17 10566 1 1 41 THR CB C 1.355 -3.535 -7.468 1.00 . A A . 41 THR CB 1 1 17 10567 1 1 41 THR CG2 C 1.937 -3.042 -8.777 1.00 . A A . 41 THR CG2 1 1 17 10568 1 1 41 THR H H 0.016 -3.946 -5.476 1.00 . A A . 41 THR H 1 1 17 10569 1 1 41 THR HA H 2.437 -2.528 -5.898 1.00 . A A . 41 THR HA 1 1 17 10570 1 1 41 THR HB H 0.307 -3.760 -7.655 1.00 . A A . 41 THR HB 1 1 17 10571 1 1 41 THR HG1 H 1.888 -4.901 -6.192 1.00 . A A . 41 THR HG1 1 1 17 10572 1 1 41 THR HG21 H 1.500 -2.077 -9.047 1.00 . A A . 41 THR HG21 1 1 17 10573 1 1 41 THR HG22 H 3.019 -2.944 -8.700 1.00 . A A . 41 THR HG22 1 1 17 10574 1 1 41 THR HG23 H 1.672 -3.782 -9.530 1.00 . A A . 41 THR HG23 1 1 17 10575 1 1 41 THR N N 0.581 -3.144 -5.237 1.00 . A A . 41 THR N 1 1 17 10576 1 1 41 THR O O 1.804 -0.278 -6.711 1.00 . A A . 41 THR O 1 1 17 10577 1 1 41 THR OG1 O 2.037 -4.731 -7.140 1.00 . A A . 41 THR OG1 1 1 17 10578 1 1 42 ALA C C -0.573 1.426 -6.184 1.00 . A A . 42 ALA C 1 1 17 10579 1 1 42 ALA CA C -0.854 0.366 -7.249 1.00 . A A . 42 ALA CA 1 1 17 10580 1 1 42 ALA CB C -2.352 0.280 -7.538 1.00 . A A . 42 ALA CB 1 1 17 10581 1 1 42 ALA H H -1.019 -1.659 -6.614 1.00 . A A . 42 ALA H 1 1 17 10582 1 1 42 ALA HA H -0.340 0.658 -8.165 1.00 . A A . 42 ALA HA 1 1 17 10583 1 1 42 ALA HB1 H -2.563 -0.535 -8.228 1.00 . A A . 42 ALA HB1 1 1 17 10584 1 1 42 ALA HB2 H -2.909 0.123 -6.617 1.00 . A A . 42 ALA HB2 1 1 17 10585 1 1 42 ALA HB3 H -2.666 1.222 -7.983 1.00 . A A . 42 ALA HB3 1 1 17 10586 1 1 42 ALA N N -0.347 -0.935 -6.832 1.00 . A A . 42 ALA N 1 1 17 10587 1 1 42 ALA O O -0.222 2.558 -6.509 1.00 . A A . 42 ALA O 1 1 17 10588 1 1 43 PHE C C 1.217 2.106 -3.892 1.00 . A A . 43 PHE C 1 1 17 10589 1 1 43 PHE CA C -0.275 1.802 -3.761 1.00 . A A . 43 PHE CA 1 1 17 10590 1 1 43 PHE CB C -0.681 1.029 -2.494 1.00 . A A . 43 PHE CB 1 1 17 10591 1 1 43 PHE CD1 C 1.057 1.396 -0.714 1.00 . A A . 43 PHE CD1 1 1 17 10592 1 1 43 PHE CD2 C -1.183 2.214 -0.277 1.00 . A A . 43 PHE CD2 1 1 17 10593 1 1 43 PHE CE1 C 1.493 1.896 0.518 1.00 . A A . 43 PHE CE1 1 1 17 10594 1 1 43 PHE CE2 C -0.764 2.657 0.991 1.00 . A A . 43 PHE CE2 1 1 17 10595 1 1 43 PHE CG C -0.261 1.597 -1.148 1.00 . A A . 43 PHE CG 1 1 17 10596 1 1 43 PHE CZ C 0.583 2.532 1.371 1.00 . A A . 43 PHE CZ 1 1 17 10597 1 1 43 PHE H H -1.012 0.081 -4.753 1.00 . A A . 43 PHE H 1 1 17 10598 1 1 43 PHE HA H -0.792 2.758 -3.776 1.00 . A A . 43 PHE HA 1 1 17 10599 1 1 43 PHE HB2 H -1.767 0.927 -2.506 1.00 . A A . 43 PHE HB2 1 1 17 10600 1 1 43 PHE HB3 H -0.246 0.033 -2.562 1.00 . A A . 43 PHE HB3 1 1 17 10601 1 1 43 PHE HD1 H 1.741 0.857 -1.339 1.00 . A A . 43 PHE HD1 1 1 17 10602 1 1 43 PHE HD2 H -2.222 2.327 -0.552 1.00 . A A . 43 PHE HD2 1 1 17 10603 1 1 43 PHE HE1 H 2.526 1.785 0.808 1.00 . A A . 43 PHE HE1 1 1 17 10604 1 1 43 PHE HE2 H -1.466 3.113 1.673 1.00 . A A . 43 PHE HE2 1 1 17 10605 1 1 43 PHE HZ H 0.924 2.902 2.323 1.00 . A A . 43 PHE HZ 1 1 17 10606 1 1 43 PHE N N -0.695 1.032 -4.915 1.00 . A A . 43 PHE N 1 1 17 10607 1 1 43 PHE O O 1.578 3.265 -4.079 1.00 . A A . 43 PHE O 1 1 17 10608 1 1 44 LEU C C 4.103 2.125 -4.971 1.00 . A A . 44 LEU C 1 1 17 10609 1 1 44 LEU CA C 3.538 1.377 -3.760 1.00 . A A . 44 LEU CA 1 1 17 10610 1 1 44 LEU CB C 4.310 0.074 -3.557 1.00 . A A . 44 LEU CB 1 1 17 10611 1 1 44 LEU CD1 C 4.660 -2.055 -2.349 1.00 . A A . 44 LEU CD1 1 1 17 10612 1 1 44 LEU CD2 C 4.302 0.096 -1.005 1.00 . A A . 44 LEU CD2 1 1 17 10613 1 1 44 LEU CG C 3.965 -0.694 -2.273 1.00 . A A . 44 LEU CG 1 1 17 10614 1 1 44 LEU H H 1.790 0.155 -3.656 1.00 . A A . 44 LEU H 1 1 17 10615 1 1 44 LEU HA H 3.681 2.020 -2.896 1.00 . A A . 44 LEU HA 1 1 17 10616 1 1 44 LEU HB2 H 4.146 -0.571 -4.416 1.00 . A A . 44 LEU HB2 1 1 17 10617 1 1 44 LEU HB3 H 5.364 0.323 -3.556 1.00 . A A . 44 LEU HB3 1 1 17 10618 1 1 44 LEU HD11 H 5.726 -1.926 -2.541 1.00 . A A . 44 LEU HD11 1 1 17 10619 1 1 44 LEU HD12 H 4.509 -2.607 -1.423 1.00 . A A . 44 LEU HD12 1 1 17 10620 1 1 44 LEU HD13 H 4.226 -2.618 -3.177 1.00 . A A . 44 LEU HD13 1 1 17 10621 1 1 44 LEU HD21 H 3.913 1.110 -1.035 1.00 . A A . 44 LEU HD21 1 1 17 10622 1 1 44 LEU HD22 H 3.843 -0.392 -0.149 1.00 . A A . 44 LEU HD22 1 1 17 10623 1 1 44 LEU HD23 H 5.373 0.144 -0.879 1.00 . A A . 44 LEU HD23 1 1 17 10624 1 1 44 LEU HG H 2.902 -0.889 -2.225 1.00 . A A . 44 LEU HG 1 1 17 10625 1 1 44 LEU N N 2.105 1.108 -3.844 1.00 . A A . 44 LEU N 1 1 17 10626 1 1 44 LEU O O 5.054 2.895 -4.823 1.00 . A A . 44 LEU O 1 1 17 10627 1 1 45 SER C C 3.730 4.218 -7.083 1.00 . A A . 45 SER C 1 1 17 10628 1 1 45 SER CA C 3.754 2.712 -7.365 1.00 . A A . 45 SER CA 1 1 17 10629 1 1 45 SER CB C 2.712 2.279 -8.408 1.00 . A A . 45 SER CB 1 1 17 10630 1 1 45 SER H H 2.757 1.257 -6.163 1.00 . A A . 45 SER H 1 1 17 10631 1 1 45 SER HA H 4.740 2.451 -7.735 1.00 . A A . 45 SER HA 1 1 17 10632 1 1 45 SER HB2 H 2.703 1.200 -8.434 1.00 . A A . 45 SER HB2 1 1 17 10633 1 1 45 SER HB3 H 1.716 2.588 -8.106 1.00 . A A . 45 SER HB3 1 1 17 10634 1 1 45 SER HG H 3.853 2.379 -9.994 1.00 . A A . 45 SER HG 1 1 17 10635 1 1 45 SER N N 3.497 1.951 -6.145 1.00 . A A . 45 SER N 1 1 17 10636 1 1 45 SER O O 4.561 4.972 -7.592 1.00 . A A . 45 SER O 1 1 17 10637 1 1 45 SER OG O 2.986 2.754 -9.712 1.00 . A A . 45 SER OG 1 1 17 10638 1 1 46 GLN C C 3.438 6.325 -4.523 1.00 . A A . 46 GLN C 1 1 17 10639 1 1 46 GLN CA C 2.626 6.023 -5.792 1.00 . A A . 46 GLN CA 1 1 17 10640 1 1 46 GLN CB C 1.122 6.280 -5.587 1.00 . A A . 46 GLN CB 1 1 17 10641 1 1 46 GLN CD C -1.101 6.451 -6.877 1.00 . A A . 46 GLN CD 1 1 17 10642 1 1 46 GLN CG C 0.376 6.086 -6.920 1.00 . A A . 46 GLN CG 1 1 17 10643 1 1 46 GLN H H 2.171 3.930 -5.884 1.00 . A A . 46 GLN H 1 1 17 10644 1 1 46 GLN HA H 2.981 6.692 -6.578 1.00 . A A . 46 GLN HA 1 1 17 10645 1 1 46 GLN HB2 H 0.714 5.600 -4.839 1.00 . A A . 46 GLN HB2 1 1 17 10646 1 1 46 GLN HB3 H 0.988 7.299 -5.231 1.00 . A A . 46 GLN HB3 1 1 17 10647 1 1 46 GLN HE21 H -1.359 5.383 -8.514 1.00 . A A . 46 GLN HE21 1 1 17 10648 1 1 46 GLN HE22 H -2.713 6.410 -8.038 1.00 . A A . 46 GLN HE22 1 1 17 10649 1 1 46 GLN HG2 H 0.849 6.699 -7.687 1.00 . A A . 46 GLN HG2 1 1 17 10650 1 1 46 GLN HG3 H 0.461 5.045 -7.227 1.00 . A A . 46 GLN HG3 1 1 17 10651 1 1 46 GLN N N 2.804 4.645 -6.232 1.00 . A A . 46 GLN N 1 1 17 10652 1 1 46 GLN NE2 N -1.876 5.886 -7.789 1.00 . A A . 46 GLN NE2 1 1 17 10653 1 1 46 GLN O O 4.112 7.356 -4.449 1.00 . A A . 46 GLN O 1 1 17 10654 1 1 46 GLN OE1 O -1.552 7.266 -6.075 1.00 . A A . 46 GLN OE1 1 1 17 10655 1 1 47 CYS C C 5.453 5.608 -2.107 1.00 . A A . 47 CYS C 1 1 17 10656 1 1 47 CYS CA C 3.928 5.712 -2.175 1.00 . A A . 47 CYS CA 1 1 17 10657 1 1 47 CYS CB C 3.300 4.753 -1.156 1.00 . A A . 47 CYS CB 1 1 17 10658 1 1 47 CYS H H 2.744 4.667 -3.619 1.00 . A A . 47 CYS H 1 1 17 10659 1 1 47 CYS HA H 3.655 6.729 -1.887 1.00 . A A . 47 CYS HA 1 1 17 10660 1 1 47 CYS HB2 H 3.739 3.755 -1.258 1.00 . A A . 47 CYS HB2 1 1 17 10661 1 1 47 CYS HB3 H 3.531 5.121 -0.155 1.00 . A A . 47 CYS HB3 1 1 17 10662 1 1 47 CYS N N 3.373 5.457 -3.509 1.00 . A A . 47 CYS N 1 1 17 10663 1 1 47 CYS O O 6.047 6.092 -1.143 1.00 . A A . 47 CYS O 1 1 17 10664 1 1 47 CYS SG S 1.500 4.645 -1.317 1.00 . A A . 47 CYS SG 1 1 17 10665 1 1 48 TYR C C 7.934 5.227 -4.692 1.00 . A A . 48 TYR C 1 1 17 10666 1 1 48 TYR CA C 7.517 4.860 -3.277 1.00 . A A . 48 TYR CA 1 1 17 10667 1 1 48 TYR CB C 7.983 3.448 -2.971 1.00 . A A . 48 TYR CB 1 1 17 10668 1 1 48 TYR CD1 C 9.143 3.501 -0.724 1.00 . A A . 48 TYR CD1 1 1 17 10669 1 1 48 TYR CD2 C 6.928 2.508 -0.907 1.00 . A A . 48 TYR CD2 1 1 17 10670 1 1 48 TYR CE1 C 9.232 3.068 0.608 1.00 . A A . 48 TYR CE1 1 1 17 10671 1 1 48 TYR CE2 C 7.055 2.006 0.394 1.00 . A A . 48 TYR CE2 1 1 17 10672 1 1 48 TYR CG C 8.008 3.178 -1.491 1.00 . A A . 48 TYR CG 1 1 17 10673 1 1 48 TYR CZ C 8.200 2.287 1.164 1.00 . A A . 48 TYR CZ 1 1 17 10674 1 1 48 TYR H H 5.493 4.597 -3.843 1.00 . A A . 48 TYR H 1 1 17 10675 1 1 48 TYR HA H 8.044 5.464 -2.550 1.00 . A A . 48 TYR HA 1 1 17 10676 1 1 48 TYR HB2 H 7.350 2.719 -3.478 1.00 . A A . 48 TYR HB2 1 1 17 10677 1 1 48 TYR HB3 H 8.998 3.321 -3.353 1.00 . A A . 48 TYR HB3 1 1 17 10678 1 1 48 TYR HD1 H 9.967 4.049 -1.159 1.00 . A A . 48 TYR HD1 1 1 17 10679 1 1 48 TYR HD2 H 6.065 2.262 -1.504 1.00 . A A . 48 TYR HD2 1 1 17 10680 1 1 48 TYR HE1 H 10.114 3.285 1.190 1.00 . A A . 48 TYR HE1 1 1 17 10681 1 1 48 TYR HE2 H 6.312 1.330 0.753 1.00 . A A . 48 TYR HE2 1 1 17 10682 1 1 48 TYR HH H 8.308 0.887 2.514 1.00 . A A . 48 TYR HH 1 1 17 10683 1 1 48 TYR N N 6.073 4.991 -3.115 1.00 . A A . 48 TYR N 1 1 17 10684 1 1 48 TYR O O 8.902 5.956 -4.880 1.00 . A A . 48 TYR O 1 1 17 10685 1 1 48 TYR OH O 8.290 1.853 2.447 1.00 . A A . 48 TYR OH 1 1 17 10686 1 1 49 GLY C C 7.557 3.160 -7.623 1.00 . A A . 49 GLY C 1 1 17 10687 1 1 49 GLY CA C 7.748 4.561 -7.048 1.00 . A A . 49 GLY CA 1 1 17 10688 1 1 49 GLY H H 6.440 4.091 -5.460 1.00 . A A . 49 GLY H 1 1 17 10689 1 1 49 GLY HA2 H 8.814 4.790 -7.076 1.00 . A A . 49 GLY HA2 1 1 17 10690 1 1 49 GLY HA3 H 7.223 5.282 -7.670 1.00 . A A . 49 GLY HA3 1 1 17 10691 1 1 49 GLY N N 7.254 4.652 -5.683 1.00 . A A . 49 GLY N 1 1 17 10692 1 1 49 GLY O O 7.647 3.002 -8.838 1.00 . A A . 49 GLY O 1 1 17 10693 1 1 50 GLY C C 8.086 0.055 -7.689 1.00 . A A . 50 GLY C 1 1 17 10694 1 1 50 GLY CA C 6.870 0.817 -7.198 1.00 . A A . 50 GLY CA 1 1 17 10695 1 1 50 GLY H H 7.151 2.367 -5.801 1.00 . A A . 50 GLY H 1 1 17 10696 1 1 50 GLY HA2 H 6.138 0.858 -8.003 1.00 . A A . 50 GLY HA2 1 1 17 10697 1 1 50 GLY HA3 H 6.436 0.285 -6.353 1.00 . A A . 50 GLY HA3 1 1 17 10698 1 1 50 GLY N N 7.222 2.169 -6.787 1.00 . A A . 50 GLY N 1 1 17 10699 1 1 50 GLY O O 8.152 -0.278 -8.872 1.00 . A A . 50 GLY O 1 1 17 10700 1 1 51 CYS C C 11.014 0.453 -7.933 1.00 . A A . 51 CYS C 1 1 17 10701 1 1 51 CYS CA C 10.385 -0.625 -7.066 1.00 . A A . 51 CYS CA 1 1 17 10702 1 1 51 CYS CB C 10.481 -2.028 -7.691 1.00 . A A . 51 CYS CB 1 1 17 10703 1 1 51 CYS H H 8.834 0.067 -5.816 1.00 . A A . 51 CYS H 1 1 17 10704 1 1 51 CYS HA H 10.931 -0.644 -6.126 1.00 . A A . 51 CYS HA 1 1 17 10705 1 1 51 CYS HB2 H 9.806 -2.088 -8.544 1.00 . A A . 51 CYS HB2 1 1 17 10706 1 1 51 CYS HB3 H 11.490 -2.131 -8.087 1.00 . A A . 51 CYS HB3 1 1 17 10707 1 1 51 CYS N N 9.018 -0.223 -6.774 1.00 . A A . 51 CYS N 1 1 17 10708 1 1 51 CYS O O 11.075 0.282 -9.169 1.00 . A A . 51 CYS O 1 1 17 10709 1 1 51 CYS OXT O 11.507 1.433 -7.347 1.00 . A A . 51 CYS OXT 1 1 17 10710 1 1 51 CYS SG S 10.203 -3.440 -6.596 1.00 . A A . 51 CYS SG 1 1 18 10711 1 1 1 GLY C C -8.113 -6.660 -0.404 1.00 . A A . 1 GLY C 1 1 18 10712 1 1 1 GLY CA C -7.735 -7.533 -1.572 1.00 . A A . 1 GLY CA 1 1 18 10713 1 1 1 GLY H1 H -7.986 -5.994 -2.874 1.00 . A A . 1 GLY H1 1 1 18 10714 1 1 1 GLY H2 H -8.020 -7.465 -3.589 1.00 . A A . 1 GLY H2 1 1 18 10715 1 1 1 GLY H3 H -9.323 -6.947 -2.706 1.00 . A A . 1 GLY H3 1 1 18 10716 1 1 1 GLY HA2 H -6.650 -7.577 -1.673 1.00 . A A . 1 GLY HA2 1 1 18 10717 1 1 1 GLY HA3 H -8.131 -8.537 -1.427 1.00 . A A . 1 GLY HA3 1 1 18 10718 1 1 1 GLY N N -8.315 -6.943 -2.776 1.00 . A A . 1 GLY N 1 1 18 10719 1 1 1 GLY O O -9.298 -6.577 -0.081 1.00 . A A . 1 GLY O 1 1 18 10720 1 1 2 GLU C C -6.887 -3.621 0.780 1.00 . A A . 2 GLU C 1 1 18 10721 1 1 2 GLU CA C -7.337 -4.997 1.246 1.00 . A A . 2 GLU CA 1 1 18 10722 1 1 2 GLU CB C -6.656 -5.443 2.550 1.00 . A A . 2 GLU CB 1 1 18 10723 1 1 2 GLU CD C -4.580 -6.730 3.235 1.00 . A A . 2 GLU CD 1 1 18 10724 1 1 2 GLU CG C -5.135 -5.557 2.436 1.00 . A A . 2 GLU CG 1 1 18 10725 1 1 2 GLU H H -6.186 -6.107 -0.147 1.00 . A A . 2 GLU H 1 1 18 10726 1 1 2 GLU HA H -8.393 -4.925 1.469 1.00 . A A . 2 GLU HA 1 1 18 10727 1 1 2 GLU HB2 H -6.888 -4.715 3.325 1.00 . A A . 2 GLU HB2 1 1 18 10728 1 1 2 GLU HB3 H -7.077 -6.408 2.832 1.00 . A A . 2 GLU HB3 1 1 18 10729 1 1 2 GLU HG2 H -4.905 -5.710 1.388 1.00 . A A . 2 GLU HG2 1 1 18 10730 1 1 2 GLU HG3 H -4.670 -4.624 2.750 1.00 . A A . 2 GLU HG3 1 1 18 10731 1 1 2 GLU N N -7.139 -5.965 0.173 1.00 . A A . 2 GLU N 1 1 18 10732 1 1 2 GLU O O -7.655 -2.668 0.876 1.00 . A A . 2 GLU O 1 1 18 10733 1 1 2 GLU OE1 O -4.446 -6.639 4.473 1.00 . A A . 2 GLU OE1 1 1 18 10734 1 1 2 GLU OE2 O -4.297 -7.776 2.599 1.00 . A A . 2 GLU OE2 1 1 18 10735 1 1 3 CYS C C -6.047 -1.622 -1.278 1.00 . A A . 3 CYS C 1 1 18 10736 1 1 3 CYS CA C -5.164 -2.214 -0.172 1.00 . A A . 3 CYS CA 1 1 18 10737 1 1 3 CYS CB C -3.721 -2.330 -0.627 1.00 . A A . 3 CYS CB 1 1 18 10738 1 1 3 CYS H H -5.084 -4.319 0.107 1.00 . A A . 3 CYS H 1 1 18 10739 1 1 3 CYS HA H -5.161 -1.574 0.710 1.00 . A A . 3 CYS HA 1 1 18 10740 1 1 3 CYS HB2 H -3.129 -2.817 0.148 1.00 . A A . 3 CYS HB2 1 1 18 10741 1 1 3 CYS HB3 H -3.679 -2.933 -1.525 1.00 . A A . 3 CYS HB3 1 1 18 10742 1 1 3 CYS N N -5.676 -3.508 0.225 1.00 . A A . 3 CYS N 1 1 18 10743 1 1 3 CYS O O -6.387 -0.442 -1.237 1.00 . A A . 3 CYS O 1 1 18 10744 1 1 3 CYS SG S -3.038 -0.697 -0.946 1.00 . A A . 3 CYS SG 1 1 18 10745 1 1 4 GLU C C -8.735 -1.575 -2.803 1.00 . A A . 4 GLU C 1 1 18 10746 1 1 4 GLU CA C -7.368 -2.045 -3.309 1.00 . A A . 4 GLU CA 1 1 18 10747 1 1 4 GLU CB C -7.572 -3.196 -4.297 1.00 . A A . 4 GLU CB 1 1 18 10748 1 1 4 GLU CD C -6.660 -4.432 -6.270 1.00 . A A . 4 GLU CD 1 1 18 10749 1 1 4 GLU CG C -6.307 -3.535 -5.086 1.00 . A A . 4 GLU CG 1 1 18 10750 1 1 4 GLU H H -6.100 -3.397 -2.247 1.00 . A A . 4 GLU H 1 1 18 10751 1 1 4 GLU HA H -6.910 -1.211 -3.844 1.00 . A A . 4 GLU HA 1 1 18 10752 1 1 4 GLU HB2 H -7.911 -4.084 -3.760 1.00 . A A . 4 GLU HB2 1 1 18 10753 1 1 4 GLU HB3 H -8.348 -2.905 -5.007 1.00 . A A . 4 GLU HB3 1 1 18 10754 1 1 4 GLU HG2 H -5.843 -2.620 -5.458 1.00 . A A . 4 GLU HG2 1 1 18 10755 1 1 4 GLU HG3 H -5.603 -4.043 -4.430 1.00 . A A . 4 GLU HG3 1 1 18 10756 1 1 4 GLU N N -6.476 -2.458 -2.230 1.00 . A A . 4 GLU N 1 1 18 10757 1 1 4 GLU O O -9.355 -0.740 -3.458 1.00 . A A . 4 GLU O 1 1 18 10758 1 1 4 GLU OE1 O -7.015 -3.902 -7.343 1.00 . A A . 4 GLU OE1 1 1 18 10759 1 1 4 GLU OE2 O -6.651 -5.680 -6.129 1.00 . A A . 4 GLU OE2 1 1 18 10760 1 1 5 GLN C C -10.222 -0.143 -0.578 1.00 . A A . 5 GLN C 1 1 18 10761 1 1 5 GLN CA C -10.450 -1.571 -1.059 1.00 . A A . 5 GLN CA 1 1 18 10762 1 1 5 GLN CB C -10.899 -2.491 0.090 1.00 . A A . 5 GLN CB 1 1 18 10763 1 1 5 GLN CD C -12.226 -0.889 1.616 1.00 . A A . 5 GLN CD 1 1 18 10764 1 1 5 GLN CG C -12.269 -2.095 0.668 1.00 . A A . 5 GLN CG 1 1 18 10765 1 1 5 GLN H H -8.635 -2.674 -1.093 1.00 . A A . 5 GLN H 1 1 18 10766 1 1 5 GLN HA H -11.228 -1.554 -1.823 1.00 . A A . 5 GLN HA 1 1 18 10767 1 1 5 GLN HB2 H -10.956 -3.515 -0.280 1.00 . A A . 5 GLN HB2 1 1 18 10768 1 1 5 GLN HB3 H -10.163 -2.486 0.890 1.00 . A A . 5 GLN HB3 1 1 18 10769 1 1 5 GLN HE21 H -14.140 -0.368 1.180 1.00 . A A . 5 GLN HE21 1 1 18 10770 1 1 5 GLN HE22 H -13.293 0.652 2.348 1.00 . A A . 5 GLN HE22 1 1 18 10771 1 1 5 GLN HG2 H -12.959 -1.900 -0.154 1.00 . A A . 5 GLN HG2 1 1 18 10772 1 1 5 GLN HG3 H -12.663 -2.936 1.233 1.00 . A A . 5 GLN HG3 1 1 18 10773 1 1 5 GLN N N -9.218 -2.074 -1.659 1.00 . A A . 5 GLN N 1 1 18 10774 1 1 5 GLN NE2 N -13.299 -0.132 1.702 1.00 . A A . 5 GLN NE2 1 1 18 10775 1 1 5 GLN O O -11.044 0.740 -0.811 1.00 . A A . 5 GLN O 1 1 18 10776 1 1 5 GLN OE1 O -11.255 -0.641 2.332 1.00 . A A . 5 GLN OE1 1 1 18 10777 1 1 6 CYS C C -8.574 2.414 -0.499 1.00 . A A . 6 CYS C 1 1 18 10778 1 1 6 CYS CA C -8.776 1.393 0.619 1.00 . A A . 6 CYS CA 1 1 18 10779 1 1 6 CYS CB C -7.534 1.240 1.477 1.00 . A A . 6 CYS CB 1 1 18 10780 1 1 6 CYS H H -8.465 -0.685 0.260 1.00 . A A . 6 CYS H 1 1 18 10781 1 1 6 CYS HA H -9.615 1.721 1.239 1.00 . A A . 6 CYS HA 1 1 18 10782 1 1 6 CYS HB2 H -7.718 0.418 2.153 1.00 . A A . 6 CYS HB2 1 1 18 10783 1 1 6 CYS HB3 H -6.678 0.986 0.854 1.00 . A A . 6 CYS HB3 1 1 18 10784 1 1 6 CYS N N -9.096 0.088 0.086 1.00 . A A . 6 CYS N 1 1 18 10785 1 1 6 CYS O O -9.040 3.548 -0.388 1.00 . A A . 6 CYS O 1 1 18 10786 1 1 6 CYS SG S -7.155 2.705 2.440 1.00 . A A . 6 CYS SG 1 1 18 10787 1 1 7 PHE C C -9.249 3.064 -3.337 1.00 . A A . 7 PHE C 1 1 18 10788 1 1 7 PHE CA C -7.847 2.774 -2.815 1.00 . A A . 7 PHE CA 1 1 18 10789 1 1 7 PHE CB C -6.986 2.067 -3.870 1.00 . A A . 7 PHE CB 1 1 18 10790 1 1 7 PHE CD1 C -4.655 2.694 -3.118 1.00 . A A . 7 PHE CD1 1 1 18 10791 1 1 7 PHE CD2 C -5.451 3.540 -5.255 1.00 . A A . 7 PHE CD2 1 1 18 10792 1 1 7 PHE CE1 C -3.449 3.385 -3.313 1.00 . A A . 7 PHE CE1 1 1 18 10793 1 1 7 PHE CE2 C -4.245 4.239 -5.438 1.00 . A A . 7 PHE CE2 1 1 18 10794 1 1 7 PHE CG C -5.661 2.762 -4.098 1.00 . A A . 7 PHE CG 1 1 18 10795 1 1 7 PHE CZ C -3.239 4.163 -4.462 1.00 . A A . 7 PHE CZ 1 1 18 10796 1 1 7 PHE H H -7.522 1.064 -1.575 1.00 . A A . 7 PHE H 1 1 18 10797 1 1 7 PHE HA H -7.384 3.734 -2.586 1.00 . A A . 7 PHE HA 1 1 18 10798 1 1 7 PHE HB2 H -6.798 1.035 -3.575 1.00 . A A . 7 PHE HB2 1 1 18 10799 1 1 7 PHE HB3 H -7.527 2.033 -4.818 1.00 . A A . 7 PHE HB3 1 1 18 10800 1 1 7 PHE HD1 H -4.817 2.152 -2.197 1.00 . A A . 7 PHE HD1 1 1 18 10801 1 1 7 PHE HD2 H -6.227 3.650 -5.995 1.00 . A A . 7 PHE HD2 1 1 18 10802 1 1 7 PHE HE1 H -2.685 3.352 -2.558 1.00 . A A . 7 PHE HE1 1 1 18 10803 1 1 7 PHE HE2 H -4.129 4.866 -6.312 1.00 . A A . 7 PHE HE2 1 1 18 10804 1 1 7 PHE HZ H -2.321 4.724 -4.561 1.00 . A A . 7 PHE HZ 1 1 18 10805 1 1 7 PHE N N -7.917 1.999 -1.587 1.00 . A A . 7 PHE N 1 1 18 10806 1 1 7 PHE O O -9.514 4.208 -3.707 1.00 . A A . 7 PHE O 1 1 18 10807 1 1 8 SER C C -12.147 3.428 -3.024 1.00 . A A . 8 SER C 1 1 18 10808 1 1 8 SER CA C -11.538 2.230 -3.757 1.00 . A A . 8 SER CA 1 1 18 10809 1 1 8 SER CB C -12.332 0.936 -3.494 1.00 . A A . 8 SER CB 1 1 18 10810 1 1 8 SER H H -9.853 1.142 -3.068 1.00 . A A . 8 SER H 1 1 18 10811 1 1 8 SER HA H -11.544 2.425 -4.825 1.00 . A A . 8 SER HA 1 1 18 10812 1 1 8 SER HB2 H -11.664 0.078 -3.547 1.00 . A A . 8 SER HB2 1 1 18 10813 1 1 8 SER HB3 H -12.772 0.967 -2.496 1.00 . A A . 8 SER HB3 1 1 18 10814 1 1 8 SER HG H -13.798 -0.124 -4.149 1.00 . A A . 8 SER HG 1 1 18 10815 1 1 8 SER N N -10.145 2.069 -3.355 1.00 . A A . 8 SER N 1 1 18 10816 1 1 8 SER O O -12.764 4.288 -3.654 1.00 . A A . 8 SER O 1 1 18 10817 1 1 8 SER OG O -13.369 0.714 -4.430 1.00 . A A . 8 SER OG 1 1 18 10818 1 1 9 ASP C C -11.644 5.830 -0.767 1.00 . A A . 9 ASP C 1 1 18 10819 1 1 9 ASP CA C -12.543 4.587 -0.893 1.00 . A A . 9 ASP CA 1 1 18 10820 1 1 9 ASP CB C -12.955 3.993 0.473 1.00 . A A . 9 ASP CB 1 1 18 10821 1 1 9 ASP CG C -14.337 4.498 0.886 1.00 . A A . 9 ASP CG 1 1 18 10822 1 1 9 ASP H H -11.400 2.815 -1.234 1.00 . A A . 9 ASP H 1 1 18 10823 1 1 9 ASP HA H -13.459 4.908 -1.389 1.00 . A A . 9 ASP HA 1 1 18 10824 1 1 9 ASP HB2 H -12.983 2.902 0.422 1.00 . A A . 9 ASP HB2 1 1 18 10825 1 1 9 ASP HB3 H -12.224 4.249 1.233 1.00 . A A . 9 ASP HB3 1 1 18 10826 1 1 9 ASP N N -11.933 3.537 -1.707 1.00 . A A . 9 ASP N 1 1 18 10827 1 1 9 ASP O O -11.666 6.522 0.252 1.00 . A A . 9 ASP O 1 1 18 10828 1 1 9 ASP OD1 O -15.305 4.273 0.116 1.00 . A A . 9 ASP OD1 1 1 18 10829 1 1 9 ASP OD2 O -14.502 5.112 1.964 1.00 . A A . 9 ASP OD2 1 1 18 10830 1 1 10 GLY C C -8.750 7.438 -1.622 1.00 . A A . 10 GLY C 1 1 18 10831 1 1 10 GLY CA C -10.235 7.468 -1.992 1.00 . A A . 10 GLY CA 1 1 18 10832 1 1 10 GLY H H -10.908 5.547 -2.630 1.00 . A A . 10 GLY H 1 1 18 10833 1 1 10 GLY HA2 H -10.725 8.228 -1.383 1.00 . A A . 10 GLY HA2 1 1 18 10834 1 1 10 GLY HA3 H -10.315 7.784 -3.031 1.00 . A A . 10 GLY HA3 1 1 18 10835 1 1 10 GLY N N -10.933 6.189 -1.845 1.00 . A A . 10 GLY N 1 1 18 10836 1 1 10 GLY O O -8.125 8.499 -1.529 1.00 . A A . 10 GLY O 1 1 18 10837 1 1 11 GLY C C -5.785 6.757 -1.957 1.00 . A A . 11 GLY C 1 1 18 10838 1 1 11 GLY CA C -6.776 6.086 -1.001 1.00 . A A . 11 GLY CA 1 1 18 10839 1 1 11 GLY H H -8.736 5.416 -1.460 1.00 . A A . 11 GLY H 1 1 18 10840 1 1 11 GLY HA2 H -6.548 5.021 -0.975 1.00 . A A . 11 GLY HA2 1 1 18 10841 1 1 11 GLY HA3 H -6.644 6.477 0.000 1.00 . A A . 11 GLY HA3 1 1 18 10842 1 1 11 GLY N N -8.171 6.254 -1.397 1.00 . A A . 11 GLY N 1 1 18 10843 1 1 11 GLY O O -5.999 6.737 -3.173 1.00 . A A . 11 GLY O 1 1 18 10844 1 1 12 ASP C C -2.450 6.533 -1.167 1.00 . A A . 12 ASP C 1 1 18 10845 1 1 12 ASP CA C -3.383 7.347 -2.078 1.00 . A A . 12 ASP CA 1 1 18 10846 1 1 12 ASP CB C -2.832 8.776 -2.244 1.00 . A A . 12 ASP CB 1 1 18 10847 1 1 12 ASP CG C -3.127 9.582 -3.502 1.00 . A A . 12 ASP CG 1 1 18 10848 1 1 12 ASP H H -4.652 7.340 -0.394 1.00 . A A . 12 ASP H 1 1 18 10849 1 1 12 ASP HA H -3.442 6.858 -3.050 1.00 . A A . 12 ASP HA 1 1 18 10850 1 1 12 ASP HB2 H -3.153 9.347 -1.387 1.00 . A A . 12 ASP HB2 1 1 18 10851 1 1 12 ASP HB3 H -1.746 8.717 -2.225 1.00 . A A . 12 ASP HB3 1 1 18 10852 1 1 12 ASP N N -4.692 7.307 -1.413 1.00 . A A . 12 ASP N 1 1 18 10853 1 1 12 ASP O O -2.560 5.311 -1.139 1.00 . A A . 12 ASP O 1 1 18 10854 1 1 12 ASP OD1 O -3.864 9.140 -4.411 1.00 . A A . 12 ASP OD1 1 1 18 10855 1 1 12 ASP OD2 O -2.588 10.713 -3.573 1.00 . A A . 12 ASP OD2 1 1 18 10856 1 1 13 CYS C C -1.068 6.705 2.073 1.00 . A A . 13 CYS C 1 1 18 10857 1 1 13 CYS CA C -0.714 6.520 0.604 1.00 . A A . 13 CYS CA 1 1 18 10858 1 1 13 CYS CB C 0.687 7.055 0.282 1.00 . A A . 13 CYS CB 1 1 18 10859 1 1 13 CYS H H -1.713 8.186 -0.240 1.00 . A A . 13 CYS H 1 1 18 10860 1 1 13 CYS HA H -0.713 5.452 0.402 1.00 . A A . 13 CYS HA 1 1 18 10861 1 1 13 CYS HB2 H 0.715 8.142 0.364 1.00 . A A . 13 CYS HB2 1 1 18 10862 1 1 13 CYS HB3 H 1.399 6.649 1.002 1.00 . A A . 13 CYS HB3 1 1 18 10863 1 1 13 CYS N N -1.689 7.170 -0.264 1.00 . A A . 13 CYS N 1 1 18 10864 1 1 13 CYS O O -1.253 5.727 2.804 1.00 . A A . 13 CYS O 1 1 18 10865 1 1 13 CYS SG S 1.201 6.592 -1.384 1.00 . A A . 13 CYS SG 1 1 18 10866 1 1 14 THR C C -2.681 7.769 4.424 1.00 . A A . 14 THR C 1 1 18 10867 1 1 14 THR CA C -1.300 8.224 3.949 1.00 . A A . 14 THR CA 1 1 18 10868 1 1 14 THR CB C -0.963 9.696 4.211 1.00 . A A . 14 THR CB 1 1 18 10869 1 1 14 THR CG2 C -1.156 10.112 5.665 1.00 . A A . 14 THR CG2 1 1 18 10870 1 1 14 THR H H -0.996 8.732 1.903 1.00 . A A . 14 THR H 1 1 18 10871 1 1 14 THR HA H -0.579 7.618 4.499 1.00 . A A . 14 THR HA 1 1 18 10872 1 1 14 THR HB H -1.574 10.335 3.571 1.00 . A A . 14 THR HB 1 1 18 10873 1 1 14 THR HG1 H 0.831 10.386 4.587 1.00 . A A . 14 THR HG1 1 1 18 10874 1 1 14 THR HG21 H -0.571 9.480 6.330 1.00 . A A . 14 THR HG21 1 1 18 10875 1 1 14 THR HG22 H -0.858 11.152 5.790 1.00 . A A . 14 THR HG22 1 1 18 10876 1 1 14 THR HG23 H -2.208 10.033 5.931 1.00 . A A . 14 THR HG23 1 1 18 10877 1 1 14 THR N N -1.128 7.947 2.538 1.00 . A A . 14 THR N 1 1 18 10878 1 1 14 THR O O -2.751 7.165 5.496 1.00 . A A . 14 THR O 1 1 18 10879 1 1 14 THR OG1 O 0.403 9.868 3.872 1.00 . A A . 14 THR OG1 1 1 18 10880 1 1 15 THR C C -5.329 6.045 3.791 1.00 . A A . 15 THR C 1 1 18 10881 1 1 15 THR CA C -5.100 7.551 4.054 1.00 . A A . 15 THR CA 1 1 18 10882 1 1 15 THR CB C -6.081 8.541 3.355 1.00 . A A . 15 THR CB 1 1 18 10883 1 1 15 THR CG2 C -6.486 8.225 1.919 1.00 . A A . 15 THR CG2 1 1 18 10884 1 1 15 THR H H -3.649 8.322 2.712 1.00 . A A . 15 THR H 1 1 18 10885 1 1 15 THR HA H -5.191 7.703 5.125 1.00 . A A . 15 THR HA 1 1 18 10886 1 1 15 THR HB H -5.559 9.493 3.277 1.00 . A A . 15 THR HB 1 1 18 10887 1 1 15 THR HG1 H -7.907 9.167 3.476 1.00 . A A . 15 THR HG1 1 1 18 10888 1 1 15 THR HG21 H -5.597 8.101 1.303 1.00 . A A . 15 THR HG21 1 1 18 10889 1 1 15 THR HG22 H -7.121 7.340 1.887 1.00 . A A . 15 THR HG22 1 1 18 10890 1 1 15 THR HG23 H -7.056 9.058 1.514 1.00 . A A . 15 THR HG23 1 1 18 10891 1 1 15 THR N N -3.751 7.941 3.640 1.00 . A A . 15 THR N 1 1 18 10892 1 1 15 THR O O -6.444 5.620 3.510 1.00 . A A . 15 THR O 1 1 18 10893 1 1 15 THR OG1 O -7.263 8.777 4.100 1.00 . A A . 15 THR OG1 1 1 18 10894 1 1 16 CYS C C -3.122 3.156 4.695 1.00 . A A . 16 CYS C 1 1 18 10895 1 1 16 CYS CA C -4.313 3.733 3.927 1.00 . A A . 16 CYS CA 1 1 18 10896 1 1 16 CYS CB C -4.217 3.187 2.492 1.00 . A A . 16 CYS CB 1 1 18 10897 1 1 16 CYS H H -3.422 5.637 4.220 1.00 . A A . 16 CYS H 1 1 18 10898 1 1 16 CYS HA H -5.224 3.344 4.397 1.00 . A A . 16 CYS HA 1 1 18 10899 1 1 16 CYS HB2 H -3.322 3.588 2.024 1.00 . A A . 16 CYS HB2 1 1 18 10900 1 1 16 CYS HB3 H -4.102 2.105 2.557 1.00 . A A . 16 CYS HB3 1 1 18 10901 1 1 16 CYS N N -4.297 5.204 3.973 1.00 . A A . 16 CYS N 1 1 18 10902 1 1 16 CYS O O -3.148 1.983 5.060 1.00 . A A . 16 CYS O 1 1 18 10903 1 1 16 CYS SG S -5.621 3.507 1.402 1.00 . A A . 16 CYS SG 1 1 18 10904 1 1 17 PHE C C -1.468 3.302 7.266 1.00 . A A . 17 PHE C 1 1 18 10905 1 1 17 PHE CA C -1.001 3.402 5.810 1.00 . A A . 17 PHE CA 1 1 18 10906 1 1 17 PHE CB C 0.292 4.222 5.671 1.00 . A A . 17 PHE CB 1 1 18 10907 1 1 17 PHE CD1 C 1.768 2.218 6.128 1.00 . A A . 17 PHE CD1 1 1 18 10908 1 1 17 PHE CD2 C 2.269 4.287 7.283 1.00 . A A . 17 PHE CD2 1 1 18 10909 1 1 17 PHE CE1 C 2.797 1.569 6.828 1.00 . A A . 17 PHE CE1 1 1 18 10910 1 1 17 PHE CE2 C 3.323 3.648 7.963 1.00 . A A . 17 PHE CE2 1 1 18 10911 1 1 17 PHE CG C 1.477 3.572 6.367 1.00 . A A . 17 PHE CG 1 1 18 10912 1 1 17 PHE CZ C 3.592 2.291 7.723 1.00 . A A . 17 PHE CZ 1 1 18 10913 1 1 17 PHE H H -1.941 4.826 4.515 1.00 . A A . 17 PHE H 1 1 18 10914 1 1 17 PHE HA H -0.795 2.388 5.468 1.00 . A A . 17 PHE HA 1 1 18 10915 1 1 17 PHE HB2 H 0.537 4.320 4.614 1.00 . A A . 17 PHE HB2 1 1 18 10916 1 1 17 PHE HB3 H 0.126 5.222 6.073 1.00 . A A . 17 PHE HB3 1 1 18 10917 1 1 17 PHE HD1 H 1.198 1.675 5.392 1.00 . A A . 17 PHE HD1 1 1 18 10918 1 1 17 PHE HD2 H 2.075 5.327 7.475 1.00 . A A . 17 PHE HD2 1 1 18 10919 1 1 17 PHE HE1 H 3.011 0.523 6.660 1.00 . A A . 17 PHE HE1 1 1 18 10920 1 1 17 PHE HE2 H 3.936 4.195 8.668 1.00 . A A . 17 PHE HE2 1 1 18 10921 1 1 17 PHE HZ H 4.411 1.786 8.209 1.00 . A A . 17 PHE HZ 1 1 18 10922 1 1 17 PHE N N -2.059 3.925 4.960 1.00 . A A . 17 PHE N 1 1 18 10923 1 1 17 PHE O O -1.010 2.411 7.987 1.00 . A A . 17 PHE O 1 1 18 10924 1 1 18 ASN C C -1.665 4.351 10.111 1.00 . A A . 18 ASN C 1 1 18 10925 1 1 18 ASN CA C -2.822 4.375 9.103 1.00 . A A . 18 ASN CA 1 1 18 10926 1 1 18 ASN CB C -3.845 3.297 9.457 1.00 . A A . 18 ASN CB 1 1 18 10927 1 1 18 ASN CG C -4.636 3.580 10.735 1.00 . A A . 18 ASN CG 1 1 18 10928 1 1 18 ASN H H -2.761 4.852 7.040 1.00 . A A . 18 ASN H 1 1 18 10929 1 1 18 ASN HA H -3.302 5.351 9.190 1.00 . A A . 18 ASN HA 1 1 18 10930 1 1 18 ASN HB2 H -4.540 3.153 8.634 1.00 . A A . 18 ASN HB2 1 1 18 10931 1 1 18 ASN HB3 H -3.233 2.409 9.601 1.00 . A A . 18 ASN HB3 1 1 18 10932 1 1 18 ASN HD21 H -4.988 1.580 11.029 1.00 . A A . 18 ASN HD21 1 1 18 10933 1 1 18 ASN HD22 H -5.506 2.682 12.290 1.00 . A A . 18 ASN HD22 1 1 18 10934 1 1 18 ASN N N -2.365 4.204 7.709 1.00 . A A . 18 ASN N 1 1 18 10935 1 1 18 ASN ND2 N -5.124 2.531 11.367 1.00 . A A . 18 ASN ND2 1 1 18 10936 1 1 18 ASN O O -1.814 3.939 11.258 1.00 . A A . 18 ASN O 1 1 18 10937 1 1 18 ASN OD1 O -4.817 4.721 11.174 1.00 . A A . 18 ASN OD1 1 1 18 10938 1 1 19 ASN C C 1.032 3.127 10.837 1.00 . A A . 19 ASN C 1 1 18 10939 1 1 19 ASN CA C 0.775 4.572 10.384 1.00 . A A . 19 ASN CA 1 1 18 10940 1 1 19 ASN CB C 0.885 5.627 11.479 1.00 . A A . 19 ASN CB 1 1 18 10941 1 1 19 ASN CG C 2.224 5.552 12.189 1.00 . A A . 19 ASN CG 1 1 18 10942 1 1 19 ASN H H -0.427 5.053 8.709 1.00 . A A . 19 ASN H 1 1 18 10943 1 1 19 ASN HA H 1.546 4.793 9.671 1.00 . A A . 19 ASN HA 1 1 18 10944 1 1 19 ASN HB2 H 0.755 6.620 11.045 1.00 . A A . 19 ASN HB2 1 1 18 10945 1 1 19 ASN HB3 H 0.083 5.467 12.190 1.00 . A A . 19 ASN HB3 1 1 18 10946 1 1 19 ASN HD21 H 1.331 5.371 13.983 1.00 . A A . 19 ASN HD21 1 1 18 10947 1 1 19 ASN HD22 H 3.059 5.363 14.056 1.00 . A A . 19 ASN HD22 1 1 18 10948 1 1 19 ASN N N -0.472 4.739 9.662 1.00 . A A . 19 ASN N 1 1 18 10949 1 1 19 ASN ND2 N 2.217 5.450 13.503 1.00 . A A . 19 ASN ND2 1 1 18 10950 1 1 19 ASN O O 1.115 2.832 12.029 1.00 . A A . 19 ASN O 1 1 18 10951 1 1 19 ASN OD1 O 3.271 5.613 11.553 1.00 . A A . 19 ASN OD1 1 1 18 10952 1 1 20 GLY C C 0.560 -0.076 10.710 1.00 . A A . 20 GLY C 1 1 18 10953 1 1 20 GLY CA C 1.628 0.854 10.133 1.00 . A A . 20 GLY CA 1 1 18 10954 1 1 20 GLY H H 0.990 2.469 8.915 1.00 . A A . 20 GLY H 1 1 18 10955 1 1 20 GLY HA2 H 2.487 0.909 10.801 1.00 . A A . 20 GLY HA2 1 1 18 10956 1 1 20 GLY HA3 H 1.978 0.429 9.197 1.00 . A A . 20 GLY HA3 1 1 18 10957 1 1 20 GLY N N 1.136 2.204 9.882 1.00 . A A . 20 GLY N 1 1 18 10958 1 1 20 GLY O O 0.890 -1.096 11.317 1.00 . A A . 20 GLY O 1 1 18 10959 1 1 21 THR C C -3.093 -0.235 10.118 1.00 . A A . 21 THR C 1 1 18 10960 1 1 21 THR CA C -1.854 -0.546 10.982 1.00 . A A . 21 THR CA 1 1 18 10961 1 1 21 THR CB C -2.023 -0.482 12.512 1.00 . A A . 21 THR CB 1 1 18 10962 1 1 21 THR CG2 C -2.118 0.956 12.966 1.00 . A A . 21 THR CG2 1 1 18 10963 1 1 21 THR H H -0.921 1.124 10.048 1.00 . A A . 21 THR H 1 1 18 10964 1 1 21 THR HA H -1.596 -1.568 10.820 1.00 . A A . 21 THR HA 1 1 18 10965 1 1 21 THR HB H -1.136 -0.913 12.976 1.00 . A A . 21 THR HB 1 1 18 10966 1 1 21 THR HG1 H -3.707 -1.381 12.210 1.00 . A A . 21 THR HG1 1 1 18 10967 1 1 21 THR HG21 H -2.940 1.430 12.442 1.00 . A A . 21 THR HG21 1 1 18 10968 1 1 21 THR HG22 H -2.247 1.001 14.043 1.00 . A A . 21 THR HG22 1 1 18 10969 1 1 21 THR HG23 H -1.191 1.446 12.696 1.00 . A A . 21 THR HG23 1 1 18 10970 1 1 21 THR N N -0.718 0.263 10.538 1.00 . A A . 21 THR N 1 1 18 10971 1 1 21 THR O O -4.219 -0.152 10.618 1.00 . A A . 21 THR O 1 1 18 10972 1 1 21 THR OG1 O -3.146 -1.207 12.984 1.00 . A A . 21 THR OG1 1 1 18 10973 1 1 22 GLY C C -3.764 -0.945 6.784 1.00 . A A . 22 GLY C 1 1 18 10974 1 1 22 GLY CA C -3.912 0.180 7.806 1.00 . A A . 22 GLY CA 1 1 18 10975 1 1 22 GLY H H -1.963 -0.166 8.442 1.00 . A A . 22 GLY H 1 1 18 10976 1 1 22 GLY HA2 H -3.782 1.142 7.316 1.00 . A A . 22 GLY HA2 1 1 18 10977 1 1 22 GLY HA3 H -4.906 0.132 8.251 1.00 . A A . 22 GLY HA3 1 1 18 10978 1 1 22 GLY N N -2.882 0.009 8.823 1.00 . A A . 22 GLY N 1 1 18 10979 1 1 22 GLY O O -2.842 -1.755 6.923 1.00 . A A . 22 GLY O 1 1 18 10980 1 1 23 PRO C C -3.366 -2.399 4.201 1.00 . A A . 23 PRO C 1 1 18 10981 1 1 23 PRO CA C -4.698 -2.216 4.927 1.00 . A A . 23 PRO CA 1 1 18 10982 1 1 23 PRO CB C -5.897 -2.036 3.997 1.00 . A A . 23 PRO CB 1 1 18 10983 1 1 23 PRO CD C -5.590 -0.020 5.331 1.00 . A A . 23 PRO CD 1 1 18 10984 1 1 23 PRO CG C -6.233 -0.553 4.058 1.00 . A A . 23 PRO CG 1 1 18 10985 1 1 23 PRO HA H -4.886 -3.086 5.550 1.00 . A A . 23 PRO HA 1 1 18 10986 1 1 23 PRO HB2 H -5.671 -2.344 2.977 1.00 . A A . 23 PRO HB2 1 1 18 10987 1 1 23 PRO HB3 H -6.738 -2.612 4.375 1.00 . A A . 23 PRO HB3 1 1 18 10988 1 1 23 PRO HD2 H -5.109 0.917 5.096 1.00 . A A . 23 PRO HD2 1 1 18 10989 1 1 23 PRO HD3 H -6.333 0.196 6.082 1.00 . A A . 23 PRO HD3 1 1 18 10990 1 1 23 PRO HG2 H -5.781 -0.054 3.200 1.00 . A A . 23 PRO HG2 1 1 18 10991 1 1 23 PRO HG3 H -7.312 -0.401 4.084 1.00 . A A . 23 PRO HG3 1 1 18 10992 1 1 23 PRO N N -4.643 -1.034 5.771 1.00 . A A . 23 PRO N 1 1 18 10993 1 1 23 PRO O O -2.726 -3.446 4.326 1.00 . A A . 23 PRO O 1 1 18 10994 1 1 24 CYS C C -0.580 -0.829 3.948 1.00 . A A . 24 CYS C 1 1 18 10995 1 1 24 CYS CA C -1.584 -1.338 2.911 1.00 . A A . 24 CYS CA 1 1 18 10996 1 1 24 CYS CB C -1.565 -0.551 1.590 1.00 . A A . 24 CYS CB 1 1 18 10997 1 1 24 CYS H H -3.413 -0.484 3.545 1.00 . A A . 24 CYS H 1 1 18 10998 1 1 24 CYS HA H -1.307 -2.361 2.659 1.00 . A A . 24 CYS HA 1 1 18 10999 1 1 24 CYS HB2 H -0.841 0.258 1.644 1.00 . A A . 24 CYS HB2 1 1 18 11000 1 1 24 CYS HB3 H -1.224 -1.252 0.837 1.00 . A A . 24 CYS HB3 1 1 18 11001 1 1 24 CYS N N -2.904 -1.356 3.509 1.00 . A A . 24 CYS N 1 1 18 11002 1 1 24 CYS O O -0.139 0.314 3.879 1.00 . A A . 24 CYS O 1 1 18 11003 1 1 24 CYS SG S -3.092 0.127 0.911 1.00 . A A . 24 CYS SG 1 1 18 11004 1 1 25 ALA C C 2.020 -2.310 5.797 1.00 . A A . 25 ALA C 1 1 18 11005 1 1 25 ALA CA C 0.830 -1.371 5.896 1.00 . A A . 25 ALA CA 1 1 18 11006 1 1 25 ALA CB C 0.262 -1.369 7.310 1.00 . A A . 25 ALA CB 1 1 18 11007 1 1 25 ALA H H -0.717 -2.550 4.965 1.00 . A A . 25 ALA H 1 1 18 11008 1 1 25 ALA HA H 1.209 -0.376 5.699 1.00 . A A . 25 ALA HA 1 1 18 11009 1 1 25 ALA HB1 H -0.233 -2.316 7.522 1.00 . A A . 25 ALA HB1 1 1 18 11010 1 1 25 ALA HB2 H -0.447 -0.551 7.409 1.00 . A A . 25 ALA HB2 1 1 18 11011 1 1 25 ALA HB3 H 1.080 -1.228 8.012 1.00 . A A . 25 ALA HB3 1 1 18 11012 1 1 25 ALA N N -0.206 -1.679 4.911 1.00 . A A . 25 ALA N 1 1 18 11013 1 1 25 ALA O O 3.169 -1.866 5.769 1.00 . A A . 25 ALA O 1 1 18 11014 1 1 26 ASN C C 3.610 -4.459 4.328 1.00 . A A . 26 ASN C 1 1 18 11015 1 1 26 ASN CA C 2.856 -4.593 5.651 1.00 . A A . 26 ASN CA 1 1 18 11016 1 1 26 ASN CB C 2.296 -6.008 5.802 1.00 . A A . 26 ASN CB 1 1 18 11017 1 1 26 ASN CG C 1.748 -6.294 7.194 1.00 . A A . 26 ASN CG 1 1 18 11018 1 1 26 ASN H H 0.829 -3.942 5.865 1.00 . A A . 26 ASN H 1 1 18 11019 1 1 26 ASN HA H 3.557 -4.402 6.466 1.00 . A A . 26 ASN HA 1 1 18 11020 1 1 26 ASN HB2 H 1.512 -6.179 5.063 1.00 . A A . 26 ASN HB2 1 1 18 11021 1 1 26 ASN HB3 H 3.105 -6.710 5.607 1.00 . A A . 26 ASN HB3 1 1 18 11022 1 1 26 ASN HD21 H 1.726 -8.293 6.845 1.00 . A A . 26 ASN HD21 1 1 18 11023 1 1 26 ASN HD22 H 1.068 -7.761 8.381 1.00 . A A . 26 ASN HD22 1 1 18 11024 1 1 26 ASN N N 1.773 -3.613 5.730 1.00 . A A . 26 ASN N 1 1 18 11025 1 1 26 ASN ND2 N 1.555 -7.555 7.512 1.00 . A A . 26 ASN ND2 1 1 18 11026 1 1 26 ASN O O 4.802 -4.764 4.261 1.00 . A A . 26 ASN O 1 1 18 11027 1 1 26 ASN OD1 O 1.492 -5.392 7.990 1.00 . A A . 26 ASN OD1 1 1 18 11028 1 1 27 CYS C C 4.555 -2.495 2.064 1.00 . A A . 27 CYS C 1 1 18 11029 1 1 27 CYS CA C 3.453 -3.562 2.004 1.00 . A A . 27 CYS CA 1 1 18 11030 1 1 27 CYS CB C 2.305 -3.126 1.078 1.00 . A A . 27 CYS CB 1 1 18 11031 1 1 27 CYS H H 1.950 -3.731 3.467 1.00 . A A . 27 CYS H 1 1 18 11032 1 1 27 CYS HA H 3.879 -4.451 1.540 1.00 . A A . 27 CYS HA 1 1 18 11033 1 1 27 CYS HB2 H 1.957 -2.119 1.312 1.00 . A A . 27 CYS HB2 1 1 18 11034 1 1 27 CYS HB3 H 2.715 -3.088 0.070 1.00 . A A . 27 CYS HB3 1 1 18 11035 1 1 27 CYS N N 2.927 -3.922 3.311 1.00 . A A . 27 CYS N 1 1 18 11036 1 1 27 CYS O O 5.055 -2.136 1.012 1.00 . A A . 27 CYS O 1 1 18 11037 1 1 27 CYS SG S 0.912 -4.295 1.065 1.00 . A A . 27 CYS SG 1 1 18 11038 1 1 28 LEU C C 7.155 -1.535 4.074 1.00 . A A . 28 LEU C 1 1 18 11039 1 1 28 LEU CA C 5.946 -0.917 3.383 1.00 . A A . 28 LEU CA 1 1 18 11040 1 1 28 LEU CB C 5.400 0.215 4.275 1.00 . A A . 28 LEU CB 1 1 18 11041 1 1 28 LEU CD1 C 4.746 2.124 2.698 1.00 . A A . 28 LEU CD1 1 1 18 11042 1 1 28 LEU CD2 C 3.126 0.335 3.060 1.00 . A A . 28 LEU CD2 1 1 18 11043 1 1 28 LEU CG C 4.279 1.089 3.708 1.00 . A A . 28 LEU CG 1 1 18 11044 1 1 28 LEU H H 4.317 -2.040 4.041 1.00 . A A . 28 LEU H 1 1 18 11045 1 1 28 LEU HA H 6.252 -0.515 2.418 1.00 . A A . 28 LEU HA 1 1 18 11046 1 1 28 LEU HB2 H 5.021 -0.210 5.206 1.00 . A A . 28 LEU HB2 1 1 18 11047 1 1 28 LEU HB3 H 6.230 0.867 4.549 1.00 . A A . 28 LEU HB3 1 1 18 11048 1 1 28 LEU HD11 H 5.718 2.523 2.986 1.00 . A A . 28 LEU HD11 1 1 18 11049 1 1 28 LEU HD12 H 4.819 1.630 1.737 1.00 . A A . 28 LEU HD12 1 1 18 11050 1 1 28 LEU HD13 H 4.022 2.931 2.624 1.00 . A A . 28 LEU HD13 1 1 18 11051 1 1 28 LEU HD21 H 2.809 -0.473 3.707 1.00 . A A . 28 LEU HD21 1 1 18 11052 1 1 28 LEU HD22 H 2.286 1.009 2.947 1.00 . A A . 28 LEU HD22 1 1 18 11053 1 1 28 LEU HD23 H 3.456 -0.040 2.082 1.00 . A A . 28 LEU HD23 1 1 18 11054 1 1 28 LEU HG H 3.877 1.597 4.561 1.00 . A A . 28 LEU HG 1 1 18 11055 1 1 28 LEU N N 4.913 -1.936 3.230 1.00 . A A . 28 LEU N 1 1 18 11056 1 1 28 LEU O O 8.275 -1.526 3.567 1.00 . A A . 28 LEU O 1 1 18 11057 1 1 29 ALA C C 8.886 -3.454 5.699 1.00 . A A . 29 ALA C 1 1 18 11058 1 1 29 ALA CA C 7.954 -2.372 6.237 1.00 . A A . 29 ALA CA 1 1 18 11059 1 1 29 ALA CB C 7.278 -2.791 7.540 1.00 . A A . 29 ALA CB 1 1 18 11060 1 1 29 ALA H H 5.958 -2.062 5.598 1.00 . A A . 29 ALA H 1 1 18 11061 1 1 29 ALA HA H 8.542 -1.472 6.406 1.00 . A A . 29 ALA HA 1 1 18 11062 1 1 29 ALA HB1 H 8.041 -3.026 8.277 1.00 . A A . 29 ALA HB1 1 1 18 11063 1 1 29 ALA HB2 H 6.655 -3.673 7.380 1.00 . A A . 29 ALA HB2 1 1 18 11064 1 1 29 ALA HB3 H 6.665 -1.971 7.906 1.00 . A A . 29 ALA HB3 1 1 18 11065 1 1 29 ALA N N 6.914 -2.055 5.279 1.00 . A A . 29 ALA N 1 1 18 11066 1 1 29 ALA O O 10.109 -3.287 5.662 1.00 . A A . 29 ALA O 1 1 18 11067 1 1 30 GLY C C 8.373 -5.676 3.152 1.00 . A A . 30 GLY C 1 1 18 11068 1 1 30 GLY CA C 8.979 -5.609 4.535 1.00 . A A . 30 GLY CA 1 1 18 11069 1 1 30 GLY H H 7.281 -4.580 5.243 1.00 . A A . 30 GLY H 1 1 18 11070 1 1 30 GLY HA2 H 8.810 -6.550 5.059 1.00 . A A . 30 GLY HA2 1 1 18 11071 1 1 30 GLY HA3 H 10.050 -5.424 4.469 1.00 . A A . 30 GLY HA3 1 1 18 11072 1 1 30 GLY N N 8.292 -4.546 5.228 1.00 . A A . 30 GLY N 1 1 18 11073 1 1 30 GLY O O 7.517 -6.534 2.924 1.00 . A A . 30 GLY O 1 1 18 11074 1 1 31 TYR C C 9.172 -5.200 -0.240 1.00 . A A . 31 TYR C 1 1 18 11075 1 1 31 TYR CA C 8.207 -4.812 0.891 1.00 . A A . 31 TYR CA 1 1 18 11076 1 1 31 TYR CB C 7.641 -3.401 0.674 1.00 . A A . 31 TYR CB 1 1 18 11077 1 1 31 TYR CD1 C 9.911 -2.341 0.132 1.00 . A A . 31 TYR CD1 1 1 18 11078 1 1 31 TYR CD2 C 7.878 -1.381 -0.783 1.00 . A A . 31 TYR CD2 1 1 18 11079 1 1 31 TYR CE1 C 10.659 -1.391 -0.577 1.00 . A A . 31 TYR CE1 1 1 18 11080 1 1 31 TYR CE2 C 8.604 -0.404 -1.486 1.00 . A A . 31 TYR CE2 1 1 18 11081 1 1 31 TYR CG C 8.509 -2.327 0.036 1.00 . A A . 31 TYR CG 1 1 18 11082 1 1 31 TYR CZ C 10.018 -0.417 -1.384 1.00 . A A . 31 TYR CZ 1 1 18 11083 1 1 31 TYR H H 9.488 -4.096 2.458 1.00 . A A . 31 TYR H 1 1 18 11084 1 1 31 TYR HA H 7.363 -5.480 0.834 1.00 . A A . 31 TYR HA 1 1 18 11085 1 1 31 TYR HB2 H 6.815 -3.585 -0.007 1.00 . A A . 31 TYR HB2 1 1 18 11086 1 1 31 TYR HB3 H 7.236 -2.965 1.594 1.00 . A A . 31 TYR HB3 1 1 18 11087 1 1 31 TYR HD1 H 10.404 -3.150 0.657 1.00 . A A . 31 TYR HD1 1 1 18 11088 1 1 31 TYR HD2 H 6.809 -1.429 -0.833 1.00 . A A . 31 TYR HD2 1 1 18 11089 1 1 31 TYR HE1 H 11.729 -1.443 -0.516 1.00 . A A . 31 TYR HE1 1 1 18 11090 1 1 31 TYR HE2 H 8.051 0.337 -2.071 1.00 . A A . 31 TYR HE2 1 1 18 11091 1 1 31 TYR HH H 10.358 0.913 -2.817 1.00 . A A . 31 TYR HH 1 1 18 11092 1 1 31 TYR N N 8.782 -4.788 2.232 1.00 . A A . 31 TYR N 1 1 18 11093 1 1 31 TYR O O 9.033 -4.698 -1.359 1.00 . A A . 31 TYR O 1 1 18 11094 1 1 31 TYR OH O 10.796 0.470 -2.067 1.00 . A A . 31 TYR OH 1 1 18 11095 1 1 32 PRO C C 10.073 -7.412 -2.332 1.00 . A A . 32 PRO C 1 1 18 11096 1 1 32 PRO CA C 10.829 -6.657 -1.224 1.00 . A A . 32 PRO CA 1 1 18 11097 1 1 32 PRO CB C 11.922 -7.520 -0.592 1.00 . A A . 32 PRO CB 1 1 18 11098 1 1 32 PRO CD C 10.251 -7.076 1.040 1.00 . A A . 32 PRO CD 1 1 18 11099 1 1 32 PRO CG C 11.196 -8.176 0.577 1.00 . A A . 32 PRO CG 1 1 18 11100 1 1 32 PRO HA H 11.270 -5.728 -1.604 1.00 . A A . 32 PRO HA 1 1 18 11101 1 1 32 PRO HB2 H 12.328 -8.251 -1.286 1.00 . A A . 32 PRO HB2 1 1 18 11102 1 1 32 PRO HB3 H 12.729 -6.893 -0.216 1.00 . A A . 32 PRO HB3 1 1 18 11103 1 1 32 PRO HD2 H 9.355 -7.498 1.479 1.00 . A A . 32 PRO HD2 1 1 18 11104 1 1 32 PRO HD3 H 10.752 -6.438 1.762 1.00 . A A . 32 PRO HD3 1 1 18 11105 1 1 32 PRO HG2 H 10.624 -9.039 0.232 1.00 . A A . 32 PRO HG2 1 1 18 11106 1 1 32 PRO HG3 H 11.881 -8.449 1.372 1.00 . A A . 32 PRO HG3 1 1 18 11107 1 1 32 PRO N N 9.940 -6.294 -0.136 1.00 . A A . 32 PRO N 1 1 18 11108 1 1 32 PRO O O 10.670 -7.719 -3.363 1.00 . A A . 32 PRO O 1 1 18 11109 1 1 33 ALA C C 6.659 -7.572 -3.377 1.00 . A A . 33 ALA C 1 1 18 11110 1 1 33 ALA CA C 7.913 -8.407 -3.073 1.00 . A A . 33 ALA CA 1 1 18 11111 1 1 33 ALA CB C 7.539 -9.789 -2.523 1.00 . A A . 33 ALA CB 1 1 18 11112 1 1 33 ALA H H 8.378 -7.529 -1.216 1.00 . A A . 33 ALA H 1 1 18 11113 1 1 33 ALA HA H 8.445 -8.550 -4.014 1.00 . A A . 33 ALA HA 1 1 18 11114 1 1 33 ALA HB1 H 6.905 -10.308 -3.246 1.00 . A A . 33 ALA HB1 1 1 18 11115 1 1 33 ALA HB2 H 8.445 -10.373 -2.360 1.00 . A A . 33 ALA HB2 1 1 18 11116 1 1 33 ALA HB3 H 6.989 -9.670 -1.586 1.00 . A A . 33 ALA HB3 1 1 18 11117 1 1 33 ALA N N 8.793 -7.750 -2.113 1.00 . A A . 33 ALA N 1 1 18 11118 1 1 33 ALA O O 5.823 -8.008 -4.171 1.00 . A A . 33 ALA O 1 1 18 11119 1 1 34 GLY C C 4.981 -5.114 -4.281 1.00 . A A . 34 GLY C 1 1 18 11120 1 1 34 GLY CA C 5.248 -5.642 -2.873 1.00 . A A . 34 GLY CA 1 1 18 11121 1 1 34 GLY H H 7.232 -6.013 -2.194 1.00 . A A . 34 GLY H 1 1 18 11122 1 1 34 GLY HA2 H 5.254 -4.812 -2.169 1.00 . A A . 34 GLY HA2 1 1 18 11123 1 1 34 GLY HA3 H 4.427 -6.308 -2.611 1.00 . A A . 34 GLY HA3 1 1 18 11124 1 1 34 GLY N N 6.493 -6.394 -2.767 1.00 . A A . 34 GLY N 1 1 18 11125 1 1 34 GLY O O 3.826 -5.082 -4.703 1.00 . A A . 34 GLY O 1 1 18 11126 1 1 35 CYS C C 5.365 -5.549 -7.305 1.00 . A A . 35 CYS C 1 1 18 11127 1 1 35 CYS CA C 5.879 -4.388 -6.448 1.00 . A A . 35 CYS CA 1 1 18 11128 1 1 35 CYS CB C 7.216 -3.902 -7.013 1.00 . A A . 35 CYS CB 1 1 18 11129 1 1 35 CYS H H 6.955 -4.814 -4.654 1.00 . A A . 35 CYS H 1 1 18 11130 1 1 35 CYS HA H 5.160 -3.572 -6.494 1.00 . A A . 35 CYS HA 1 1 18 11131 1 1 35 CYS HB2 H 7.842 -4.771 -7.207 1.00 . A A . 35 CYS HB2 1 1 18 11132 1 1 35 CYS HB3 H 7.035 -3.409 -7.968 1.00 . A A . 35 CYS HB3 1 1 18 11133 1 1 35 CYS N N 6.022 -4.779 -5.047 1.00 . A A . 35 CYS N 1 1 18 11134 1 1 35 CYS O O 4.839 -5.327 -8.396 1.00 . A A . 35 CYS O 1 1 18 11135 1 1 35 CYS SG S 8.123 -2.773 -5.935 1.00 . A A . 35 CYS SG 1 1 18 11136 1 1 36 SER C C 3.479 -8.147 -7.133 1.00 . A A . 36 SER C 1 1 18 11137 1 1 36 SER CA C 4.953 -7.951 -7.508 1.00 . A A . 36 SER CA 1 1 18 11138 1 1 36 SER CB C 5.860 -9.153 -7.212 1.00 . A A . 36 SER CB 1 1 18 11139 1 1 36 SER H H 6.063 -6.991 -6.028 1.00 . A A . 36 SER H 1 1 18 11140 1 1 36 SER HA H 4.988 -7.767 -8.579 1.00 . A A . 36 SER HA 1 1 18 11141 1 1 36 SER HB2 H 5.748 -9.856 -8.021 1.00 . A A . 36 SER HB2 1 1 18 11142 1 1 36 SER HB3 H 6.903 -8.830 -7.206 1.00 . A A . 36 SER HB3 1 1 18 11143 1 1 36 SER HG H 5.675 -9.168 -5.266 1.00 . A A . 36 SER HG 1 1 18 11144 1 1 36 SER N N 5.518 -6.799 -6.855 1.00 . A A . 36 SER N 1 1 18 11145 1 1 36 SER O O 2.712 -8.613 -7.978 1.00 . A A . 36 SER O 1 1 18 11146 1 1 36 SER OG O 5.590 -9.822 -5.997 1.00 . A A . 36 SER OG 1 1 18 11147 1 1 37 ASN C C 0.834 -6.873 -6.010 1.00 . A A . 37 ASN C 1 1 18 11148 1 1 37 ASN CA C 1.710 -7.957 -5.417 1.00 . A A . 37 ASN CA 1 1 18 11149 1 1 37 ASN CB C 1.631 -7.854 -3.872 1.00 . A A . 37 ASN CB 1 1 18 11150 1 1 37 ASN CG C 1.464 -9.217 -3.241 1.00 . A A . 37 ASN CG 1 1 18 11151 1 1 37 ASN H H 3.731 -7.299 -5.308 1.00 . A A . 37 ASN H 1 1 18 11152 1 1 37 ASN HA H 1.338 -8.931 -5.734 1.00 . A A . 37 ASN HA 1 1 18 11153 1 1 37 ASN HB2 H 2.468 -7.316 -3.437 1.00 . A A . 37 ASN HB2 1 1 18 11154 1 1 37 ASN HB3 H 0.745 -7.286 -3.580 1.00 . A A . 37 ASN HB3 1 1 18 11155 1 1 37 ASN HD21 H -0.377 -9.328 -4.042 1.00 . A A . 37 ASN HD21 1 1 18 11156 1 1 37 ASN HD22 H 0.094 -10.680 -3.020 1.00 . A A . 37 ASN HD22 1 1 18 11157 1 1 37 ASN N N 3.071 -7.771 -5.913 1.00 . A A . 37 ASN N 1 1 18 11158 1 1 37 ASN ND2 N 0.310 -9.804 -3.470 1.00 . A A . 37 ASN ND2 1 1 18 11159 1 1 37 ASN O O 0.832 -5.765 -5.482 1.00 . A A . 37 ASN O 1 1 18 11160 1 1 37 ASN OD1 O 2.310 -9.738 -2.524 1.00 . A A . 37 ASN OD1 1 1 18 11161 1 1 38 SER C C -1.719 -5.462 -6.752 1.00 . A A . 38 SER C 1 1 18 11162 1 1 38 SER CA C -0.759 -6.161 -7.742 1.00 . A A . 38 SER CA 1 1 18 11163 1 1 38 SER CB C -1.485 -6.839 -8.909 1.00 . A A . 38 SER CB 1 1 18 11164 1 1 38 SER H H 0.122 -8.095 -7.447 1.00 . A A . 38 SER H 1 1 18 11165 1 1 38 SER HA H -0.089 -5.413 -8.174 1.00 . A A . 38 SER HA 1 1 18 11166 1 1 38 SER HB2 H -0.773 -7.488 -9.415 1.00 . A A . 38 SER HB2 1 1 18 11167 1 1 38 SER HB3 H -2.314 -7.442 -8.536 1.00 . A A . 38 SER HB3 1 1 18 11168 1 1 38 SER HG H -2.915 -5.813 -9.725 1.00 . A A . 38 SER HG 1 1 18 11169 1 1 38 SER N N 0.084 -7.154 -7.077 1.00 . A A . 38 SER N 1 1 18 11170 1 1 38 SER O O -2.055 -4.295 -6.960 1.00 . A A . 38 SER O 1 1 18 11171 1 1 38 SER OG O -1.948 -5.895 -9.854 1.00 . A A . 38 SER OG 1 1 18 11172 1 1 39 ASP C C -2.287 -4.352 -3.933 1.00 . A A . 39 ASP C 1 1 18 11173 1 1 39 ASP CA C -2.919 -5.592 -4.562 1.00 . A A . 39 ASP CA 1 1 18 11174 1 1 39 ASP CB C -3.149 -6.668 -3.485 1.00 . A A . 39 ASP CB 1 1 18 11175 1 1 39 ASP CG C -4.105 -6.215 -2.362 1.00 . A A . 39 ASP CG 1 1 18 11176 1 1 39 ASP H H -1.750 -7.075 -5.539 1.00 . A A . 39 ASP H 1 1 18 11177 1 1 39 ASP HA H -3.886 -5.311 -4.981 1.00 . A A . 39 ASP HA 1 1 18 11178 1 1 39 ASP HB2 H -3.589 -7.540 -3.963 1.00 . A A . 39 ASP HB2 1 1 18 11179 1 1 39 ASP HB3 H -2.190 -6.994 -3.065 1.00 . A A . 39 ASP HB3 1 1 18 11180 1 1 39 ASP N N -2.091 -6.126 -5.646 1.00 . A A . 39 ASP N 1 1 18 11181 1 1 39 ASP O O -3.000 -3.391 -3.661 1.00 . A A . 39 ASP O 1 1 18 11182 1 1 39 ASP OD1 O -5.307 -5.978 -2.638 1.00 . A A . 39 ASP OD1 1 1 18 11183 1 1 39 ASP OD2 O -3.718 -6.283 -1.172 1.00 . A A . 39 ASP OD2 1 1 18 11184 1 1 40 CYS C C 0.662 -2.487 -4.148 1.00 . A A . 40 CYS C 1 1 18 11185 1 1 40 CYS CA C -0.203 -3.245 -3.143 1.00 . A A . 40 CYS CA 1 1 18 11186 1 1 40 CYS CB C 0.622 -3.776 -1.953 1.00 . A A . 40 CYS CB 1 1 18 11187 1 1 40 CYS H H -0.416 -5.090 -4.164 1.00 . A A . 40 CYS H 1 1 18 11188 1 1 40 CYS HA H -0.903 -2.512 -2.744 1.00 . A A . 40 CYS HA 1 1 18 11189 1 1 40 CYS HB2 H 0.957 -4.806 -2.145 1.00 . A A . 40 CYS HB2 1 1 18 11190 1 1 40 CYS HB3 H 1.528 -3.175 -1.825 1.00 . A A . 40 CYS HB3 1 1 18 11191 1 1 40 CYS N N -0.960 -4.334 -3.762 1.00 . A A . 40 CYS N 1 1 18 11192 1 1 40 CYS O O 1.134 -1.402 -3.831 1.00 . A A . 40 CYS O 1 1 18 11193 1 1 40 CYS SG S -0.329 -3.641 -0.406 1.00 . A A . 40 CYS SG 1 1 18 11194 1 1 41 THR C C 1.331 -0.975 -6.665 1.00 . A A . 41 THR C 1 1 18 11195 1 1 41 THR CA C 1.704 -2.428 -6.382 1.00 . A A . 41 THR CA 1 1 18 11196 1 1 41 THR CB C 1.570 -3.310 -7.623 1.00 . A A . 41 THR CB 1 1 18 11197 1 1 41 THR CG2 C 2.162 -2.759 -8.909 1.00 . A A . 41 THR CG2 1 1 18 11198 1 1 41 THR H H 0.454 -3.909 -5.561 1.00 . A A . 41 THR H 1 1 18 11199 1 1 41 THR HA H 2.737 -2.459 -6.029 1.00 . A A . 41 THR HA 1 1 18 11200 1 1 41 THR HB H 0.510 -3.481 -7.799 1.00 . A A . 41 THR HB 1 1 18 11201 1 1 41 THR HG1 H 2.025 -4.830 -6.484 1.00 . A A . 41 THR HG1 1 1 18 11202 1 1 41 THR HG21 H 1.685 -1.812 -9.163 1.00 . A A . 41 THR HG21 1 1 18 11203 1 1 41 THR HG22 H 3.234 -2.620 -8.781 1.00 . A A . 41 THR HG22 1 1 18 11204 1 1 41 THR HG23 H 1.969 -3.489 -9.696 1.00 . A A . 41 THR HG23 1 1 18 11205 1 1 41 THR N N 0.851 -3.002 -5.360 1.00 . A A . 41 THR N 1 1 18 11206 1 1 41 THR O O 2.230 -0.137 -6.713 1.00 . A A . 41 THR O 1 1 18 11207 1 1 41 THR OG1 O 2.212 -4.541 -7.395 1.00 . A A . 41 THR OG1 1 1 18 11208 1 1 42 ALA C C -0.119 1.653 -6.126 1.00 . A A . 42 ALA C 1 1 18 11209 1 1 42 ALA CA C -0.388 0.661 -7.251 1.00 . A A . 42 ALA CA 1 1 18 11210 1 1 42 ALA CB C -1.867 0.658 -7.640 1.00 . A A . 42 ALA CB 1 1 18 11211 1 1 42 ALA H H -0.667 -1.377 -6.714 1.00 . A A . 42 ALA H 1 1 18 11212 1 1 42 ALA HA H 0.197 0.969 -8.119 1.00 . A A . 42 ALA HA 1 1 18 11213 1 1 42 ALA HB1 H -2.032 -0.033 -8.465 1.00 . A A . 42 ALA HB1 1 1 18 11214 1 1 42 ALA HB2 H -2.488 0.366 -6.796 1.00 . A A . 42 ALA HB2 1 1 18 11215 1 1 42 ALA HB3 H -2.153 1.660 -7.952 1.00 . A A . 42 ALA HB3 1 1 18 11216 1 1 42 ALA N N 0.041 -0.672 -6.863 1.00 . A A . 42 ALA N 1 1 18 11217 1 1 42 ALA O O 0.477 2.697 -6.372 1.00 . A A . 42 ALA O 1 1 18 11218 1 1 43 PHE C C 1.309 2.339 -3.696 1.00 . A A . 43 PHE C 1 1 18 11219 1 1 43 PHE CA C -0.189 2.059 -3.694 1.00 . A A . 43 PHE CA 1 1 18 11220 1 1 43 PHE CB C -0.667 1.269 -2.464 1.00 . A A . 43 PHE CB 1 1 18 11221 1 1 43 PHE CD1 C 1.059 1.451 -0.650 1.00 . A A . 43 PHE CD1 1 1 18 11222 1 1 43 PHE CD2 C -1.073 2.530 -0.270 1.00 . A A . 43 PHE CD2 1 1 18 11223 1 1 43 PHE CE1 C 1.533 1.930 0.575 1.00 . A A . 43 PHE CE1 1 1 18 11224 1 1 43 PHE CE2 C -0.622 2.952 0.994 1.00 . A A . 43 PHE CE2 1 1 18 11225 1 1 43 PHE CG C -0.223 1.785 -1.107 1.00 . A A . 43 PHE CG 1 1 18 11226 1 1 43 PHE CZ C 0.689 2.676 1.408 1.00 . A A . 43 PHE CZ 1 1 18 11227 1 1 43 PHE H H -0.990 0.413 -4.790 1.00 . A A . 43 PHE H 1 1 18 11228 1 1 43 PHE HA H -0.699 3.020 -3.719 1.00 . A A . 43 PHE HA 1 1 18 11229 1 1 43 PHE HB2 H -1.753 1.220 -2.492 1.00 . A A . 43 PHE HB2 1 1 18 11230 1 1 43 PHE HB3 H -0.288 0.252 -2.546 1.00 . A A . 43 PHE HB3 1 1 18 11231 1 1 43 PHE HD1 H 1.689 0.831 -1.256 1.00 . A A . 43 PHE HD1 1 1 18 11232 1 1 43 PHE HD2 H -2.082 2.765 -0.573 1.00 . A A . 43 PHE HD2 1 1 18 11233 1 1 43 PHE HE1 H 2.549 1.727 0.860 1.00 . A A . 43 PHE HE1 1 1 18 11234 1 1 43 PHE HE2 H -1.272 3.511 1.643 1.00 . A A . 43 PHE HE2 1 1 18 11235 1 1 43 PHE HZ H 1.046 3.024 2.364 1.00 . A A . 43 PHE HZ 1 1 18 11236 1 1 43 PHE N N -0.518 1.307 -4.898 1.00 . A A . 43 PHE N 1 1 18 11237 1 1 43 PHE O O 1.728 3.490 -3.731 1.00 . A A . 43 PHE O 1 1 18 11238 1 1 44 LEU C C 4.211 2.247 -4.737 1.00 . A A . 44 LEU C 1 1 18 11239 1 1 44 LEU CA C 3.567 1.465 -3.590 1.00 . A A . 44 LEU CA 1 1 18 11240 1 1 44 LEU CB C 4.222 0.097 -3.455 1.00 . A A . 44 LEU CB 1 1 18 11241 1 1 44 LEU CD1 C 4.511 -2.099 -2.371 1.00 . A A . 44 LEU CD1 1 1 18 11242 1 1 44 LEU CD2 C 4.210 -0.017 -0.935 1.00 . A A . 44 LEU CD2 1 1 18 11243 1 1 44 LEU CG C 3.832 -0.734 -2.228 1.00 . A A . 44 LEU CG 1 1 18 11244 1 1 44 LEU H H 1.745 0.356 -3.683 1.00 . A A . 44 LEU H 1 1 18 11245 1 1 44 LEU HA H 3.733 2.048 -2.689 1.00 . A A . 44 LEU HA 1 1 18 11246 1 1 44 LEU HB2 H 4.004 -0.486 -4.345 1.00 . A A . 44 LEU HB2 1 1 18 11247 1 1 44 LEU HB3 H 5.286 0.280 -3.420 1.00 . A A . 44 LEU HB3 1 1 18 11248 1 1 44 LEU HD11 H 5.579 -1.980 -2.551 1.00 . A A . 44 LEU HD11 1 1 18 11249 1 1 44 LEU HD12 H 4.356 -2.696 -1.475 1.00 . A A . 44 LEU HD12 1 1 18 11250 1 1 44 LEU HD13 H 4.077 -2.624 -3.223 1.00 . A A . 44 LEU HD13 1 1 18 11251 1 1 44 LEU HD21 H 3.900 1.023 -0.929 1.00 . A A . 44 LEU HD21 1 1 18 11252 1 1 44 LEU HD22 H 3.707 -0.506 -0.108 1.00 . A A . 44 LEU HD22 1 1 18 11253 1 1 44 LEU HD23 H 5.281 -0.050 -0.810 1.00 . A A . 44 LEU HD23 1 1 18 11254 1 1 44 LEU HG H 2.762 -0.904 -2.194 1.00 . A A . 44 LEU HG 1 1 18 11255 1 1 44 LEU N N 2.134 1.296 -3.729 1.00 . A A . 44 LEU N 1 1 18 11256 1 1 44 LEU O O 5.226 2.908 -4.524 1.00 . A A . 44 LEU O 1 1 18 11257 1 1 45 SER C C 3.824 4.552 -6.559 1.00 . A A . 45 SER C 1 1 18 11258 1 1 45 SER CA C 3.962 3.096 -7.033 1.00 . A A . 45 SER CA 1 1 18 11259 1 1 45 SER CB C 3.099 2.715 -8.245 1.00 . A A . 45 SER CB 1 1 18 11260 1 1 45 SER H H 2.839 1.581 -6.027 1.00 . A A . 45 SER H 1 1 18 11261 1 1 45 SER HA H 5.000 2.928 -7.303 1.00 . A A . 45 SER HA 1 1 18 11262 1 1 45 SER HB2 H 3.075 1.631 -8.345 1.00 . A A . 45 SER HB2 1 1 18 11263 1 1 45 SER HB3 H 2.079 3.060 -8.109 1.00 . A A . 45 SER HB3 1 1 18 11264 1 1 45 SER HG H 2.837 3.584 -9.947 1.00 . A A . 45 SER HG 1 1 18 11265 1 1 45 SER N N 3.627 2.209 -5.929 1.00 . A A . 45 SER N 1 1 18 11266 1 1 45 SER O O 4.826 5.272 -6.476 1.00 . A A . 45 SER O 1 1 18 11267 1 1 45 SER OG O 3.609 3.241 -9.448 1.00 . A A . 45 SER OG 1 1 18 11268 1 1 46 GLN C C 3.225 6.626 -4.388 1.00 . A A . 46 GLN C 1 1 18 11269 1 1 46 GLN CA C 2.343 6.274 -5.598 1.00 . A A . 46 GLN CA 1 1 18 11270 1 1 46 GLN CB C 0.858 6.355 -5.211 1.00 . A A . 46 GLN CB 1 1 18 11271 1 1 46 GLN CD C -0.294 5.544 -7.410 1.00 . A A . 46 GLN CD 1 1 18 11272 1 1 46 GLN CG C -0.112 6.644 -6.364 1.00 . A A . 46 GLN CG 1 1 18 11273 1 1 46 GLN H H 1.825 4.323 -6.185 1.00 . A A . 46 GLN H 1 1 18 11274 1 1 46 GLN HA H 2.544 7.014 -6.374 1.00 . A A . 46 GLN HA 1 1 18 11275 1 1 46 GLN HB2 H 0.555 5.445 -4.697 1.00 . A A . 46 GLN HB2 1 1 18 11276 1 1 46 GLN HB3 H 0.745 7.171 -4.500 1.00 . A A . 46 GLN HB3 1 1 18 11277 1 1 46 GLN HE21 H -1.968 4.811 -6.522 1.00 . A A . 46 GLN HE21 1 1 18 11278 1 1 46 GLN HE22 H -1.332 3.908 -7.880 1.00 . A A . 46 GLN HE22 1 1 18 11279 1 1 46 GLN HG2 H -1.074 6.809 -5.897 1.00 . A A . 46 GLN HG2 1 1 18 11280 1 1 46 GLN HG3 H 0.185 7.565 -6.861 1.00 . A A . 46 GLN HG3 1 1 18 11281 1 1 46 GLN N N 2.616 4.956 -6.144 1.00 . A A . 46 GLN N 1 1 18 11282 1 1 46 GLN NE2 N -1.337 4.736 -7.304 1.00 . A A . 46 GLN NE2 1 1 18 11283 1 1 46 GLN O O 3.547 7.805 -4.236 1.00 . A A . 46 GLN O 1 1 18 11284 1 1 46 GLN OE1 O 0.438 5.443 -8.390 1.00 . A A . 46 GLN OE1 1 1 18 11285 1 1 47 CYS C C 5.802 5.953 -2.338 1.00 . A A . 47 CYS C 1 1 18 11286 1 1 47 CYS CA C 4.277 5.989 -2.255 1.00 . A A . 47 CYS CA 1 1 18 11287 1 1 47 CYS CB C 3.805 5.107 -1.085 1.00 . A A . 47 CYS CB 1 1 18 11288 1 1 47 CYS H H 3.155 4.765 -3.640 1.00 . A A . 47 CYS H 1 1 18 11289 1 1 47 CYS HA H 4.005 7.012 -1.989 1.00 . A A . 47 CYS HA 1 1 18 11290 1 1 47 CYS HB2 H 4.356 4.155 -1.070 1.00 . A A . 47 CYS HB2 1 1 18 11291 1 1 47 CYS HB3 H 4.035 5.652 -0.166 1.00 . A A . 47 CYS HB3 1 1 18 11292 1 1 47 CYS N N 3.595 5.672 -3.520 1.00 . A A . 47 CYS N 1 1 18 11293 1 1 47 CYS O O 6.440 6.793 -1.707 1.00 . A A . 47 CYS O 1 1 18 11294 1 1 47 CYS SG S 2.031 4.771 -1.059 1.00 . A A . 47 CYS SG 1 1 18 11295 1 1 48 TYR C C 8.408 5.134 -4.478 1.00 . A A . 48 TYR C 1 1 18 11296 1 1 48 TYR CA C 7.827 4.754 -3.124 1.00 . A A . 48 TYR CA 1 1 18 11297 1 1 48 TYR CB C 8.176 3.303 -2.842 1.00 . A A . 48 TYR CB 1 1 18 11298 1 1 48 TYR CD1 C 9.164 3.320 -0.509 1.00 . A A . 48 TYR CD1 1 1 18 11299 1 1 48 TYR CD2 C 7.020 2.237 -0.908 1.00 . A A . 48 TYR CD2 1 1 18 11300 1 1 48 TYR CE1 C 9.145 2.886 0.828 1.00 . A A . 48 TYR CE1 1 1 18 11301 1 1 48 TYR CE2 C 7.064 1.717 0.386 1.00 . A A . 48 TYR CE2 1 1 18 11302 1 1 48 TYR CG C 8.112 2.970 -1.377 1.00 . A A . 48 TYR CG 1 1 18 11303 1 1 48 TYR CZ C 8.110 2.037 1.271 1.00 . A A . 48 TYR CZ 1 1 18 11304 1 1 48 TYR H H 5.788 4.341 -3.560 1.00 . A A . 48 TYR H 1 1 18 11305 1 1 48 TYR HA H 8.341 5.287 -2.339 1.00 . A A . 48 TYR HA 1 1 18 11306 1 1 48 TYR HB2 H 7.533 2.634 -3.414 1.00 . A A . 48 TYR HB2 1 1 18 11307 1 1 48 TYR HB3 H 9.202 3.130 -3.160 1.00 . A A . 48 TYR HB3 1 1 18 11308 1 1 48 TYR HD1 H 9.996 3.908 -0.871 1.00 . A A . 48 TYR HD1 1 1 18 11309 1 1 48 TYR HD2 H 6.222 1.966 -1.583 1.00 . A A . 48 TYR HD2 1 1 18 11310 1 1 48 TYR HE1 H 9.927 3.183 1.503 1.00 . A A . 48 TYR HE1 1 1 18 11311 1 1 48 TYR HE2 H 6.325 1.007 0.674 1.00 . A A . 48 TYR HE2 1 1 18 11312 1 1 48 TYR HH H 8.942 1.550 2.984 1.00 . A A . 48 TYR HH 1 1 18 11313 1 1 48 TYR N N 6.383 4.983 -3.050 1.00 . A A . 48 TYR N 1 1 18 11314 1 1 48 TYR O O 9.573 5.525 -4.558 1.00 . A A . 48 TYR O 1 1 18 11315 1 1 48 TYR OH O 8.078 1.546 2.535 1.00 . A A . 48 TYR OH 1 1 18 11316 1 1 49 GLY C C 7.995 3.610 -7.588 1.00 . A A . 49 GLY C 1 1 18 11317 1 1 49 GLY CA C 8.120 4.981 -6.923 1.00 . A A . 49 GLY CA 1 1 18 11318 1 1 49 GLY H H 6.668 4.696 -5.416 1.00 . A A . 49 GLY H 1 1 18 11319 1 1 49 GLY HA2 H 9.160 5.308 -6.964 1.00 . A A . 49 GLY HA2 1 1 18 11320 1 1 49 GLY HA3 H 7.517 5.693 -7.485 1.00 . A A . 49 GLY HA3 1 1 18 11321 1 1 49 GLY N N 7.639 4.950 -5.548 1.00 . A A . 49 GLY N 1 1 18 11322 1 1 49 GLY O O 8.252 3.495 -8.786 1.00 . A A . 49 GLY O 1 1 18 11323 1 1 50 GLY C C 8.247 0.380 -7.768 1.00 . A A . 50 GLY C 1 1 18 11324 1 1 50 GLY CA C 7.109 1.335 -7.433 1.00 . A A . 50 GLY CA 1 1 18 11325 1 1 50 GLY H H 7.376 2.725 -5.867 1.00 . A A . 50 GLY H 1 1 18 11326 1 1 50 GLY HA2 H 6.540 1.541 -8.342 1.00 . A A . 50 GLY HA2 1 1 18 11327 1 1 50 GLY HA3 H 6.446 0.868 -6.716 1.00 . A A . 50 GLY HA3 1 1 18 11328 1 1 50 GLY N N 7.560 2.585 -6.851 1.00 . A A . 50 GLY N 1 1 18 11329 1 1 50 GLY O O 8.205 -0.234 -8.836 1.00 . A A . 50 GLY O 1 1 18 11330 1 1 51 CYS C C 11.392 0.479 -7.997 1.00 . A A . 51 CYS C 1 1 18 11331 1 1 51 CYS CA C 10.525 -0.399 -7.108 1.00 . A A . 51 CYS CA 1 1 18 11332 1 1 51 CYS CB C 10.462 -1.844 -7.629 1.00 . A A . 51 CYS CB 1 1 18 11333 1 1 51 CYS H H 9.139 0.710 -5.975 1.00 . A A . 51 CYS H 1 1 18 11334 1 1 51 CYS HA H 11.028 -0.450 -6.146 1.00 . A A . 51 CYS HA 1 1 18 11335 1 1 51 CYS HB2 H 9.765 -1.926 -8.458 1.00 . A A . 51 CYS HB2 1 1 18 11336 1 1 51 CYS HB3 H 11.443 -2.087 -8.034 1.00 . A A . 51 CYS HB3 1 1 18 11337 1 1 51 CYS N N 9.221 0.217 -6.864 1.00 . A A . 51 CYS N 1 1 18 11338 1 1 51 CYS O O 10.886 1.201 -8.888 1.00 . A A . 51 CYS O 1 1 18 11339 1 1 51 CYS OXT O 12.624 0.411 -7.803 1.00 . A A . 51 CYS OXT 1 1 18 11340 1 1 51 CYS SG S 10.079 -3.090 -6.378 1.00 . A A . 51 CYS SG 1 1 19 11341 1 1 1 GLY C C -8.051 -5.681 -1.063 1.00 . A A . 1 GLY C 1 1 19 11342 1 1 1 GLY CA C -7.989 -6.914 -1.934 1.00 . A A . 1 GLY CA 1 1 19 11343 1 1 1 GLY H1 H -8.671 -5.921 -3.593 1.00 . A A . 1 GLY H1 1 1 19 11344 1 1 1 GLY H2 H -7.025 -6.025 -3.477 1.00 . A A . 1 GLY H2 1 1 19 11345 1 1 1 GLY H3 H -7.894 -7.344 -3.935 1.00 . A A . 1 GLY H3 1 1 19 11346 1 1 1 GLY HA2 H -7.106 -7.495 -1.670 1.00 . A A . 1 GLY HA2 1 1 19 11347 1 1 1 GLY HA3 H -8.880 -7.508 -1.767 1.00 . A A . 1 GLY HA3 1 1 19 11348 1 1 1 GLY N N -7.898 -6.522 -3.350 1.00 . A A . 1 GLY N 1 1 19 11349 1 1 1 GLY O O -8.392 -4.612 -1.558 1.00 . A A . 1 GLY O 1 1 19 11350 1 1 2 GLU C C -7.069 -3.488 0.837 1.00 . A A . 2 GLU C 1 1 19 11351 1 1 2 GLU CA C -7.853 -4.742 1.220 1.00 . A A . 2 GLU CA 1 1 19 11352 1 1 2 GLU CB C -7.451 -5.247 2.614 1.00 . A A . 2 GLU CB 1 1 19 11353 1 1 2 GLU CD C -5.904 -7.010 3.596 1.00 . A A . 2 GLU CD 1 1 19 11354 1 1 2 GLU CG C -6.019 -5.792 2.673 1.00 . A A . 2 GLU CG 1 1 19 11355 1 1 2 GLU H H -7.466 -6.715 0.585 1.00 . A A . 2 GLU H 1 1 19 11356 1 1 2 GLU HA H -8.894 -4.463 1.292 1.00 . A A . 2 GLU HA 1 1 19 11357 1 1 2 GLU HB2 H -7.541 -4.420 3.319 1.00 . A A . 2 GLU HB2 1 1 19 11358 1 1 2 GLU HB3 H -8.153 -6.031 2.901 1.00 . A A . 2 GLU HB3 1 1 19 11359 1 1 2 GLU HG2 H -5.733 -6.093 1.669 1.00 . A A . 2 GLU HG2 1 1 19 11360 1 1 2 GLU HG3 H -5.340 -5.002 2.990 1.00 . A A . 2 GLU HG3 1 1 19 11361 1 1 2 GLU N N -7.753 -5.812 0.228 1.00 . A A . 2 GLU N 1 1 19 11362 1 1 2 GLU O O -7.517 -2.376 1.119 1.00 . A A . 2 GLU O 1 1 19 11363 1 1 2 GLU OE1 O -6.233 -8.129 3.135 1.00 . A A . 2 GLU OE1 1 1 19 11364 1 1 2 GLU OE2 O -5.517 -6.872 4.775 1.00 . A A . 2 GLU OE2 1 1 19 11365 1 1 3 CYS C C -5.841 -1.745 -1.366 1.00 . A A . 3 CYS C 1 1 19 11366 1 1 3 CYS CA C -5.152 -2.465 -0.196 1.00 . A A . 3 CYS CA 1 1 19 11367 1 1 3 CYS CB C -3.700 -2.849 -0.483 1.00 . A A . 3 CYS CB 1 1 19 11368 1 1 3 CYS H H -5.608 -4.565 -0.096 1.00 . A A . 3 CYS H 1 1 19 11369 1 1 3 CYS HA H -5.153 -1.797 0.667 1.00 . A A . 3 CYS HA 1 1 19 11370 1 1 3 CYS HB2 H -3.270 -3.285 0.417 1.00 . A A . 3 CYS HB2 1 1 19 11371 1 1 3 CYS HB3 H -3.669 -3.607 -1.262 1.00 . A A . 3 CYS HB3 1 1 19 11372 1 1 3 CYS N N -5.920 -3.639 0.176 1.00 . A A . 3 CYS N 1 1 19 11373 1 1 3 CYS O O -6.032 -0.528 -1.320 1.00 . A A . 3 CYS O 1 1 19 11374 1 1 3 CYS SG S -2.696 -1.426 -0.973 1.00 . A A . 3 CYS SG 1 1 19 11375 1 1 4 GLU C C -8.401 -1.378 -3.064 1.00 . A A . 4 GLU C 1 1 19 11376 1 1 4 GLU CA C -7.040 -1.936 -3.509 1.00 . A A . 4 GLU CA 1 1 19 11377 1 1 4 GLU CB C -7.281 -2.998 -4.595 1.00 . A A . 4 GLU CB 1 1 19 11378 1 1 4 GLU CD C -6.315 -4.314 -6.537 1.00 . A A . 4 GLU CD 1 1 19 11379 1 1 4 GLU CG C -6.003 -3.471 -5.296 1.00 . A A . 4 GLU CG 1 1 19 11380 1 1 4 GLU H H -6.067 -3.478 -2.388 1.00 . A A . 4 GLU H 1 1 19 11381 1 1 4 GLU HA H -6.466 -1.110 -3.935 1.00 . A A . 4 GLU HA 1 1 19 11382 1 1 4 GLU HB2 H -7.788 -3.859 -4.157 1.00 . A A . 4 GLU HB2 1 1 19 11383 1 1 4 GLU HB3 H -7.946 -2.566 -5.340 1.00 . A A . 4 GLU HB3 1 1 19 11384 1 1 4 GLU HG2 H -5.415 -2.607 -5.601 1.00 . A A . 4 GLU HG2 1 1 19 11385 1 1 4 GLU HG3 H -5.422 -4.059 -4.588 1.00 . A A . 4 GLU HG3 1 1 19 11386 1 1 4 GLU N N -6.276 -2.490 -2.390 1.00 . A A . 4 GLU N 1 1 19 11387 1 1 4 GLU O O -8.906 -0.456 -3.714 1.00 . A A . 4 GLU O 1 1 19 11388 1 1 4 GLU OE1 O -6.858 -3.755 -7.521 1.00 . A A . 4 GLU OE1 1 1 19 11389 1 1 4 GLU OE2 O -6.029 -5.536 -6.513 1.00 . A A . 4 GLU OE2 1 1 19 11390 1 1 5 GLN C C -9.945 -0.032 -0.848 1.00 . A A . 5 GLN C 1 1 19 11391 1 1 5 GLN CA C -10.213 -1.441 -1.358 1.00 . A A . 5 GLN CA 1 1 19 11392 1 1 5 GLN CB C -10.649 -2.394 -0.223 1.00 . A A . 5 GLN CB 1 1 19 11393 1 1 5 GLN CD C -12.091 -0.744 1.155 1.00 . A A . 5 GLN CD 1 1 19 11394 1 1 5 GLN CG C -12.014 -2.089 0.420 1.00 . A A . 5 GLN CG 1 1 19 11395 1 1 5 GLN H H -8.537 -2.722 -1.566 1.00 . A A . 5 GLN H 1 1 19 11396 1 1 5 GLN HA H -11.003 -1.400 -2.110 1.00 . A A . 5 GLN HA 1 1 19 11397 1 1 5 GLN HB2 H -10.699 -3.405 -0.629 1.00 . A A . 5 GLN HB2 1 1 19 11398 1 1 5 GLN HB3 H -9.905 -2.390 0.567 1.00 . A A . 5 GLN HB3 1 1 19 11399 1 1 5 GLN HE21 H -13.700 -0.196 0.068 1.00 . A A . 5 GLN HE21 1 1 19 11400 1 1 5 GLN HE22 H -13.131 1.018 1.173 1.00 . A A . 5 GLN HE22 1 1 19 11401 1 1 5 GLN HG2 H -12.777 -2.136 -0.357 1.00 . A A . 5 GLN HG2 1 1 19 11402 1 1 5 GLN HG3 H -12.233 -2.875 1.143 1.00 . A A . 5 GLN HG3 1 1 19 11403 1 1 5 GLN N N -8.991 -1.922 -1.991 1.00 . A A . 5 GLN N 1 1 19 11404 1 1 5 GLN NE2 N -13.056 0.083 0.801 1.00 . A A . 5 GLN NE2 1 1 19 11405 1 1 5 GLN O O -10.666 0.884 -1.223 1.00 . A A . 5 GLN O 1 1 19 11406 1 1 5 GLN OE1 O -11.274 -0.431 2.021 1.00 . A A . 5 GLN OE1 1 1 19 11407 1 1 6 CYS C C -8.374 2.466 -0.567 1.00 . A A . 6 CYS C 1 1 19 11408 1 1 6 CYS CA C -8.548 1.429 0.540 1.00 . A A . 6 CYS CA 1 1 19 11409 1 1 6 CYS CB C -7.282 1.275 1.388 1.00 . A A . 6 CYS CB 1 1 19 11410 1 1 6 CYS H H -8.366 -0.677 0.247 1.00 . A A . 6 CYS H 1 1 19 11411 1 1 6 CYS HA H -9.371 1.742 1.184 1.00 . A A . 6 CYS HA 1 1 19 11412 1 1 6 CYS HB2 H -7.352 0.326 1.908 1.00 . A A . 6 CYS HB2 1 1 19 11413 1 1 6 CYS HB3 H -6.406 1.234 0.740 1.00 . A A . 6 CYS HB3 1 1 19 11414 1 1 6 CYS N N -8.898 0.140 -0.034 1.00 . A A . 6 CYS N 1 1 19 11415 1 1 6 CYS O O -8.920 3.564 -0.484 1.00 . A A . 6 CYS O 1 1 19 11416 1 1 6 CYS SG S -7.067 2.580 2.626 1.00 . A A . 6 CYS SG 1 1 19 11417 1 1 7 PHE C C -8.891 3.270 -3.440 1.00 . A A . 7 PHE C 1 1 19 11418 1 1 7 PHE CA C -7.529 2.902 -2.842 1.00 . A A . 7 PHE CA 1 1 19 11419 1 1 7 PHE CB C -6.634 2.165 -3.848 1.00 . A A . 7 PHE CB 1 1 19 11420 1 1 7 PHE CD1 C -4.457 3.239 -3.124 1.00 . A A . 7 PHE CD1 1 1 19 11421 1 1 7 PHE CD2 C -5.021 3.208 -5.493 1.00 . A A . 7 PHE CD2 1 1 19 11422 1 1 7 PHE CE1 C -3.267 3.912 -3.425 1.00 . A A . 7 PHE CE1 1 1 19 11423 1 1 7 PHE CE2 C -3.829 3.891 -5.791 1.00 . A A . 7 PHE CE2 1 1 19 11424 1 1 7 PHE CG C -5.342 2.887 -4.161 1.00 . A A . 7 PHE CG 1 1 19 11425 1 1 7 PHE CZ C -2.954 4.251 -4.753 1.00 . A A . 7 PHE CZ 1 1 19 11426 1 1 7 PHE H H -7.241 1.173 -1.619 1.00 . A A . 7 PHE H 1 1 19 11427 1 1 7 PHE HA H -7.042 3.838 -2.574 1.00 . A A . 7 PHE HA 1 1 19 11428 1 1 7 PHE HB2 H -6.380 1.173 -3.472 1.00 . A A . 7 PHE HB2 1 1 19 11429 1 1 7 PHE HB3 H -7.188 2.020 -4.774 1.00 . A A . 7 PHE HB3 1 1 19 11430 1 1 7 PHE HD1 H -4.681 3.028 -2.089 1.00 . A A . 7 PHE HD1 1 1 19 11431 1 1 7 PHE HD2 H -5.707 2.956 -6.287 1.00 . A A . 7 PHE HD2 1 1 19 11432 1 1 7 PHE HE1 H -2.589 4.166 -2.627 1.00 . A A . 7 PHE HE1 1 1 19 11433 1 1 7 PHE HE2 H -3.589 4.149 -6.813 1.00 . A A . 7 PHE HE2 1 1 19 11434 1 1 7 PHE HZ H -2.035 4.778 -4.971 1.00 . A A . 7 PHE HZ 1 1 19 11435 1 1 7 PHE N N -7.666 2.094 -1.637 1.00 . A A . 7 PHE N 1 1 19 11436 1 1 7 PHE O O -9.136 4.442 -3.717 1.00 . A A . 7 PHE O 1 1 19 11437 1 1 8 SER C C -12.011 3.379 -3.178 1.00 . A A . 8 SER C 1 1 19 11438 1 1 8 SER CA C -11.147 2.513 -4.108 1.00 . A A . 8 SER CA 1 1 19 11439 1 1 8 SER CB C -11.827 1.163 -4.351 1.00 . A A . 8 SER CB 1 1 19 11440 1 1 8 SER H H -9.559 1.370 -3.271 1.00 . A A . 8 SER H 1 1 19 11441 1 1 8 SER HA H -11.066 3.036 -5.061 1.00 . A A . 8 SER HA 1 1 19 11442 1 1 8 SER HB2 H -11.977 0.643 -3.405 1.00 . A A . 8 SER HB2 1 1 19 11443 1 1 8 SER HB3 H -12.799 1.336 -4.809 1.00 . A A . 8 SER HB3 1 1 19 11444 1 1 8 SER HG H -10.315 0.001 -4.692 1.00 . A A . 8 SER HG 1 1 19 11445 1 1 8 SER N N -9.796 2.300 -3.590 1.00 . A A . 8 SER N 1 1 19 11446 1 1 8 SER O O -13.059 3.873 -3.608 1.00 . A A . 8 SER O 1 1 19 11447 1 1 8 SER OG O -11.053 0.357 -5.220 1.00 . A A . 8 SER OG 1 1 19 11448 1 1 9 ASP C C -11.307 5.799 -0.889 1.00 . A A . 9 ASP C 1 1 19 11449 1 1 9 ASP CA C -12.186 4.542 -0.995 1.00 . A A . 9 ASP CA 1 1 19 11450 1 1 9 ASP CB C -12.476 3.813 0.335 1.00 . A A . 9 ASP CB 1 1 19 11451 1 1 9 ASP CG C -13.982 3.759 0.570 1.00 . A A . 9 ASP CG 1 1 19 11452 1 1 9 ASP H H -10.737 3.140 -1.620 1.00 . A A . 9 ASP H 1 1 19 11453 1 1 9 ASP HA H -13.144 4.876 -1.389 1.00 . A A . 9 ASP HA 1 1 19 11454 1 1 9 ASP HB2 H -12.075 2.798 0.314 1.00 . A A . 9 ASP HB2 1 1 19 11455 1 1 9 ASP HB3 H -12.011 4.322 1.173 1.00 . A A . 9 ASP HB3 1 1 19 11456 1 1 9 ASP N N -11.580 3.607 -1.937 1.00 . A A . 9 ASP N 1 1 19 11457 1 1 9 ASP O O -11.208 6.456 0.153 1.00 . A A . 9 ASP O 1 1 19 11458 1 1 9 ASP OD1 O -14.569 4.811 0.896 1.00 . A A . 9 ASP OD1 1 1 19 11459 1 1 9 ASP OD2 O -14.608 2.705 0.310 1.00 . A A . 9 ASP OD2 1 1 19 11460 1 1 10 GLY C C -8.533 7.354 -1.688 1.00 . A A . 10 GLY C 1 1 19 11461 1 1 10 GLY CA C -9.962 7.420 -2.218 1.00 . A A . 10 GLY CA 1 1 19 11462 1 1 10 GLY H H -10.752 5.563 -2.815 1.00 . A A . 10 GLY H 1 1 19 11463 1 1 10 GLY HA2 H -10.469 8.241 -1.723 1.00 . A A . 10 GLY HA2 1 1 19 11464 1 1 10 GLY HA3 H -9.918 7.636 -3.285 1.00 . A A . 10 GLY HA3 1 1 19 11465 1 1 10 GLY N N -10.732 6.201 -2.028 1.00 . A A . 10 GLY N 1 1 19 11466 1 1 10 GLY O O -7.886 8.397 -1.593 1.00 . A A . 10 GLY O 1 1 19 11467 1 1 11 GLY C C -5.660 6.476 -1.856 1.00 . A A . 11 GLY C 1 1 19 11468 1 1 11 GLY CA C -6.687 5.958 -0.853 1.00 . A A . 11 GLY CA 1 1 19 11469 1 1 11 GLY H H -8.642 5.353 -1.398 1.00 . A A . 11 GLY H 1 1 19 11470 1 1 11 GLY HA2 H -6.526 4.893 -0.702 1.00 . A A . 11 GLY HA2 1 1 19 11471 1 1 11 GLY HA3 H -6.576 6.465 0.099 1.00 . A A . 11 GLY HA3 1 1 19 11472 1 1 11 GLY N N -8.042 6.167 -1.325 1.00 . A A . 11 GLY N 1 1 19 11473 1 1 11 GLY O O -5.832 6.321 -3.068 1.00 . A A . 11 GLY O 1 1 19 11474 1 1 12 ASP C C -2.180 6.942 -1.655 1.00 . A A . 12 ASP C 1 1 19 11475 1 1 12 ASP CA C -3.467 7.673 -2.047 1.00 . A A . 12 ASP CA 1 1 19 11476 1 1 12 ASP CB C -3.322 9.191 -1.743 1.00 . A A . 12 ASP CB 1 1 19 11477 1 1 12 ASP CG C -3.655 9.667 -0.313 1.00 . A A . 12 ASP CG 1 1 19 11478 1 1 12 ASP H H -4.583 7.228 -0.329 1.00 . A A . 12 ASP H 1 1 19 11479 1 1 12 ASP HA H -3.616 7.482 -3.112 1.00 . A A . 12 ASP HA 1 1 19 11480 1 1 12 ASP HB2 H -2.301 9.499 -1.969 1.00 . A A . 12 ASP HB2 1 1 19 11481 1 1 12 ASP HB3 H -3.979 9.730 -2.424 1.00 . A A . 12 ASP HB3 1 1 19 11482 1 1 12 ASP N N -4.598 7.089 -1.336 1.00 . A A . 12 ASP N 1 1 19 11483 1 1 12 ASP O O -1.551 6.308 -2.497 1.00 . A A . 12 ASP O 1 1 19 11484 1 1 12 ASP OD1 O -3.556 8.877 0.660 1.00 . A A . 12 ASP OD1 1 1 19 11485 1 1 12 ASP OD2 O -3.997 10.859 -0.160 1.00 . A A . 12 ASP OD2 1 1 19 11486 1 1 13 CYS C C -1.183 6.536 1.919 1.00 . A A . 13 CYS C 1 1 19 11487 1 1 13 CYS CA C -1.140 6.053 0.459 1.00 . A A . 13 CYS CA 1 1 19 11488 1 1 13 CYS CB C 0.281 5.802 -0.039 1.00 . A A . 13 CYS CB 1 1 19 11489 1 1 13 CYS H H -2.307 7.713 0.150 1.00 . A A . 13 CYS H 1 1 19 11490 1 1 13 CYS HA H -1.717 5.133 0.381 1.00 . A A . 13 CYS HA 1 1 19 11491 1 1 13 CYS HB2 H 0.315 4.769 -0.380 1.00 . A A . 13 CYS HB2 1 1 19 11492 1 1 13 CYS HB3 H 0.411 6.447 -0.906 1.00 . A A . 13 CYS HB3 1 1 19 11493 1 1 13 CYS N N -1.791 7.043 -0.388 1.00 . A A . 13 CYS N 1 1 19 11494 1 1 13 CYS O O -1.254 5.741 2.863 1.00 . A A . 13 CYS O 1 1 19 11495 1 1 13 CYS SG S 1.699 6.113 1.059 1.00 . A A . 13 CYS SG 1 1 19 11496 1 1 14 THR C C -2.515 8.257 4.135 1.00 . A A . 14 THR C 1 1 19 11497 1 1 14 THR CA C -1.207 8.545 3.379 1.00 . A A . 14 THR CA 1 1 19 11498 1 1 14 THR CB C -0.958 10.049 3.130 1.00 . A A . 14 THR CB 1 1 19 11499 1 1 14 THR CG2 C -0.473 10.754 4.393 1.00 . A A . 14 THR CG2 1 1 19 11500 1 1 14 THR H H -1.080 8.455 1.295 1.00 . A A . 14 THR H 1 1 19 11501 1 1 14 THR HA H -0.382 8.147 3.964 1.00 . A A . 14 THR HA 1 1 19 11502 1 1 14 THR HB H -1.881 10.519 2.789 1.00 . A A . 14 THR HB 1 1 19 11503 1 1 14 THR HG1 H 0.637 10.947 2.413 1.00 . A A . 14 THR HG1 1 1 19 11504 1 1 14 THR HG21 H 0.403 10.249 4.801 1.00 . A A . 14 THR HG21 1 1 19 11505 1 1 14 THR HG22 H -0.217 11.788 4.169 1.00 . A A . 14 THR HG22 1 1 19 11506 1 1 14 THR HG23 H -1.272 10.751 5.129 1.00 . A A . 14 THR HG23 1 1 19 11507 1 1 14 THR N N -1.184 7.859 2.105 1.00 . A A . 14 THR N 1 1 19 11508 1 1 14 THR O O -2.461 7.898 5.314 1.00 . A A . 14 THR O 1 1 19 11509 1 1 14 THR OG1 O 0.028 10.240 2.127 1.00 . A A . 14 THR OG1 1 1 19 11510 1 1 15 THR C C -5.311 6.564 4.060 1.00 . A A . 15 THR C 1 1 19 11511 1 1 15 THR CA C -5.003 8.087 4.047 1.00 . A A . 15 THR CA 1 1 19 11512 1 1 15 THR CB C -6.023 8.989 3.280 1.00 . A A . 15 THR CB 1 1 19 11513 1 1 15 THR CG2 C -6.643 8.523 1.958 1.00 . A A . 15 THR CG2 1 1 19 11514 1 1 15 THR H H -3.649 8.685 2.512 1.00 . A A . 15 THR H 1 1 19 11515 1 1 15 THR HA H -4.983 8.419 5.085 1.00 . A A . 15 THR HA 1 1 19 11516 1 1 15 THR HB H -5.478 9.892 3.001 1.00 . A A . 15 THR HB 1 1 19 11517 1 1 15 THR HG1 H -6.917 9.194 5.031 1.00 . A A . 15 THR HG1 1 1 19 11518 1 1 15 THR HG21 H -5.875 8.300 1.231 1.00 . A A . 15 THR HG21 1 1 19 11519 1 1 15 THR HG22 H -7.293 7.660 2.099 1.00 . A A . 15 THR HG22 1 1 19 11520 1 1 15 THR HG23 H -7.247 9.333 1.548 1.00 . A A . 15 THR HG23 1 1 19 11521 1 1 15 THR N N -3.678 8.368 3.480 1.00 . A A . 15 THR N 1 1 19 11522 1 1 15 THR O O -6.439 6.146 3.811 1.00 . A A . 15 THR O 1 1 19 11523 1 1 15 THR OG1 O -7.117 9.367 4.094 1.00 . A A . 15 THR OG1 1 1 19 11524 1 1 16 CYS C C -3.279 3.685 5.190 1.00 . A A . 16 CYS C 1 1 19 11525 1 1 16 CYS CA C -4.388 4.244 4.310 1.00 . A A . 16 CYS CA 1 1 19 11526 1 1 16 CYS CB C -4.234 3.695 2.881 1.00 . A A . 16 CYS CB 1 1 19 11527 1 1 16 CYS H H -3.439 6.135 4.598 1.00 . A A . 16 CYS H 1 1 19 11528 1 1 16 CYS HA H -5.332 3.848 4.710 1.00 . A A . 16 CYS HA 1 1 19 11529 1 1 16 CYS HB2 H -3.418 4.234 2.405 1.00 . A A . 16 CYS HB2 1 1 19 11530 1 1 16 CYS HB3 H -3.958 2.641 2.933 1.00 . A A . 16 CYS HB3 1 1 19 11531 1 1 16 CYS N N -4.317 5.711 4.334 1.00 . A A . 16 CYS N 1 1 19 11532 1 1 16 CYS O O -3.523 2.680 5.845 1.00 . A A . 16 CYS O 1 1 19 11533 1 1 16 CYS SG S -5.693 3.822 1.806 1.00 . A A . 16 CYS SG 1 1 19 11534 1 1 17 PHE C C -1.370 3.512 7.515 1.00 . A A . 17 PHE C 1 1 19 11535 1 1 17 PHE CA C -0.994 3.629 6.032 1.00 . A A . 17 PHE CA 1 1 19 11536 1 1 17 PHE CB C 0.357 4.326 5.853 1.00 . A A . 17 PHE CB 1 1 19 11537 1 1 17 PHE CD1 C 1.702 2.240 6.322 1.00 . A A . 17 PHE CD1 1 1 19 11538 1 1 17 PHE CD2 C 2.225 4.242 7.601 1.00 . A A . 17 PHE CD2 1 1 19 11539 1 1 17 PHE CE1 C 2.666 1.517 7.042 1.00 . A A . 17 PHE CE1 1 1 19 11540 1 1 17 PHE CE2 C 3.211 3.520 8.303 1.00 . A A . 17 PHE CE2 1 1 19 11541 1 1 17 PHE CG C 1.472 3.602 6.595 1.00 . A A . 17 PHE CG 1 1 19 11542 1 1 17 PHE CZ C 3.429 2.161 8.021 1.00 . A A . 17 PHE CZ 1 1 19 11543 1 1 17 PHE H H -1.823 5.010 4.603 1.00 . A A . 17 PHE H 1 1 19 11544 1 1 17 PHE HA H -0.868 2.616 5.664 1.00 . A A . 17 PHE HA 1 1 19 11545 1 1 17 PHE HB2 H 0.607 4.358 4.791 1.00 . A A . 17 PHE HB2 1 1 19 11546 1 1 17 PHE HB3 H 0.273 5.346 6.214 1.00 . A A . 17 PHE HB3 1 1 19 11547 1 1 17 PHE HD1 H 1.131 1.734 5.559 1.00 . A A . 17 PHE HD1 1 1 19 11548 1 1 17 PHE HD2 H 2.048 5.282 7.855 1.00 . A A . 17 PHE HD2 1 1 19 11549 1 1 17 PHE HE1 H 2.834 0.459 6.853 1.00 . A A . 17 PHE HE1 1 1 19 11550 1 1 17 PHE HE2 H 3.793 3.998 9.079 1.00 . A A . 17 PHE HE2 1 1 19 11551 1 1 17 PHE HZ H 4.162 1.575 8.556 1.00 . A A . 17 PHE HZ 1 1 19 11552 1 1 17 PHE N N -2.061 4.247 5.233 1.00 . A A . 17 PHE N 1 1 19 11553 1 1 17 PHE O O -1.082 2.479 8.131 1.00 . A A . 17 PHE O 1 1 19 11554 1 1 18 ASN C C -1.358 4.321 10.432 1.00 . A A . 18 ASN C 1 1 19 11555 1 1 18 ASN CA C -2.512 4.572 9.456 1.00 . A A . 18 ASN CA 1 1 19 11556 1 1 18 ASN CB C -3.602 3.531 9.679 1.00 . A A . 18 ASN CB 1 1 19 11557 1 1 18 ASN CG C -4.554 3.944 10.799 1.00 . A A . 18 ASN CG 1 1 19 11558 1 1 18 ASN H H -2.235 5.345 7.498 1.00 . A A . 18 ASN H 1 1 19 11559 1 1 18 ASN HA H -2.926 5.563 9.651 1.00 . A A . 18 ASN HA 1 1 19 11560 1 1 18 ASN HB2 H -4.169 3.372 8.761 1.00 . A A . 18 ASN HB2 1 1 19 11561 1 1 18 ASN HB3 H -3.054 2.626 9.938 1.00 . A A . 18 ASN HB3 1 1 19 11562 1 1 18 ASN HD21 H -6.144 3.132 9.825 1.00 . A A . 18 ASN HD21 1 1 19 11563 1 1 18 ASN HD22 H -6.518 4.140 11.212 1.00 . A A . 18 ASN HD22 1 1 19 11564 1 1 18 ASN N N -2.060 4.524 8.061 1.00 . A A . 18 ASN N 1 1 19 11565 1 1 18 ASN ND2 N -5.833 3.671 10.627 1.00 . A A . 18 ASN ND2 1 1 19 11566 1 1 18 ASN O O -1.478 3.624 11.440 1.00 . A A . 18 ASN O 1 1 19 11567 1 1 18 ASN OD1 O -4.168 4.535 11.807 1.00 . A A . 18 ASN OD1 1 1 19 11568 1 1 19 ASN C C 1.488 3.130 11.042 1.00 . A A . 19 ASN C 1 1 19 11569 1 1 19 ASN CA C 1.062 4.588 10.783 1.00 . A A . 19 ASN CA 1 1 19 11570 1 1 19 ASN CB C 1.111 5.544 11.983 1.00 . A A . 19 ASN CB 1 1 19 11571 1 1 19 ASN CG C 2.398 5.450 12.783 1.00 . A A . 19 ASN CG 1 1 19 11572 1 1 19 ASN H H -0.143 5.344 9.217 1.00 . A A . 19 ASN H 1 1 19 11573 1 1 19 ASN HA H 1.769 4.940 10.068 1.00 . A A . 19 ASN HA 1 1 19 11574 1 1 19 ASN HB2 H 1.008 6.558 11.601 1.00 . A A . 19 ASN HB2 1 1 19 11575 1 1 19 ASN HB3 H 0.276 5.331 12.653 1.00 . A A . 19 ASN HB3 1 1 19 11576 1 1 19 ASN HD21 H 3.561 6.099 11.229 1.00 . A A . 19 ASN HD21 1 1 19 11577 1 1 19 ASN HD22 H 4.389 5.588 12.701 1.00 . A A . 19 ASN HD22 1 1 19 11578 1 1 19 ASN N N -0.175 4.783 10.061 1.00 . A A . 19 ASN N 1 1 19 11579 1 1 19 ASN ND2 N 3.534 5.748 12.180 1.00 . A A . 19 ASN ND2 1 1 19 11580 1 1 19 ASN O O 2.420 2.884 11.806 1.00 . A A . 19 ASN O 1 1 19 11581 1 1 19 ASN OD1 O 2.385 5.121 13.965 1.00 . A A . 19 ASN OD1 1 1 19 11582 1 1 20 GLY C C 0.312 -0.186 10.894 1.00 . A A . 20 GLY C 1 1 19 11583 1 1 20 GLY CA C 1.343 0.783 10.338 1.00 . A A . 20 GLY CA 1 1 19 11584 1 1 20 GLY H H 0.227 2.390 9.629 1.00 . A A . 20 GLY H 1 1 19 11585 1 1 20 GLY HA2 H 2.254 0.706 10.908 1.00 . A A . 20 GLY HA2 1 1 19 11586 1 1 20 GLY HA3 H 1.565 0.494 9.314 1.00 . A A . 20 GLY HA3 1 1 19 11587 1 1 20 GLY N N 0.905 2.164 10.330 1.00 . A A . 20 GLY N 1 1 19 11588 1 1 20 GLY O O 0.669 -1.289 11.310 1.00 . A A . 20 GLY O 1 1 19 11589 1 1 21 THR C C -3.172 -0.672 10.176 1.00 . A A . 21 THR C 1 1 19 11590 1 1 21 THR CA C -2.071 -0.672 11.261 1.00 . A A . 21 THR CA 1 1 19 11591 1 1 21 THR CB C -2.475 -0.330 12.706 1.00 . A A . 21 THR CB 1 1 19 11592 1 1 21 THR CG2 C -3.421 0.849 12.699 1.00 . A A . 21 THR CG2 1 1 19 11593 1 1 21 THR H H -1.179 1.139 10.598 1.00 . A A . 21 THR H 1 1 19 11594 1 1 21 THR HA H -1.721 -1.682 11.324 1.00 . A A . 21 THR HA 1 1 19 11595 1 1 21 THR HB H -1.576 -0.061 13.262 1.00 . A A . 21 THR HB 1 1 19 11596 1 1 21 THR HG1 H -3.038 -1.213 14.332 1.00 . A A . 21 THR HG1 1 1 19 11597 1 1 21 THR HG21 H -2.978 1.643 12.111 1.00 . A A . 21 THR HG21 1 1 19 11598 1 1 21 THR HG22 H -4.361 0.537 12.254 1.00 . A A . 21 THR HG22 1 1 19 11599 1 1 21 THR HG23 H -3.576 1.194 13.715 1.00 . A A . 21 THR HG23 1 1 19 11600 1 1 21 THR N N -0.963 0.194 10.875 1.00 . A A . 21 THR N 1 1 19 11601 1 1 21 THR O O -4.194 -1.341 10.321 1.00 . A A . 21 THR O 1 1 19 11602 1 1 21 THR OG1 O -3.071 -1.419 13.385 1.00 . A A . 21 THR OG1 1 1 19 11603 1 1 22 GLY C C -3.801 -1.069 7.008 1.00 . A A . 22 GLY C 1 1 19 11604 1 1 22 GLY CA C -3.946 0.108 7.982 1.00 . A A . 22 GLY CA 1 1 19 11605 1 1 22 GLY H H -2.107 0.539 8.932 1.00 . A A . 22 GLY H 1 1 19 11606 1 1 22 GLY HA2 H -3.812 1.043 7.455 1.00 . A A . 22 GLY HA2 1 1 19 11607 1 1 22 GLY HA3 H -4.955 0.091 8.395 1.00 . A A . 22 GLY HA3 1 1 19 11608 1 1 22 GLY N N -2.980 0.055 9.070 1.00 . A A . 22 GLY N 1 1 19 11609 1 1 22 GLY O O -2.960 -1.947 7.220 1.00 . A A . 22 GLY O 1 1 19 11610 1 1 23 PRO C C -3.533 -2.681 4.321 1.00 . A A . 23 PRO C 1 1 19 11611 1 1 23 PRO CA C -4.785 -2.283 5.107 1.00 . A A . 23 PRO CA 1 1 19 11612 1 1 23 PRO CB C -5.979 -1.972 4.202 1.00 . A A . 23 PRO CB 1 1 19 11613 1 1 23 PRO CD C -5.357 0.040 5.409 1.00 . A A . 23 PRO CD 1 1 19 11614 1 1 23 PRO CG C -6.085 -0.447 4.168 1.00 . A A . 23 PRO CG 1 1 19 11615 1 1 23 PRO HA H -5.049 -3.117 5.753 1.00 . A A . 23 PRO HA 1 1 19 11616 1 1 23 PRO HB2 H -5.845 -2.383 3.202 1.00 . A A . 23 PRO HB2 1 1 19 11617 1 1 23 PRO HB3 H -6.883 -2.380 4.655 1.00 . A A . 23 PRO HB3 1 1 19 11618 1 1 23 PRO HD2 H -4.680 0.824 5.095 1.00 . A A . 23 PRO HD2 1 1 19 11619 1 1 23 PRO HD3 H -6.047 0.461 6.135 1.00 . A A . 23 PRO HD3 1 1 19 11620 1 1 23 PRO HG2 H -5.571 -0.034 3.300 1.00 . A A . 23 PRO HG2 1 1 19 11621 1 1 23 PRO HG3 H -7.128 -0.132 4.178 1.00 . A A . 23 PRO HG3 1 1 19 11622 1 1 23 PRO N N -4.599 -1.093 5.927 1.00 . A A . 23 PRO N 1 1 19 11623 1 1 23 PRO O O -3.135 -3.846 4.344 1.00 . A A . 23 PRO O 1 1 19 11624 1 1 24 CYS C C -0.423 -2.105 3.686 1.00 . A A . 24 CYS C 1 1 19 11625 1 1 24 CYS CA C -1.699 -1.996 2.833 1.00 . A A . 24 CYS CA 1 1 19 11626 1 1 24 CYS CB C -1.537 -0.901 1.759 1.00 . A A . 24 CYS CB 1 1 19 11627 1 1 24 CYS H H -3.159 -0.769 3.784 1.00 . A A . 24 CYS H 1 1 19 11628 1 1 24 CYS HA H -1.837 -2.951 2.324 1.00 . A A . 24 CYS HA 1 1 19 11629 1 1 24 CYS HB2 H -2.477 -0.375 1.601 1.00 . A A . 24 CYS HB2 1 1 19 11630 1 1 24 CYS HB3 H -0.802 -0.166 2.091 1.00 . A A . 24 CYS HB3 1 1 19 11631 1 1 24 CYS N N -2.888 -1.733 3.638 1.00 . A A . 24 CYS N 1 1 19 11632 1 1 24 CYS O O 0.647 -2.318 3.134 1.00 . A A . 24 CYS O 1 1 19 11633 1 1 24 CYS SG S -1.004 -1.532 0.152 1.00 . A A . 24 CYS SG 1 1 19 11634 1 1 25 ALA C C 1.842 -2.532 5.744 1.00 . A A . 25 ALA C 1 1 19 11635 1 1 25 ALA CA C 0.657 -1.566 5.844 1.00 . A A . 25 ALA CA 1 1 19 11636 1 1 25 ALA CB C 0.188 -1.422 7.290 1.00 . A A . 25 ALA CB 1 1 19 11637 1 1 25 ALA H H -1.407 -1.865 5.424 1.00 . A A . 25 ALA H 1 1 19 11638 1 1 25 ALA HA H 1.027 -0.591 5.523 1.00 . A A . 25 ALA HA 1 1 19 11639 1 1 25 ALA HB1 H -0.243 -2.365 7.628 1.00 . A A . 25 ALA HB1 1 1 19 11640 1 1 25 ALA HB2 H -0.540 -0.615 7.372 1.00 . A A . 25 ALA HB2 1 1 19 11641 1 1 25 ALA HB3 H 1.041 -1.183 7.916 1.00 . A A . 25 ALA HB3 1 1 19 11642 1 1 25 ALA N N -0.487 -1.927 5.010 1.00 . A A . 25 ALA N 1 1 19 11643 1 1 25 ALA O O 2.985 -2.074 5.717 1.00 . A A . 25 ALA O 1 1 19 11644 1 1 26 ASN C C 3.472 -4.718 4.241 1.00 . A A . 26 ASN C 1 1 19 11645 1 1 26 ASN CA C 2.765 -4.773 5.599 1.00 . A A . 26 ASN CA 1 1 19 11646 1 1 26 ASN CB C 2.370 -6.217 5.930 1.00 . A A . 26 ASN CB 1 1 19 11647 1 1 26 ASN CG C 1.905 -6.362 7.371 1.00 . A A . 26 ASN CG 1 1 19 11648 1 1 26 ASN H H 0.672 -4.202 5.626 1.00 . A A . 26 ASN H 1 1 19 11649 1 1 26 ASN HA H 3.491 -4.443 6.347 1.00 . A A . 26 ASN HA 1 1 19 11650 1 1 26 ASN HB2 H 1.606 -6.569 5.238 1.00 . A A . 26 ASN HB2 1 1 19 11651 1 1 26 ASN HB3 H 3.252 -6.848 5.798 1.00 . A A . 26 ASN HB3 1 1 19 11652 1 1 26 ASN HD21 H -0.034 -6.085 6.857 1.00 . A A . 26 ASN HD21 1 1 19 11653 1 1 26 ASN HD22 H 0.264 -6.463 8.543 1.00 . A A . 26 ASN HD22 1 1 19 11654 1 1 26 ASN N N 1.624 -3.849 5.663 1.00 . A A . 26 ASN N 1 1 19 11655 1 1 26 ASN ND2 N 0.613 -6.251 7.622 1.00 . A A . 26 ASN ND2 1 1 19 11656 1 1 26 ASN O O 4.623 -5.141 4.129 1.00 . A A . 26 ASN O 1 1 19 11657 1 1 26 ASN OD1 O 2.707 -6.523 8.288 1.00 . A A . 26 ASN OD1 1 1 19 11658 1 1 27 CYS C C 4.486 -2.699 2.031 1.00 . A A . 27 CYS C 1 1 19 11659 1 1 27 CYS CA C 3.451 -3.827 1.932 1.00 . A A . 27 CYS CA 1 1 19 11660 1 1 27 CYS CB C 2.381 -3.610 0.852 1.00 . A A . 27 CYS CB 1 1 19 11661 1 1 27 CYS H H 1.937 -3.691 3.417 1.00 . A A . 27 CYS H 1 1 19 11662 1 1 27 CYS HA H 3.972 -4.708 1.575 1.00 . A A . 27 CYS HA 1 1 19 11663 1 1 27 CYS HB2 H 1.769 -2.719 1.010 1.00 . A A . 27 CYS HB2 1 1 19 11664 1 1 27 CYS HB3 H 2.892 -3.445 -0.094 1.00 . A A . 27 CYS HB3 1 1 19 11665 1 1 27 CYS N N 2.840 -4.120 3.226 1.00 . A A . 27 CYS N 1 1 19 11666 1 1 27 CYS O O 4.943 -2.247 0.992 1.00 . A A . 27 CYS O 1 1 19 11667 1 1 27 CYS SG S 1.387 -5.123 0.702 1.00 . A A . 27 CYS SG 1 1 19 11668 1 1 28 LEU C C 7.008 -1.439 4.034 1.00 . A A . 28 LEU C 1 1 19 11669 1 1 28 LEU CA C 5.674 -1.024 3.421 1.00 . A A . 28 LEU CA 1 1 19 11670 1 1 28 LEU CB C 4.978 0.025 4.319 1.00 . A A . 28 LEU CB 1 1 19 11671 1 1 28 LEU CD1 C 3.924 2.183 3.488 1.00 . A A . 28 LEU CD1 1 1 19 11672 1 1 28 LEU CD2 C 2.952 0.081 2.644 1.00 . A A . 28 LEU CD2 1 1 19 11673 1 1 28 LEU CG C 3.686 0.710 3.817 1.00 . A A . 28 LEU CG 1 1 19 11674 1 1 28 LEU H H 4.381 -2.579 4.050 1.00 . A A . 28 LEU H 1 1 19 11675 1 1 28 LEU HA H 5.885 -0.565 2.457 1.00 . A A . 28 LEU HA 1 1 19 11676 1 1 28 LEU HB2 H 4.754 -0.425 5.285 1.00 . A A . 28 LEU HB2 1 1 19 11677 1 1 28 LEU HB3 H 5.713 0.796 4.547 1.00 . A A . 28 LEU HB3 1 1 19 11678 1 1 28 LEU HD11 H 4.353 2.665 4.360 1.00 . A A . 28 LEU HD11 1 1 19 11679 1 1 28 LEU HD12 H 4.619 2.274 2.658 1.00 . A A . 28 LEU HD12 1 1 19 11680 1 1 28 LEU HD13 H 2.982 2.672 3.240 1.00 . A A . 28 LEU HD13 1 1 19 11681 1 1 28 LEU HD21 H 2.695 -0.945 2.875 1.00 . A A . 28 LEU HD21 1 1 19 11682 1 1 28 LEU HD22 H 2.003 0.587 2.504 1.00 . A A . 28 LEU HD22 1 1 19 11683 1 1 28 LEU HD23 H 3.572 0.133 1.749 1.00 . A A . 28 LEU HD23 1 1 19 11684 1 1 28 LEU HG H 2.979 0.675 4.632 1.00 . A A . 28 LEU HG 1 1 19 11685 1 1 28 LEU N N 4.837 -2.206 3.230 1.00 . A A . 28 LEU N 1 1 19 11686 1 1 28 LEU O O 8.049 -1.342 3.386 1.00 . A A . 28 LEU O 1 1 19 11687 1 1 29 ALA C C 9.314 -2.701 5.520 1.00 . A A . 29 ALA C 1 1 19 11688 1 1 29 ALA CA C 8.149 -1.956 6.167 1.00 . A A . 29 ALA CA 1 1 19 11689 1 1 29 ALA CB C 7.753 -2.614 7.488 1.00 . A A . 29 ALA CB 1 1 19 11690 1 1 29 ALA H H 6.074 -1.963 5.738 1.00 . A A . 29 ALA H 1 1 19 11691 1 1 29 ALA HA H 8.480 -0.937 6.375 1.00 . A A . 29 ALA HA 1 1 19 11692 1 1 29 ALA HB1 H 8.636 -2.708 8.118 1.00 . A A . 29 ALA HB1 1 1 19 11693 1 1 29 ALA HB2 H 7.331 -3.606 7.304 1.00 . A A . 29 ALA HB2 1 1 19 11694 1 1 29 ALA HB3 H 7.018 -1.995 7.999 1.00 . A A . 29 ALA HB3 1 1 19 11695 1 1 29 ALA N N 6.978 -1.880 5.297 1.00 . A A . 29 ALA N 1 1 19 11696 1 1 29 ALA O O 10.440 -2.206 5.535 1.00 . A A . 29 ALA O 1 1 19 11697 1 1 30 GLY C C 9.278 -5.157 2.939 1.00 . A A . 30 GLY C 1 1 19 11698 1 1 30 GLY CA C 9.994 -4.627 4.156 1.00 . A A . 30 GLY CA 1 1 19 11699 1 1 30 GLY H H 8.080 -4.183 4.916 1.00 . A A . 30 GLY H 1 1 19 11700 1 1 30 GLY HA2 H 10.357 -5.466 4.748 1.00 . A A . 30 GLY HA2 1 1 19 11701 1 1 30 GLY HA3 H 10.831 -4.000 3.850 1.00 . A A . 30 GLY HA3 1 1 19 11702 1 1 30 GLY N N 9.037 -3.861 4.928 1.00 . A A . 30 GLY N 1 1 19 11703 1 1 30 GLY O O 8.599 -6.179 3.044 1.00 . A A . 30 GLY O 1 1 19 11704 1 1 31 TYR C C 9.214 -5.071 -0.631 1.00 . A A . 31 TYR C 1 1 19 11705 1 1 31 TYR CA C 8.498 -4.694 0.674 1.00 . A A . 31 TYR CA 1 1 19 11706 1 1 31 TYR CB C 7.744 -3.361 0.590 1.00 . A A . 31 TYR CB 1 1 19 11707 1 1 31 TYR CD1 C 9.789 -2.113 -0.375 1.00 . A A . 31 TYR CD1 1 1 19 11708 1 1 31 TYR CD2 C 7.556 -1.290 -0.792 1.00 . A A . 31 TYR CD2 1 1 19 11709 1 1 31 TYR CE1 C 10.317 -1.096 -1.198 1.00 . A A . 31 TYR CE1 1 1 19 11710 1 1 31 TYR CE2 C 8.066 -0.232 -1.553 1.00 . A A . 31 TYR CE2 1 1 19 11711 1 1 31 TYR CG C 8.400 -2.191 -0.135 1.00 . A A . 31 TYR CG 1 1 19 11712 1 1 31 TYR CZ C 9.454 -0.127 -1.760 1.00 . A A . 31 TYR CZ 1 1 19 11713 1 1 31 TYR H H 9.892 -3.582 1.821 1.00 . A A . 31 TYR H 1 1 19 11714 1 1 31 TYR HA H 7.775 -5.467 0.873 1.00 . A A . 31 TYR HA 1 1 19 11715 1 1 31 TYR HB2 H 6.834 -3.584 0.041 1.00 . A A . 31 TYR HB2 1 1 19 11716 1 1 31 TYR HB3 H 7.426 -3.037 1.582 1.00 . A A . 31 TYR HB3 1 1 19 11717 1 1 31 TYR HD1 H 10.437 -2.890 0.000 1.00 . A A . 31 TYR HD1 1 1 19 11718 1 1 31 TYR HD2 H 6.503 -1.393 -0.628 1.00 . A A . 31 TYR HD2 1 1 19 11719 1 1 31 TYR HE1 H 11.372 -1.077 -1.423 1.00 . A A . 31 TYR HE1 1 1 19 11720 1 1 31 TYR HE2 H 7.394 0.506 -1.970 1.00 . A A . 31 TYR HE2 1 1 19 11721 1 1 31 TYR HH H 10.847 0.870 -2.801 1.00 . A A . 31 TYR HH 1 1 19 11722 1 1 31 TYR N N 9.375 -4.449 1.812 1.00 . A A . 31 TYR N 1 1 19 11723 1 1 31 TYR O O 8.758 -4.678 -1.704 1.00 . A A . 31 TYR O 1 1 19 11724 1 1 31 TYR OH O 9.903 0.858 -2.587 1.00 . A A . 31 TYR OH 1 1 19 11725 1 1 32 PRO C C 10.157 -7.347 -2.738 1.00 . A A . 32 PRO C 1 1 19 11726 1 1 32 PRO CA C 10.908 -6.358 -1.828 1.00 . A A . 32 PRO CA 1 1 19 11727 1 1 32 PRO CB C 12.216 -6.951 -1.294 1.00 . A A . 32 PRO CB 1 1 19 11728 1 1 32 PRO CD C 10.664 -6.793 0.501 1.00 . A A . 32 PRO CD 1 1 19 11729 1 1 32 PRO CG C 11.742 -7.717 -0.060 1.00 . A A . 32 PRO CG 1 1 19 11730 1 1 32 PRO HA H 11.112 -5.418 -2.356 1.00 . A A . 32 PRO HA 1 1 19 11731 1 1 32 PRO HB2 H 12.720 -7.596 -2.012 1.00 . A A . 32 PRO HB2 1 1 19 11732 1 1 32 PRO HB3 H 12.884 -6.143 -0.990 1.00 . A A . 32 PRO HB3 1 1 19 11733 1 1 32 PRO HD2 H 9.871 -7.354 0.997 1.00 . A A . 32 PRO HD2 1 1 19 11734 1 1 32 PRO HD3 H 11.134 -6.099 1.195 1.00 . A A . 32 PRO HD3 1 1 19 11735 1 1 32 PRO HG2 H 11.306 -8.670 -0.354 1.00 . A A . 32 PRO HG2 1 1 19 11736 1 1 32 PRO HG3 H 12.547 -7.864 0.657 1.00 . A A . 32 PRO HG3 1 1 19 11737 1 1 32 PRO N N 10.132 -6.052 -0.632 1.00 . A A . 32 PRO N 1 1 19 11738 1 1 32 PRO O O 10.737 -7.953 -3.638 1.00 . A A . 32 PRO O 1 1 19 11739 1 1 33 ALA C C 6.675 -7.467 -3.501 1.00 . A A . 33 ALA C 1 1 19 11740 1 1 33 ALA CA C 7.940 -8.304 -3.306 1.00 . A A . 33 ALA CA 1 1 19 11741 1 1 33 ALA CB C 7.564 -9.667 -2.739 1.00 . A A . 33 ALA CB 1 1 19 11742 1 1 33 ALA H H 8.512 -7.186 -1.617 1.00 . A A . 33 ALA H 1 1 19 11743 1 1 33 ALA HA H 8.391 -8.451 -4.291 1.00 . A A . 33 ALA HA 1 1 19 11744 1 1 33 ALA HB1 H 6.758 -10.101 -3.331 1.00 . A A . 33 ALA HB1 1 1 19 11745 1 1 33 ALA HB2 H 8.421 -10.335 -2.787 1.00 . A A . 33 ALA HB2 1 1 19 11746 1 1 33 ALA HB3 H 7.222 -9.535 -1.710 1.00 . A A . 33 ALA HB3 1 1 19 11747 1 1 33 ALA N N 8.896 -7.659 -2.419 1.00 . A A . 33 ALA N 1 1 19 11748 1 1 33 ALA O O 5.910 -7.762 -4.421 1.00 . A A . 33 ALA O 1 1 19 11749 1 1 34 GLY C C 4.988 -5.003 -4.026 1.00 . A A . 34 GLY C 1 1 19 11750 1 1 34 GLY CA C 5.167 -5.725 -2.696 1.00 . A A . 34 GLY CA 1 1 19 11751 1 1 34 GLY H H 7.122 -6.134 -2.007 1.00 . A A . 34 GLY H 1 1 19 11752 1 1 34 GLY HA2 H 5.127 -5.008 -1.882 1.00 . A A . 34 GLY HA2 1 1 19 11753 1 1 34 GLY HA3 H 4.349 -6.432 -2.563 1.00 . A A . 34 GLY HA3 1 1 19 11754 1 1 34 GLY N N 6.430 -6.450 -2.666 1.00 . A A . 34 GLY N 1 1 19 11755 1 1 34 GLY O O 3.863 -4.881 -4.488 1.00 . A A . 34 GLY O 1 1 19 11756 1 1 35 CYS C C 5.502 -4.936 -7.069 1.00 . A A . 35 CYS C 1 1 19 11757 1 1 35 CYS CA C 6.176 -4.053 -6.006 1.00 . A A . 35 CYS CA 1 1 19 11758 1 1 35 CYS CB C 7.667 -3.898 -6.379 1.00 . A A . 35 CYS CB 1 1 19 11759 1 1 35 CYS H H 6.992 -4.744 -4.231 1.00 . A A . 35 CYS H 1 1 19 11760 1 1 35 CYS HA H 5.696 -3.073 -6.000 1.00 . A A . 35 CYS HA 1 1 19 11761 1 1 35 CYS HB2 H 7.898 -4.705 -7.068 1.00 . A A . 35 CYS HB2 1 1 19 11762 1 1 35 CYS HB3 H 7.817 -2.964 -6.925 1.00 . A A . 35 CYS HB3 1 1 19 11763 1 1 35 CYS N N 6.094 -4.619 -4.671 1.00 . A A . 35 CYS N 1 1 19 11764 1 1 35 CYS O O 5.267 -4.465 -8.182 1.00 . A A . 35 CYS O 1 1 19 11765 1 1 35 CYS SG S 8.915 -4.064 -5.063 1.00 . A A . 35 CYS SG 1 1 19 11766 1 1 36 SER C C 3.505 -7.879 -7.240 1.00 . A A . 36 SER C 1 1 19 11767 1 1 36 SER CA C 4.810 -7.231 -7.700 1.00 . A A . 36 SER CA 1 1 19 11768 1 1 36 SER CB C 5.955 -8.228 -7.815 1.00 . A A . 36 SER CB 1 1 19 11769 1 1 36 SER H H 5.612 -6.640 -5.934 1.00 . A A . 36 SER H 1 1 19 11770 1 1 36 SER HA H 4.644 -6.781 -8.679 1.00 . A A . 36 SER HA 1 1 19 11771 1 1 36 SER HB2 H 5.773 -8.806 -8.697 1.00 . A A . 36 SER HB2 1 1 19 11772 1 1 36 SER HB3 H 6.870 -7.659 -7.936 1.00 . A A . 36 SER HB3 1 1 19 11773 1 1 36 SER HG H 5.999 -8.635 -5.880 1.00 . A A . 36 SER HG 1 1 19 11774 1 1 36 SER N N 5.285 -6.224 -6.787 1.00 . A A . 36 SER N 1 1 19 11775 1 1 36 SER O O 2.802 -8.484 -8.055 1.00 . A A . 36 SER O 1 1 19 11776 1 1 36 SER OG O 6.130 -9.113 -6.719 1.00 . A A . 36 SER OG 1 1 19 11777 1 1 37 ASN C C 0.876 -7.120 -5.876 1.00 . A A . 37 ASN C 1 1 19 11778 1 1 37 ASN CA C 1.876 -8.165 -5.416 1.00 . A A . 37 ASN CA 1 1 19 11779 1 1 37 ASN CB C 1.900 -8.235 -3.867 1.00 . A A . 37 ASN CB 1 1 19 11780 1 1 37 ASN CG C 1.664 -9.645 -3.364 1.00 . A A . 37 ASN CG 1 1 19 11781 1 1 37 ASN H H 3.743 -7.088 -5.438 1.00 . A A . 37 ASN H 1 1 19 11782 1 1 37 ASN HA H 1.612 -9.140 -5.829 1.00 . A A . 37 ASN HA 1 1 19 11783 1 1 37 ASN HB2 H 2.810 -7.809 -3.452 1.00 . A A . 37 ASN HB2 1 1 19 11784 1 1 37 ASN HB3 H 1.094 -7.632 -3.447 1.00 . A A . 37 ASN HB3 1 1 19 11785 1 1 37 ASN HD21 H -0.262 -9.496 -3.922 1.00 . A A . 37 ASN HD21 1 1 19 11786 1 1 37 ASN HD22 H 0.148 -11.022 -3.201 1.00 . A A . 37 ASN HD22 1 1 19 11787 1 1 37 ASN N N 3.150 -7.716 -5.965 1.00 . A A . 37 ASN N 1 1 19 11788 1 1 37 ASN ND2 N 0.430 -10.093 -3.476 1.00 . A A . 37 ASN ND2 1 1 19 11789 1 1 37 ASN O O 0.813 -6.070 -5.246 1.00 . A A . 37 ASN O 1 1 19 11790 1 1 37 ASN OD1 O 2.568 -10.328 -2.877 1.00 . A A . 37 ASN OD1 1 1 19 11791 1 1 38 SER C C -1.645 -5.649 -6.659 1.00 . A A . 38 SER C 1 1 19 11792 1 1 38 SER CA C -0.636 -6.290 -7.618 1.00 . A A . 38 SER CA 1 1 19 11793 1 1 38 SER CB C -1.270 -6.776 -8.919 1.00 . A A . 38 SER CB 1 1 19 11794 1 1 38 SER H H 0.175 -8.250 -7.431 1.00 . A A . 38 SER H 1 1 19 11795 1 1 38 SER HA H 0.050 -5.507 -7.936 1.00 . A A . 38 SER HA 1 1 19 11796 1 1 38 SER HB2 H -1.955 -6.011 -9.292 1.00 . A A . 38 SER HB2 1 1 19 11797 1 1 38 SER HB3 H -0.470 -6.895 -9.645 1.00 . A A . 38 SER HB3 1 1 19 11798 1 1 38 SER HG H -2.810 -7.800 -8.375 1.00 . A A . 38 SER HG 1 1 19 11799 1 1 38 SER N N 0.153 -7.346 -6.980 1.00 . A A . 38 SER N 1 1 19 11800 1 1 38 SER O O -1.936 -4.462 -6.788 1.00 . A A . 38 SER O 1 1 19 11801 1 1 38 SER OG O -1.953 -8.013 -8.807 1.00 . A A . 38 SER OG 1 1 19 11802 1 1 39 ASP C C -2.308 -4.646 -3.881 1.00 . A A . 39 ASP C 1 1 19 11803 1 1 39 ASP CA C -2.919 -5.881 -4.551 1.00 . A A . 39 ASP CA 1 1 19 11804 1 1 39 ASP CB C -3.129 -6.993 -3.516 1.00 . A A . 39 ASP CB 1 1 19 11805 1 1 39 ASP CG C -4.083 -6.514 -2.420 1.00 . A A . 39 ASP CG 1 1 19 11806 1 1 39 ASP H H -1.814 -7.364 -5.600 1.00 . A A . 39 ASP H 1 1 19 11807 1 1 39 ASP HA H -3.889 -5.606 -4.959 1.00 . A A . 39 ASP HA 1 1 19 11808 1 1 39 ASP HB2 H -3.591 -7.842 -4.017 1.00 . A A . 39 ASP HB2 1 1 19 11809 1 1 39 ASP HB3 H -2.174 -7.349 -3.101 1.00 . A A . 39 ASP HB3 1 1 19 11810 1 1 39 ASP N N -2.095 -6.389 -5.642 1.00 . A A . 39 ASP N 1 1 19 11811 1 1 39 ASP O O -3.021 -3.704 -3.538 1.00 . A A . 39 ASP O 1 1 19 11812 1 1 39 ASP OD1 O -5.274 -6.298 -2.747 1.00 . A A . 39 ASP OD1 1 1 19 11813 1 1 39 ASP OD2 O -3.729 -6.528 -1.225 1.00 . A A . 39 ASP OD2 1 1 19 11814 1 1 40 CYS C C 0.534 -2.714 -4.113 1.00 . A A . 40 CYS C 1 1 19 11815 1 1 40 CYS CA C -0.187 -3.600 -3.101 1.00 . A A . 40 CYS CA 1 1 19 11816 1 1 40 CYS CB C 0.786 -4.274 -2.121 1.00 . A A . 40 CYS CB 1 1 19 11817 1 1 40 CYS H H -0.467 -5.361 -4.219 1.00 . A A . 40 CYS H 1 1 19 11818 1 1 40 CYS HA H -0.847 -2.953 -2.526 1.00 . A A . 40 CYS HA 1 1 19 11819 1 1 40 CYS HB2 H 1.247 -5.158 -2.581 1.00 . A A . 40 CYS HB2 1 1 19 11820 1 1 40 CYS HB3 H 1.589 -3.586 -1.835 1.00 . A A . 40 CYS HB3 1 1 19 11821 1 1 40 CYS N N -0.983 -4.630 -3.745 1.00 . A A . 40 CYS N 1 1 19 11822 1 1 40 CYS O O 0.704 -1.531 -3.831 1.00 . A A . 40 CYS O 1 1 19 11823 1 1 40 CYS SG S -0.091 -4.719 -0.606 1.00 . A A . 40 CYS SG 1 1 19 11824 1 1 41 THR C C 1.171 -1.130 -6.563 1.00 . A A . 41 THR C 1 1 19 11825 1 1 41 THR CA C 1.653 -2.560 -6.325 1.00 . A A . 41 THR CA 1 1 19 11826 1 1 41 THR CB C 1.574 -3.431 -7.575 1.00 . A A . 41 THR CB 1 1 19 11827 1 1 41 THR CG2 C 2.204 -2.864 -8.825 1.00 . A A . 41 THR CG2 1 1 19 11828 1 1 41 THR H H 0.809 -4.234 -5.433 1.00 . A A . 41 THR H 1 1 19 11829 1 1 41 THR HA H 2.696 -2.511 -6.009 1.00 . A A . 41 THR HA 1 1 19 11830 1 1 41 THR HB H 0.522 -3.596 -7.794 1.00 . A A . 41 THR HB 1 1 19 11831 1 1 41 THR HG1 H 2.175 -5.173 -8.166 1.00 . A A . 41 THR HG1 1 1 19 11832 1 1 41 THR HG21 H 1.765 -1.898 -9.059 1.00 . A A . 41 THR HG21 1 1 19 11833 1 1 41 THR HG22 H 3.274 -2.754 -8.681 1.00 . A A . 41 THR HG22 1 1 19 11834 1 1 41 THR HG23 H 1.989 -3.567 -9.630 1.00 . A A . 41 THR HG23 1 1 19 11835 1 1 41 THR N N 0.906 -3.235 -5.280 1.00 . A A . 41 THR N 1 1 19 11836 1 1 41 THR O O 1.940 -0.220 -6.300 1.00 . A A . 41 THR O 1 1 19 11837 1 1 41 THR OG1 O 2.224 -4.659 -7.337 1.00 . A A . 41 THR OG1 1 1 19 11838 1 1 42 ALA C C -0.516 1.444 -6.263 1.00 . A A . 42 ALA C 1 1 19 11839 1 1 42 ALA CA C -0.484 0.453 -7.433 1.00 . A A . 42 ALA CA 1 1 19 11840 1 1 42 ALA CB C -1.872 0.386 -8.069 1.00 . A A . 42 ALA CB 1 1 19 11841 1 1 42 ALA H H -0.694 -1.665 -7.193 1.00 . A A . 42 ALA H 1 1 19 11842 1 1 42 ALA HA H 0.232 0.846 -8.172 1.00 . A A . 42 ALA HA 1 1 19 11843 1 1 42 ALA HB1 H -1.845 -0.229 -8.969 1.00 . A A . 42 ALA HB1 1 1 19 11844 1 1 42 ALA HB2 H -2.189 1.396 -8.327 1.00 . A A . 42 ALA HB2 1 1 19 11845 1 1 42 ALA HB3 H -2.589 -0.032 -7.360 1.00 . A A . 42 ALA HB3 1 1 19 11846 1 1 42 ALA N N -0.062 -0.894 -7.032 1.00 . A A . 42 ALA N 1 1 19 11847 1 1 42 ALA O O -0.310 2.636 -6.480 1.00 . A A . 42 ALA O 1 1 19 11848 1 1 43 PHE C C 0.951 2.151 -3.793 1.00 . A A . 43 PHE C 1 1 19 11849 1 1 43 PHE CA C -0.531 1.793 -3.849 1.00 . A A . 43 PHE CA 1 1 19 11850 1 1 43 PHE CB C -1.057 1.071 -2.597 1.00 . A A . 43 PHE CB 1 1 19 11851 1 1 43 PHE CD1 C 0.634 1.403 -0.790 1.00 . A A . 43 PHE CD1 1 1 19 11852 1 1 43 PHE CD2 C -1.591 2.275 -0.403 1.00 . A A . 43 PHE CD2 1 1 19 11853 1 1 43 PHE CE1 C 1.061 1.888 0.444 1.00 . A A . 43 PHE CE1 1 1 19 11854 1 1 43 PHE CE2 C -1.182 2.687 0.880 1.00 . A A . 43 PHE CE2 1 1 19 11855 1 1 43 PHE CG C -0.667 1.640 -1.252 1.00 . A A . 43 PHE CG 1 1 19 11856 1 1 43 PHE CZ C 0.150 2.522 1.295 1.00 . A A . 43 PHE CZ 1 1 19 11857 1 1 43 PHE H H -0.880 -0.020 -4.917 1.00 . A A . 43 PHE H 1 1 19 11858 1 1 43 PHE HA H -1.072 2.723 -3.967 1.00 . A A . 43 PHE HA 1 1 19 11859 1 1 43 PHE HB2 H -2.143 1.003 -2.664 1.00 . A A . 43 PHE HB2 1 1 19 11860 1 1 43 PHE HB3 H -0.650 0.069 -2.585 1.00 . A A . 43 PHE HB3 1 1 19 11861 1 1 43 PHE HD1 H 1.310 0.822 -1.385 1.00 . A A . 43 PHE HD1 1 1 19 11862 1 1 43 PHE HD2 H -2.613 2.425 -0.721 1.00 . A A . 43 PHE HD2 1 1 19 11863 1 1 43 PHE HE1 H 2.090 1.763 0.736 1.00 . A A . 43 PHE HE1 1 1 19 11864 1 1 43 PHE HE2 H -1.879 3.165 1.544 1.00 . A A . 43 PHE HE2 1 1 19 11865 1 1 43 PHE HZ H 0.498 2.872 2.253 1.00 . A A . 43 PHE HZ 1 1 19 11866 1 1 43 PHE N N -0.745 0.974 -5.033 1.00 . A A . 43 PHE N 1 1 19 11867 1 1 43 PHE O O 1.300 3.331 -3.758 1.00 . A A . 43 PHE O 1 1 19 11868 1 1 44 LEU C C 3.870 2.241 -4.750 1.00 . A A . 44 LEU C 1 1 19 11869 1 1 44 LEU CA C 3.267 1.388 -3.627 1.00 . A A . 44 LEU CA 1 1 19 11870 1 1 44 LEU CB C 4.028 0.062 -3.521 1.00 . A A . 44 LEU CB 1 1 19 11871 1 1 44 LEU CD1 C 4.422 -2.126 -2.438 1.00 . A A . 44 LEU CD1 1 1 19 11872 1 1 44 LEU CD2 C 3.825 -0.160 -0.966 1.00 . A A . 44 LEU CD2 1 1 19 11873 1 1 44 LEU CG C 3.630 -0.824 -2.329 1.00 . A A . 44 LEU CG 1 1 19 11874 1 1 44 LEU H H 1.522 0.186 -3.754 1.00 . A A . 44 LEU H 1 1 19 11875 1 1 44 LEU HA H 3.362 1.933 -2.698 1.00 . A A . 44 LEU HA 1 1 19 11876 1 1 44 LEU HB2 H 3.889 -0.503 -4.446 1.00 . A A . 44 LEU HB2 1 1 19 11877 1 1 44 LEU HB3 H 5.085 0.300 -3.442 1.00 . A A . 44 LEU HB3 1 1 19 11878 1 1 44 LEU HD11 H 5.483 -1.928 -2.580 1.00 . A A . 44 LEU HD11 1 1 19 11879 1 1 44 LEU HD12 H 4.288 -2.739 -1.551 1.00 . A A . 44 LEU HD12 1 1 19 11880 1 1 44 LEU HD13 H 4.042 -2.659 -3.306 1.00 . A A . 44 LEU HD13 1 1 19 11881 1 1 44 LEU HD21 H 3.398 0.837 -0.920 1.00 . A A . 44 LEU HD21 1 1 19 11882 1 1 44 LEU HD22 H 3.309 -0.766 -0.222 1.00 . A A . 44 LEU HD22 1 1 19 11883 1 1 44 LEU HD23 H 4.876 -0.092 -0.722 1.00 . A A . 44 LEU HD23 1 1 19 11884 1 1 44 LEU HG H 2.579 -1.087 -2.388 1.00 . A A . 44 LEU HG 1 1 19 11885 1 1 44 LEU N N 1.841 1.154 -3.778 1.00 . A A . 44 LEU N 1 1 19 11886 1 1 44 LEU O O 4.764 3.045 -4.484 1.00 . A A . 44 LEU O 1 1 19 11887 1 1 45 SER C C 3.640 4.394 -6.900 1.00 . A A . 45 SER C 1 1 19 11888 1 1 45 SER CA C 3.701 2.878 -7.159 1.00 . A A . 45 SER CA 1 1 19 11889 1 1 45 SER CB C 2.741 2.365 -8.246 1.00 . A A . 45 SER CB 1 1 19 11890 1 1 45 SER H H 2.686 1.387 -6.160 1.00 . A A . 45 SER H 1 1 19 11891 1 1 45 SER HA H 4.720 2.632 -7.461 1.00 . A A . 45 SER HA 1 1 19 11892 1 1 45 SER HB2 H 1.733 2.309 -7.844 1.00 . A A . 45 SER HB2 1 1 19 11893 1 1 45 SER HB3 H 2.699 3.020 -9.097 1.00 . A A . 45 SER HB3 1 1 19 11894 1 1 45 SER HG H 2.711 0.837 -9.493 1.00 . A A . 45 SER HG 1 1 19 11895 1 1 45 SER N N 3.362 2.121 -5.972 1.00 . A A . 45 SER N 1 1 19 11896 1 1 45 SER O O 4.480 5.132 -7.423 1.00 . A A . 45 SER O 1 1 19 11897 1 1 45 SER OG O 3.174 1.084 -8.670 1.00 . A A . 45 SER OG 1 1 19 11898 1 1 46 GLN C C 3.231 6.438 -4.174 1.00 . A A . 46 GLN C 1 1 19 11899 1 1 46 GLN CA C 2.654 6.242 -5.581 1.00 . A A . 46 GLN CA 1 1 19 11900 1 1 46 GLN CB C 1.188 6.690 -5.636 1.00 . A A . 46 GLN CB 1 1 19 11901 1 1 46 GLN CD C 0.493 5.865 -7.997 1.00 . A A . 46 GLN CD 1 1 19 11902 1 1 46 GLN CG C 0.764 7.046 -7.066 1.00 . A A . 46 GLN CG 1 1 19 11903 1 1 46 GLN H H 1.992 4.249 -5.728 1.00 . A A . 46 GLN H 1 1 19 11904 1 1 46 GLN HA H 3.238 6.876 -6.251 1.00 . A A . 46 GLN HA 1 1 19 11905 1 1 46 GLN HB2 H 0.528 5.928 -5.215 1.00 . A A . 46 GLN HB2 1 1 19 11906 1 1 46 GLN HB3 H 1.094 7.592 -5.032 1.00 . A A . 46 GLN HB3 1 1 19 11907 1 1 46 GLN HE21 H -1.523 5.873 -7.640 1.00 . A A . 46 GLN HE21 1 1 19 11908 1 1 46 GLN HE22 H -0.892 4.655 -8.750 1.00 . A A . 46 GLN HE22 1 1 19 11909 1 1 46 GLN HG2 H -0.128 7.668 -7.013 1.00 . A A . 46 GLN HG2 1 1 19 11910 1 1 46 GLN HG3 H 1.571 7.623 -7.502 1.00 . A A . 46 GLN HG3 1 1 19 11911 1 1 46 GLN N N 2.734 4.860 -6.030 1.00 . A A . 46 GLN N 1 1 19 11912 1 1 46 GLN NE2 N -0.747 5.430 -8.105 1.00 . A A . 46 GLN NE2 1 1 19 11913 1 1 46 GLN O O 3.863 7.462 -3.916 1.00 . A A . 46 GLN O 1 1 19 11914 1 1 46 GLN OE1 O 1.393 5.366 -8.671 1.00 . A A . 46 GLN OE1 1 1 19 11915 1 1 47 CYS C C 4.997 5.712 -1.749 1.00 . A A . 47 CYS C 1 1 19 11916 1 1 47 CYS CA C 3.473 5.618 -1.861 1.00 . A A . 47 CYS CA 1 1 19 11917 1 1 47 CYS CB C 3.008 4.387 -1.081 1.00 . A A . 47 CYS CB 1 1 19 11918 1 1 47 CYS H H 2.465 4.696 -3.516 1.00 . A A . 47 CYS H 1 1 19 11919 1 1 47 CYS HA H 3.025 6.516 -1.435 1.00 . A A . 47 CYS HA 1 1 19 11920 1 1 47 CYS HB2 H 2.011 4.113 -1.418 1.00 . A A . 47 CYS HB2 1 1 19 11921 1 1 47 CYS HB3 H 3.670 3.556 -1.320 1.00 . A A . 47 CYS HB3 1 1 19 11922 1 1 47 CYS N N 3.030 5.496 -3.252 1.00 . A A . 47 CYS N 1 1 19 11923 1 1 47 CYS O O 5.518 6.352 -0.835 1.00 . A A . 47 CYS O 1 1 19 11924 1 1 47 CYS SG S 2.958 4.551 0.724 1.00 . A A . 47 CYS SG 1 1 19 11925 1 1 48 TYR C C 7.570 5.329 -4.136 1.00 . A A . 48 TYR C 1 1 19 11926 1 1 48 TYR CA C 7.122 4.875 -2.752 1.00 . A A . 48 TYR CA 1 1 19 11927 1 1 48 TYR CB C 7.483 3.416 -2.494 1.00 . A A . 48 TYR CB 1 1 19 11928 1 1 48 TYR CD1 C 8.581 3.302 -0.221 1.00 . A A . 48 TYR CD1 1 1 19 11929 1 1 48 TYR CD2 C 6.381 2.299 -0.527 1.00 . A A . 48 TYR CD2 1 1 19 11930 1 1 48 TYR CE1 C 8.625 2.819 1.099 1.00 . A A . 48 TYR CE1 1 1 19 11931 1 1 48 TYR CE2 C 6.446 1.758 0.764 1.00 . A A . 48 TYR CE2 1 1 19 11932 1 1 48 TYR CG C 7.467 3.028 -1.036 1.00 . A A . 48 TYR CG 1 1 19 11933 1 1 48 TYR CZ C 7.554 2.040 1.590 1.00 . A A . 48 TYR CZ 1 1 19 11934 1 1 48 TYR H H 5.154 4.568 -3.390 1.00 . A A . 48 TYR H 1 1 19 11935 1 1 48 TYR HA H 7.626 5.461 -1.991 1.00 . A A . 48 TYR HA 1 1 19 11936 1 1 48 TYR HB2 H 6.805 2.767 -3.044 1.00 . A A . 48 TYR HB2 1 1 19 11937 1 1 48 TYR HB3 H 8.480 3.222 -2.881 1.00 . A A . 48 TYR HB3 1 1 19 11938 1 1 48 TYR HD1 H 9.411 3.867 -0.622 1.00 . A A . 48 TYR HD1 1 1 19 11939 1 1 48 TYR HD2 H 5.544 2.078 -1.170 1.00 . A A . 48 TYR HD2 1 1 19 11940 1 1 48 TYR HE1 H 9.488 3.024 1.721 1.00 . A A . 48 TYR HE1 1 1 19 11941 1 1 48 TYR HE2 H 5.675 1.084 1.104 1.00 . A A . 48 TYR HE2 1 1 19 11942 1 1 48 TYR HH H 8.463 1.526 3.231 1.00 . A A . 48 TYR HH 1 1 19 11943 1 1 48 TYR N N 5.685 5.041 -2.669 1.00 . A A . 48 TYR N 1 1 19 11944 1 1 48 TYR O O 8.296 6.315 -4.250 1.00 . A A . 48 TYR O 1 1 19 11945 1 1 48 TYR OH O 7.570 1.573 2.861 1.00 . A A . 48 TYR OH 1 1 19 11946 1 1 49 GLY C C 7.515 3.573 -7.408 1.00 . A A . 49 GLY C 1 1 19 11947 1 1 49 GLY CA C 7.573 4.836 -6.549 1.00 . A A . 49 GLY CA 1 1 19 11948 1 1 49 GLY H H 6.435 3.899 -5.021 1.00 . A A . 49 GLY H 1 1 19 11949 1 1 49 GLY HA2 H 8.606 5.176 -6.524 1.00 . A A . 49 GLY HA2 1 1 19 11950 1 1 49 GLY HA3 H 6.974 5.617 -7.011 1.00 . A A . 49 GLY HA3 1 1 19 11951 1 1 49 GLY N N 7.124 4.625 -5.180 1.00 . A A . 49 GLY N 1 1 19 11952 1 1 49 GLY O O 7.622 3.653 -8.632 1.00 . A A . 49 GLY O 1 1 19 11953 1 1 50 GLY C C 8.828 0.657 -7.564 1.00 . A A . 50 GLY C 1 1 19 11954 1 1 50 GLY CA C 7.375 1.113 -7.475 1.00 . A A . 50 GLY CA 1 1 19 11955 1 1 50 GLY H H 7.291 2.347 -5.787 1.00 . A A . 50 GLY H 1 1 19 11956 1 1 50 GLY HA2 H 6.947 1.190 -8.473 1.00 . A A . 50 GLY HA2 1 1 19 11957 1 1 50 GLY HA3 H 6.788 0.383 -6.918 1.00 . A A . 50 GLY HA3 1 1 19 11958 1 1 50 GLY N N 7.323 2.398 -6.797 1.00 . A A . 50 GLY N 1 1 19 11959 1 1 50 GLY O O 9.559 1.106 -8.450 1.00 . A A . 50 GLY O 1 1 19 11960 1 1 51 CYS C C 10.800 -1.650 -7.909 1.00 . A A . 51 CYS C 1 1 19 11961 1 1 51 CYS CA C 10.573 -0.829 -6.636 1.00 . A A . 51 CYS CA 1 1 19 11962 1 1 51 CYS CB C 10.780 -1.669 -5.365 1.00 . A A . 51 CYS CB 1 1 19 11963 1 1 51 CYS H H 8.639 -0.380 -5.854 1.00 . A A . 51 CYS H 1 1 19 11964 1 1 51 CYS HA H 11.331 -0.042 -6.620 1.00 . A A . 51 CYS HA 1 1 19 11965 1 1 51 CYS HB2 H 11.368 -2.549 -5.631 1.00 . A A . 51 CYS HB2 1 1 19 11966 1 1 51 CYS HB3 H 11.402 -1.068 -4.702 1.00 . A A . 51 CYS HB3 1 1 19 11967 1 1 51 CYS N N 9.262 -0.188 -6.628 1.00 . A A . 51 CYS N 1 1 19 11968 1 1 51 CYS O O 11.965 -1.944 -8.239 1.00 . A A . 51 CYS O 1 1 19 11969 1 1 51 CYS OXT O 9.844 -2.091 -8.586 1.00 . A A . 51 CYS OXT 1 1 19 11970 1 1 51 CYS SG S 9.316 -2.190 -4.415 1.00 . A A . 51 CYS SG 1 1 20 11971 1 1 1 GLY C C -7.820 -6.184 -0.841 1.00 . A A . 1 GLY C 1 1 20 11972 1 1 1 GLY CA C -7.502 -7.234 -1.892 1.00 . A A . 1 GLY CA 1 1 20 11973 1 1 1 GLY H1 H -8.707 -6.384 -3.319 1.00 . A A . 1 GLY H1 1 1 20 11974 1 1 1 GLY H2 H -7.120 -5.942 -3.417 1.00 . A A . 1 GLY H2 1 1 20 11975 1 1 1 GLY H3 H -7.580 -7.428 -3.937 1.00 . A A . 1 GLY H3 1 1 20 11976 1 1 1 GLY HA2 H -6.453 -7.512 -1.813 1.00 . A A . 1 GLY HA2 1 1 20 11977 1 1 1 GLY HA3 H -8.123 -8.112 -1.726 1.00 . A A . 1 GLY HA3 1 1 20 11978 1 1 1 GLY N N -7.753 -6.716 -3.244 1.00 . A A . 1 GLY N 1 1 20 11979 1 1 1 GLY O O -8.634 -5.287 -1.085 1.00 . A A . 1 GLY O 1 1 20 11980 1 1 2 GLU C C -6.948 -3.964 1.152 1.00 . A A . 2 GLU C 1 1 20 11981 1 1 2 GLU CA C -7.499 -5.360 1.449 1.00 . A A . 2 GLU CA 1 1 20 11982 1 1 2 GLU CB C -7.044 -5.852 2.830 1.00 . A A . 2 GLU CB 1 1 20 11983 1 1 2 GLU CD C -5.193 -6.892 4.278 1.00 . A A . 2 GLU CD 1 1 20 11984 1 1 2 GLU CG C -5.634 -6.447 2.872 1.00 . A A . 2 GLU CG 1 1 20 11985 1 1 2 GLU H H -6.552 -7.031 0.516 1.00 . A A . 2 GLU H 1 1 20 11986 1 1 2 GLU HA H -8.568 -5.294 1.535 1.00 . A A . 2 GLU HA 1 1 20 11987 1 1 2 GLU HB2 H -7.096 -5.005 3.516 1.00 . A A . 2 GLU HB2 1 1 20 11988 1 1 2 GLU HB3 H -7.754 -6.608 3.168 1.00 . A A . 2 GLU HB3 1 1 20 11989 1 1 2 GLU HG2 H -5.667 -7.291 2.191 1.00 . A A . 2 GLU HG2 1 1 20 11990 1 1 2 GLU HG3 H -4.915 -5.715 2.502 1.00 . A A . 2 GLU HG3 1 1 20 11991 1 1 2 GLU N N -7.229 -6.298 0.357 1.00 . A A . 2 GLU N 1 1 20 11992 1 1 2 GLU O O -7.587 -2.963 1.500 1.00 . A A . 2 GLU O 1 1 20 11993 1 1 2 GLU OE1 O -5.849 -6.511 5.272 1.00 . A A . 2 GLU OE1 1 1 20 11994 1 1 2 GLU OE2 O -4.149 -7.573 4.422 1.00 . A A . 2 GLU OE2 1 1 20 11995 1 1 3 CYS C C -5.978 -1.959 -0.938 1.00 . A A . 3 CYS C 1 1 20 11996 1 1 3 CYS CA C -5.133 -2.642 0.154 1.00 . A A . 3 CYS CA 1 1 20 11997 1 1 3 CYS CB C -3.697 -2.903 -0.297 1.00 . A A . 3 CYS CB 1 1 20 11998 1 1 3 CYS H H -5.357 -4.758 0.180 1.00 . A A . 3 CYS H 1 1 20 11999 1 1 3 CYS HA H -5.056 -1.995 1.041 1.00 . A A . 3 CYS HA 1 1 20 12000 1 1 3 CYS HB2 H -3.158 -3.389 0.516 1.00 . A A . 3 CYS HB2 1 1 20 12001 1 1 3 CYS HB3 H -3.700 -3.577 -1.152 1.00 . A A . 3 CYS HB3 1 1 20 12002 1 1 3 CYS N N -5.770 -3.897 0.521 1.00 . A A . 3 CYS N 1 1 20 12003 1 1 3 CYS O O -6.332 -0.786 -0.802 1.00 . A A . 3 CYS O 1 1 20 12004 1 1 3 CYS SG S -2.817 -1.381 -0.728 1.00 . A A . 3 CYS SG 1 1 20 12005 1 1 4 GLU C C -8.579 -1.651 -2.503 1.00 . A A . 4 GLU C 1 1 20 12006 1 1 4 GLU CA C -7.243 -2.159 -3.040 1.00 . A A . 4 GLU CA 1 1 20 12007 1 1 4 GLU CB C -7.515 -3.216 -4.115 1.00 . A A . 4 GLU CB 1 1 20 12008 1 1 4 GLU CD C -6.500 -4.461 -6.103 1.00 . A A . 4 GLU CD 1 1 20 12009 1 1 4 GLU CG C -6.359 -3.306 -5.109 1.00 . A A . 4 GLU CG 1 1 20 12010 1 1 4 GLU H H -6.016 -3.635 -2.104 1.00 . A A . 4 GLU H 1 1 20 12011 1 1 4 GLU HA H -6.735 -1.312 -3.499 1.00 . A A . 4 GLU HA 1 1 20 12012 1 1 4 GLU HB2 H -7.702 -4.176 -3.641 1.00 . A A . 4 GLU HB2 1 1 20 12013 1 1 4 GLU HB3 H -8.402 -2.922 -4.673 1.00 . A A . 4 GLU HB3 1 1 20 12014 1 1 4 GLU HG2 H -6.341 -2.366 -5.659 1.00 . A A . 4 GLU HG2 1 1 20 12015 1 1 4 GLU HG3 H -5.413 -3.399 -4.581 1.00 . A A . 4 GLU HG3 1 1 20 12016 1 1 4 GLU N N -6.384 -2.690 -1.983 1.00 . A A . 4 GLU N 1 1 20 12017 1 1 4 GLU O O -9.109 -0.681 -3.046 1.00 . A A . 4 GLU O 1 1 20 12018 1 1 4 GLU OE1 O -6.770 -5.612 -5.691 1.00 . A A . 4 GLU OE1 1 1 20 12019 1 1 4 GLU OE2 O -6.309 -4.209 -7.320 1.00 . A A . 4 GLU OE2 1 1 20 12020 1 1 5 GLN C C -10.181 -0.439 -0.145 1.00 . A A . 5 GLN C 1 1 20 12021 1 1 5 GLN CA C -10.382 -1.777 -0.867 1.00 . A A . 5 GLN CA 1 1 20 12022 1 1 5 GLN CB C -10.987 -2.847 0.054 1.00 . A A . 5 GLN CB 1 1 20 12023 1 1 5 GLN CD C -13.267 -2.932 -1.057 1.00 . A A . 5 GLN CD 1 1 20 12024 1 1 5 GLN CG C -12.505 -2.689 0.248 1.00 . A A . 5 GLN CG 1 1 20 12025 1 1 5 GLN H H -8.681 -3.077 -1.058 1.00 . A A . 5 GLN H 1 1 20 12026 1 1 5 GLN HA H -11.077 -1.604 -1.684 1.00 . A A . 5 GLN HA 1 1 20 12027 1 1 5 GLN HB2 H -10.813 -3.827 -0.387 1.00 . A A . 5 GLN HB2 1 1 20 12028 1 1 5 GLN HB3 H -10.488 -2.824 1.021 1.00 . A A . 5 GLN HB3 1 1 20 12029 1 1 5 GLN HE21 H -14.068 -1.051 -1.114 1.00 . A A . 5 GLN HE21 1 1 20 12030 1 1 5 GLN HE22 H -14.387 -2.068 -2.509 1.00 . A A . 5 GLN HE22 1 1 20 12031 1 1 5 GLN HG2 H -12.839 -3.419 0.985 1.00 . A A . 5 GLN HG2 1 1 20 12032 1 1 5 GLN HG3 H -12.733 -1.700 0.644 1.00 . A A . 5 GLN HG3 1 1 20 12033 1 1 5 GLN N N -9.136 -2.261 -1.452 1.00 . A A . 5 GLN N 1 1 20 12034 1 1 5 GLN NE2 N -13.951 -1.943 -1.597 1.00 . A A . 5 GLN NE2 1 1 20 12035 1 1 5 GLN O O -11.149 0.296 0.049 1.00 . A A . 5 GLN O 1 1 20 12036 1 1 5 GLN OE1 O -13.236 -4.034 -1.598 1.00 . A A . 5 GLN OE1 1 1 20 12037 1 1 6 CYS C C -8.595 2.226 -0.371 1.00 . A A . 6 CYS C 1 1 20 12038 1 1 6 CYS CA C -8.619 1.221 0.770 1.00 . A A . 6 CYS CA 1 1 20 12039 1 1 6 CYS CB C -7.283 1.160 1.498 1.00 . A A . 6 CYS CB 1 1 20 12040 1 1 6 CYS H H -8.182 -0.721 0.037 1.00 . A A . 6 CYS H 1 1 20 12041 1 1 6 CYS HA H -9.380 1.535 1.482 1.00 . A A . 6 CYS HA 1 1 20 12042 1 1 6 CYS HB2 H -7.291 0.257 2.091 1.00 . A A . 6 CYS HB2 1 1 20 12043 1 1 6 CYS HB3 H -6.454 1.085 0.796 1.00 . A A . 6 CYS HB3 1 1 20 12044 1 1 6 CYS N N -8.953 -0.097 0.249 1.00 . A A . 6 CYS N 1 1 20 12045 1 1 6 CYS O O -9.291 3.231 -0.322 1.00 . A A . 6 CYS O 1 1 20 12046 1 1 6 CYS SG S -7.026 2.583 2.577 1.00 . A A . 6 CYS SG 1 1 20 12047 1 1 7 PHE C C -9.265 2.962 -3.213 1.00 . A A . 7 PHE C 1 1 20 12048 1 1 7 PHE CA C -7.859 2.706 -2.663 1.00 . A A . 7 PHE CA 1 1 20 12049 1 1 7 PHE CB C -7.011 1.984 -3.713 1.00 . A A . 7 PHE CB 1 1 20 12050 1 1 7 PHE CD1 C -5.749 3.785 -4.936 1.00 . A A . 7 PHE CD1 1 1 20 12051 1 1 7 PHE CD2 C -4.581 2.443 -3.271 1.00 . A A . 7 PHE CD2 1 1 20 12052 1 1 7 PHE CE1 C -4.585 4.532 -5.163 1.00 . A A . 7 PHE CE1 1 1 20 12053 1 1 7 PHE CE2 C -3.432 3.215 -3.486 1.00 . A A . 7 PHE CE2 1 1 20 12054 1 1 7 PHE CG C -5.742 2.734 -4.003 1.00 . A A . 7 PHE CG 1 1 20 12055 1 1 7 PHE CZ C -3.419 4.247 -4.437 1.00 . A A . 7 PHE CZ 1 1 20 12056 1 1 7 PHE H H -7.330 1.050 -1.419 1.00 . A A . 7 PHE H 1 1 20 12057 1 1 7 PHE HA H -7.409 3.676 -2.424 1.00 . A A . 7 PHE HA 1 1 20 12058 1 1 7 PHE HB2 H -6.764 0.974 -3.384 1.00 . A A . 7 PHE HB2 1 1 20 12059 1 1 7 PHE HB3 H -7.578 1.882 -4.638 1.00 . A A . 7 PHE HB3 1 1 20 12060 1 1 7 PHE HD1 H -6.664 4.064 -5.439 1.00 . A A . 7 PHE HD1 1 1 20 12061 1 1 7 PHE HD2 H -4.586 1.677 -2.506 1.00 . A A . 7 PHE HD2 1 1 20 12062 1 1 7 PHE HE1 H -4.626 5.376 -5.832 1.00 . A A . 7 PHE HE1 1 1 20 12063 1 1 7 PHE HE2 H -2.574 3.065 -2.860 1.00 . A A . 7 PHE HE2 1 1 20 12064 1 1 7 PHE HZ H -2.534 4.860 -4.541 1.00 . A A . 7 PHE HZ 1 1 20 12065 1 1 7 PHE N N -7.879 1.901 -1.448 1.00 . A A . 7 PHE N 1 1 20 12066 1 1 7 PHE O O -9.551 4.040 -3.740 1.00 . A A . 7 PHE O 1 1 20 12067 1 1 8 SER C C -12.242 3.198 -2.720 1.00 . A A . 8 SER C 1 1 20 12068 1 1 8 SER CA C -11.546 2.056 -3.456 1.00 . A A . 8 SER CA 1 1 20 12069 1 1 8 SER CB C -12.227 0.718 -3.141 1.00 . A A . 8 SER CB 1 1 20 12070 1 1 8 SER H H -9.804 1.098 -2.697 1.00 . A A . 8 SER H 1 1 20 12071 1 1 8 SER HA H -11.595 2.253 -4.528 1.00 . A A . 8 SER HA 1 1 20 12072 1 1 8 SER HB2 H -11.480 -0.017 -2.865 1.00 . A A . 8 SER HB2 1 1 20 12073 1 1 8 SER HB3 H -12.914 0.829 -2.302 1.00 . A A . 8 SER HB3 1 1 20 12074 1 1 8 SER HG H -13.788 0.677 -4.246 1.00 . A A . 8 SER HG 1 1 20 12075 1 1 8 SER N N -10.146 1.970 -3.082 1.00 . A A . 8 SER N 1 1 20 12076 1 1 8 SER O O -13.154 3.803 -3.278 1.00 . A A . 8 SER O 1 1 20 12077 1 1 8 SER OG O -12.917 0.223 -4.266 1.00 . A A . 8 SER OG 1 1 20 12078 1 1 9 ASP C C -11.503 5.897 -0.824 1.00 . A A . 9 ASP C 1 1 20 12079 1 1 9 ASP CA C -12.393 4.650 -0.755 1.00 . A A . 9 ASP CA 1 1 20 12080 1 1 9 ASP CB C -12.620 4.194 0.694 1.00 . A A . 9 ASP CB 1 1 20 12081 1 1 9 ASP CG C -14.049 4.502 1.128 1.00 . A A . 9 ASP CG 1 1 20 12082 1 1 9 ASP H H -11.011 3.068 -1.089 1.00 . A A . 9 ASP H 1 1 20 12083 1 1 9 ASP HA H -13.366 4.905 -1.168 1.00 . A A . 9 ASP HA 1 1 20 12084 1 1 9 ASP HB2 H -12.457 3.118 0.776 1.00 . A A . 9 ASP HB2 1 1 20 12085 1 1 9 ASP HB3 H -11.910 4.666 1.372 1.00 . A A . 9 ASP HB3 1 1 20 12086 1 1 9 ASP N N -11.812 3.539 -1.502 1.00 . A A . 9 ASP N 1 1 20 12087 1 1 9 ASP O O -11.599 6.784 0.023 1.00 . A A . 9 ASP O 1 1 20 12088 1 1 9 ASP OD1 O -14.326 5.611 1.629 1.00 . A A . 9 ASP OD1 1 1 20 12089 1 1 9 ASP OD2 O -14.885 3.578 0.994 1.00 . A A . 9 ASP OD2 1 1 20 12090 1 1 10 GLY C C -8.877 7.658 -1.688 1.00 . A A . 10 GLY C 1 1 20 12091 1 1 10 GLY CA C -10.219 7.356 -2.357 1.00 . A A . 10 GLY CA 1 1 20 12092 1 1 10 GLY H H -10.755 5.306 -2.590 1.00 . A A . 10 GLY H 1 1 20 12093 1 1 10 GLY HA2 H -10.905 8.170 -2.130 1.00 . A A . 10 GLY HA2 1 1 20 12094 1 1 10 GLY HA3 H -10.052 7.345 -3.433 1.00 . A A . 10 GLY HA3 1 1 20 12095 1 1 10 GLY N N -10.846 6.100 -1.970 1.00 . A A . 10 GLY N 1 1 20 12096 1 1 10 GLY O O -8.442 8.809 -1.778 1.00 . A A . 10 GLY O 1 1 20 12097 1 1 11 GLY C C -5.809 6.729 -1.529 1.00 . A A . 11 GLY C 1 1 20 12098 1 1 11 GLY CA C -6.899 6.878 -0.466 1.00 . A A . 11 GLY CA 1 1 20 12099 1 1 11 GLY H H -8.656 5.786 -0.897 1.00 . A A . 11 GLY H 1 1 20 12100 1 1 11 GLY HA2 H -6.745 6.119 0.299 1.00 . A A . 11 GLY HA2 1 1 20 12101 1 1 11 GLY HA3 H -6.832 7.866 -0.011 1.00 . A A . 11 GLY HA3 1 1 20 12102 1 1 11 GLY N N -8.233 6.696 -1.024 1.00 . A A . 11 GLY N 1 1 20 12103 1 1 11 GLY O O -6.059 6.183 -2.601 1.00 . A A . 11 GLY O 1 1 20 12104 1 1 12 ASP C C -2.308 6.356 -1.354 1.00 . A A . 12 ASP C 1 1 20 12105 1 1 12 ASP CA C -3.412 7.129 -2.085 1.00 . A A . 12 ASP CA 1 1 20 12106 1 1 12 ASP CB C -2.888 8.518 -2.528 1.00 . A A . 12 ASP CB 1 1 20 12107 1 1 12 ASP CG C -2.960 9.651 -1.496 1.00 . A A . 12 ASP CG 1 1 20 12108 1 1 12 ASP H H -4.490 7.693 -0.339 1.00 . A A . 12 ASP H 1 1 20 12109 1 1 12 ASP HA H -3.658 6.570 -2.987 1.00 . A A . 12 ASP HA 1 1 20 12110 1 1 12 ASP HB2 H -1.857 8.426 -2.872 1.00 . A A . 12 ASP HB2 1 1 20 12111 1 1 12 ASP HB3 H -3.483 8.821 -3.392 1.00 . A A . 12 ASP HB3 1 1 20 12112 1 1 12 ASP N N -4.596 7.200 -1.213 1.00 . A A . 12 ASP N 1 1 20 12113 1 1 12 ASP O O -2.074 5.184 -1.619 1.00 . A A . 12 ASP O 1 1 20 12114 1 1 12 ASP OD1 O -3.000 9.392 -0.266 1.00 . A A . 12 ASP OD1 1 1 20 12115 1 1 12 ASP OD2 O -2.930 10.834 -1.899 1.00 . A A . 12 ASP OD2 1 1 20 12116 1 1 13 CYS C C -0.856 7.053 1.923 1.00 . A A . 13 CYS C 1 1 20 12117 1 1 13 CYS CA C -0.722 6.372 0.559 1.00 . A A . 13 CYS CA 1 1 20 12118 1 1 13 CYS CB C 0.732 6.416 0.061 1.00 . A A . 13 CYS CB 1 1 20 12119 1 1 13 CYS H H -1.935 7.946 -0.232 1.00 . A A . 13 CYS H 1 1 20 12120 1 1 13 CYS HA H -1.009 5.330 0.670 1.00 . A A . 13 CYS HA 1 1 20 12121 1 1 13 CYS HB2 H 0.765 5.997 -0.946 1.00 . A A . 13 CYS HB2 1 1 20 12122 1 1 13 CYS HB3 H 1.063 7.453 0.014 1.00 . A A . 13 CYS HB3 1 1 20 12123 1 1 13 CYS N N -1.632 6.992 -0.398 1.00 . A A . 13 CYS N 1 1 20 12124 1 1 13 CYS O O -0.649 6.404 2.956 1.00 . A A . 13 CYS O 1 1 20 12125 1 1 13 CYS SG S 1.893 5.479 1.102 1.00 . A A . 13 CYS SG 1 1 20 12126 1 1 14 THR C C -2.672 8.314 3.891 1.00 . A A . 14 THR C 1 1 20 12127 1 1 14 THR CA C -1.570 9.075 3.148 1.00 . A A . 14 THR CA 1 1 20 12128 1 1 14 THR CB C -1.985 10.508 2.740 1.00 . A A . 14 THR CB 1 1 20 12129 1 1 14 THR CG2 C -2.133 11.442 3.940 1.00 . A A . 14 THR CG2 1 1 20 12130 1 1 14 THR H H -1.439 8.828 1.080 1.00 . A A . 14 THR H 1 1 20 12131 1 1 14 THR HA H -0.676 9.121 3.773 1.00 . A A . 14 THR HA 1 1 20 12132 1 1 14 THR HB H -2.933 10.474 2.203 1.00 . A A . 14 THR HB 1 1 20 12133 1 1 14 THR HG1 H -1.504 11.537 1.158 1.00 . A A . 14 THR HG1 1 1 20 12134 1 1 14 THR HG21 H -1.195 11.499 4.494 1.00 . A A . 14 THR HG21 1 1 20 12135 1 1 14 THR HG22 H -2.410 12.438 3.594 1.00 . A A . 14 THR HG22 1 1 20 12136 1 1 14 THR HG23 H -2.923 11.078 4.596 1.00 . A A . 14 THR HG23 1 1 20 12137 1 1 14 THR N N -1.258 8.327 1.944 1.00 . A A . 14 THR N 1 1 20 12138 1 1 14 THR O O -2.485 7.868 5.026 1.00 . A A . 14 THR O 1 1 20 12139 1 1 14 THR OG1 O -1.010 11.074 1.880 1.00 . A A . 14 THR OG1 1 1 20 12140 1 1 15 THR C C -5.236 6.180 3.841 1.00 . A A . 15 THR C 1 1 20 12141 1 1 15 THR CA C -5.040 7.711 3.877 1.00 . A A . 15 THR CA 1 1 20 12142 1 1 15 THR CB C -6.010 8.520 2.984 1.00 . A A . 15 THR CB 1 1 20 12143 1 1 15 THR CG2 C -7.481 8.502 3.293 1.00 . A A . 15 THR CG2 1 1 20 12144 1 1 15 THR H H -4.037 8.565 2.373 1.00 . A A . 15 THR H 1 1 20 12145 1 1 15 THR HA H -5.082 8.070 4.904 1.00 . A A . 15 THR HA 1 1 20 12146 1 1 15 THR HB H -5.891 8.175 1.957 1.00 . A A . 15 THR HB 1 1 20 12147 1 1 15 THR HG1 H -5.651 10.239 2.115 1.00 . A A . 15 THR HG1 1 1 20 12148 1 1 15 THR HG21 H -7.649 8.898 4.284 1.00 . A A . 15 THR HG21 1 1 20 12149 1 1 15 THR HG22 H -7.973 9.117 2.544 1.00 . A A . 15 THR HG22 1 1 20 12150 1 1 15 THR HG23 H -7.847 7.487 3.210 1.00 . A A . 15 THR HG23 1 1 20 12151 1 1 15 THR N N -3.805 8.083 3.234 1.00 . A A . 15 THR N 1 1 20 12152 1 1 15 THR O O -6.358 5.693 3.914 1.00 . A A . 15 THR O 1 1 20 12153 1 1 15 THR OG1 O -5.644 9.895 3.041 1.00 . A A . 15 THR OG1 1 1 20 12154 1 1 16 CYS C C -2.964 3.264 4.510 1.00 . A A . 16 CYS C 1 1 20 12155 1 1 16 CYS CA C -4.165 3.930 3.839 1.00 . A A . 16 CYS CA 1 1 20 12156 1 1 16 CYS CB C -4.191 3.519 2.354 1.00 . A A . 16 CYS CB 1 1 20 12157 1 1 16 CYS H H -3.260 5.874 3.978 1.00 . A A . 16 CYS H 1 1 20 12158 1 1 16 CYS HA H -5.048 3.501 4.338 1.00 . A A . 16 CYS HA 1 1 20 12159 1 1 16 CYS HB2 H -3.424 4.071 1.813 1.00 . A A . 16 CYS HB2 1 1 20 12160 1 1 16 CYS HB3 H -3.955 2.457 2.286 1.00 . A A . 16 CYS HB3 1 1 20 12161 1 1 16 CYS N N -4.149 5.398 3.948 1.00 . A A . 16 CYS N 1 1 20 12162 1 1 16 CYS O O -2.986 2.047 4.675 1.00 . A A . 16 CYS O 1 1 20 12163 1 1 16 CYS SG S -5.768 3.769 1.507 1.00 . A A . 16 CYS SG 1 1 20 12164 1 1 17 PHE C C -1.295 3.314 7.211 1.00 . A A . 17 PHE C 1 1 20 12165 1 1 17 PHE CA C -0.880 3.360 5.734 1.00 . A A . 17 PHE CA 1 1 20 12166 1 1 17 PHE CB C 0.454 4.082 5.531 1.00 . A A . 17 PHE CB 1 1 20 12167 1 1 17 PHE CD1 C 1.816 2.031 6.117 1.00 . A A . 17 PHE CD1 1 1 20 12168 1 1 17 PHE CD2 C 2.440 4.156 7.102 1.00 . A A . 17 PHE CD2 1 1 20 12169 1 1 17 PHE CE1 C 2.798 1.377 6.883 1.00 . A A . 17 PHE CE1 1 1 20 12170 1 1 17 PHE CE2 C 3.429 3.509 7.860 1.00 . A A . 17 PHE CE2 1 1 20 12171 1 1 17 PHE CG C 1.609 3.415 6.248 1.00 . A A . 17 PHE CG 1 1 20 12172 1 1 17 PHE CZ C 3.612 2.119 7.750 1.00 . A A . 17 PHE CZ 1 1 20 12173 1 1 17 PHE H H -1.859 4.983 4.749 1.00 . A A . 17 PHE H 1 1 20 12174 1 1 17 PHE HA H -0.754 2.327 5.403 1.00 . A A . 17 PHE HA 1 1 20 12175 1 1 17 PHE HB2 H 0.683 4.105 4.464 1.00 . A A . 17 PHE HB2 1 1 20 12176 1 1 17 PHE HB3 H 0.345 5.104 5.893 1.00 . A A . 17 PHE HB3 1 1 20 12177 1 1 17 PHE HD1 H 1.217 1.472 5.416 1.00 . A A . 17 PHE HD1 1 1 20 12178 1 1 17 PHE HD2 H 2.301 5.220 7.219 1.00 . A A . 17 PHE HD2 1 1 20 12179 1 1 17 PHE HE1 H 2.938 0.307 6.806 1.00 . A A . 17 PHE HE1 1 1 20 12180 1 1 17 PHE HE2 H 4.007 4.091 8.561 1.00 . A A . 17 PHE HE2 1 1 20 12181 1 1 17 PHE HZ H 4.361 1.607 8.335 1.00 . A A . 17 PHE HZ 1 1 20 12182 1 1 17 PHE N N -1.917 3.989 4.918 1.00 . A A . 17 PHE N 1 1 20 12183 1 1 17 PHE O O -0.976 2.351 7.910 1.00 . A A . 17 PHE O 1 1 20 12184 1 1 18 ASN C C -1.367 4.361 10.073 1.00 . A A . 18 ASN C 1 1 20 12185 1 1 18 ASN CA C -2.511 4.502 9.055 1.00 . A A . 18 ASN CA 1 1 20 12186 1 1 18 ASN CB C -3.655 3.530 9.338 1.00 . A A . 18 ASN CB 1 1 20 12187 1 1 18 ASN CG C -4.631 4.052 10.382 1.00 . A A . 18 ASN CG 1 1 20 12188 1 1 18 ASN H H -2.179 5.123 7.077 1.00 . A A . 18 ASN H 1 1 20 12189 1 1 18 ASN HA H -2.892 5.519 9.138 1.00 . A A . 18 ASN HA 1 1 20 12190 1 1 18 ASN HB2 H -4.207 3.321 8.420 1.00 . A A . 18 ASN HB2 1 1 20 12191 1 1 18 ASN HB3 H -3.181 2.626 9.704 1.00 . A A . 18 ASN HB3 1 1 20 12192 1 1 18 ASN HD21 H -6.158 2.802 9.755 1.00 . A A . 18 ASN HD21 1 1 20 12193 1 1 18 ASN HD22 H -6.525 3.915 11.036 1.00 . A A . 18 ASN HD22 1 1 20 12194 1 1 18 ASN N N -2.049 4.318 7.674 1.00 . A A . 18 ASN N 1 1 20 12195 1 1 18 ASN ND2 N -5.838 3.520 10.400 1.00 . A A . 18 ASN ND2 1 1 20 12196 1 1 18 ASN O O -1.477 3.688 11.100 1.00 . A A . 18 ASN O 1 1 20 12197 1 1 18 ASN OD1 O -4.341 4.985 11.124 1.00 . A A . 18 ASN OD1 1 1 20 12198 1 1 19 ASN C C 1.311 3.199 10.767 1.00 . A A . 19 ASN C 1 1 20 12199 1 1 19 ASN CA C 1.100 4.630 10.262 1.00 . A A . 19 ASN CA 1 1 20 12200 1 1 19 ASN CB C 1.558 5.728 11.230 1.00 . A A . 19 ASN CB 1 1 20 12201 1 1 19 ASN CG C 3.081 5.749 11.273 1.00 . A A . 19 ASN CG 1 1 20 12202 1 1 19 ASN H H -0.217 5.461 8.863 1.00 . A A . 19 ASN H 1 1 20 12203 1 1 19 ASN HA H 1.728 4.705 9.399 1.00 . A A . 19 ASN HA 1 1 20 12204 1 1 19 ASN HB2 H 1.217 6.696 10.861 1.00 . A A . 19 ASN HB2 1 1 20 12205 1 1 19 ASN HB3 H 1.135 5.559 12.223 1.00 . A A . 19 ASN HB3 1 1 20 12206 1 1 19 ASN HD21 H 3.161 4.924 13.135 1.00 . A A . 19 ASN HD21 1 1 20 12207 1 1 19 ASN HD22 H 4.702 5.203 12.351 1.00 . A A . 19 ASN HD22 1 1 20 12208 1 1 19 ASN N N -0.211 4.898 9.705 1.00 . A A . 19 ASN N 1 1 20 12209 1 1 19 ASN ND2 N 3.697 5.351 12.372 1.00 . A A . 19 ASN ND2 1 1 20 12210 1 1 19 ASN O O 1.640 2.970 11.928 1.00 . A A . 19 ASN O 1 1 20 12211 1 1 19 ASN OD1 O 3.716 6.122 10.289 1.00 . A A . 19 ASN OD1 1 1 20 12212 1 1 20 GLY C C 0.304 0.014 10.672 1.00 . A A . 20 GLY C 1 1 20 12213 1 1 20 GLY CA C 1.467 0.826 10.110 1.00 . A A . 20 GLY CA 1 1 20 12214 1 1 20 GLY H H 0.830 2.452 8.941 1.00 . A A . 20 GLY H 1 1 20 12215 1 1 20 GLY HA2 H 2.318 0.763 10.782 1.00 . A A . 20 GLY HA2 1 1 20 12216 1 1 20 GLY HA3 H 1.765 0.373 9.168 1.00 . A A . 20 GLY HA3 1 1 20 12217 1 1 20 GLY N N 1.142 2.222 9.873 1.00 . A A . 20 GLY N 1 1 20 12218 1 1 20 GLY O O 0.485 -1.155 10.991 1.00 . A A . 20 GLY O 1 1 20 12219 1 1 21 THR C C -3.105 -0.255 10.073 1.00 . A A . 21 THR C 1 1 20 12220 1 1 21 THR CA C -2.109 -0.071 11.242 1.00 . A A . 21 THR CA 1 1 20 12221 1 1 21 THR CB C -2.607 0.799 12.403 1.00 . A A . 21 THR CB 1 1 20 12222 1 1 21 THR CG2 C -4.102 0.930 12.608 1.00 . A A . 21 THR CG2 1 1 20 12223 1 1 21 THR H H -1.030 1.554 10.523 1.00 . A A . 21 THR H 1 1 20 12224 1 1 21 THR HA H -1.888 -1.040 11.656 1.00 . A A . 21 THR HA 1 1 20 12225 1 1 21 THR HB H -2.287 1.781 12.145 1.00 . A A . 21 THR HB 1 1 20 12226 1 1 21 THR HG1 H -1.208 -0.042 13.532 1.00 . A A . 21 THR HG1 1 1 20 12227 1 1 21 THR HG21 H -4.527 1.351 11.699 1.00 . A A . 21 THR HG21 1 1 20 12228 1 1 21 THR HG22 H -4.539 -0.043 12.812 1.00 . A A . 21 THR HG22 1 1 20 12229 1 1 21 THR HG23 H -4.307 1.612 13.432 1.00 . A A . 21 THR HG23 1 1 20 12230 1 1 21 THR N N -0.897 0.582 10.766 1.00 . A A . 21 THR N 1 1 20 12231 1 1 21 THR O O -4.151 -0.869 10.250 1.00 . A A . 21 THR O 1 1 20 12232 1 1 21 THR OG1 O -2.005 0.505 13.658 1.00 . A A . 21 THR OG1 1 1 20 12233 1 1 22 GLY C C -3.813 -1.065 7.031 1.00 . A A . 22 GLY C 1 1 20 12234 1 1 22 GLY CA C -3.742 0.286 7.749 1.00 . A A . 22 GLY CA 1 1 20 12235 1 1 22 GLY H H -1.930 0.737 8.729 1.00 . A A . 22 GLY H 1 1 20 12236 1 1 22 GLY HA2 H -3.411 1.044 7.040 1.00 . A A . 22 GLY HA2 1 1 20 12237 1 1 22 GLY HA3 H -4.739 0.548 8.105 1.00 . A A . 22 GLY HA3 1 1 20 12238 1 1 22 GLY N N -2.818 0.275 8.877 1.00 . A A . 22 GLY N 1 1 20 12239 1 1 22 GLY O O -3.074 -1.991 7.375 1.00 . A A . 22 GLY O 1 1 20 12240 1 1 23 PRO C C -3.537 -2.603 4.362 1.00 . A A . 23 PRO C 1 1 20 12241 1 1 23 PRO CA C -4.788 -2.417 5.225 1.00 . A A . 23 PRO CA 1 1 20 12242 1 1 23 PRO CB C -6.032 -2.214 4.362 1.00 . A A . 23 PRO CB 1 1 20 12243 1 1 23 PRO CD C -5.425 -0.101 5.396 1.00 . A A . 23 PRO CD 1 1 20 12244 1 1 23 PRO CG C -6.119 -0.699 4.179 1.00 . A A . 23 PRO CG 1 1 20 12245 1 1 23 PRO HA H -4.922 -3.282 5.877 1.00 . A A . 23 PRO HA 1 1 20 12246 1 1 23 PRO HB2 H -5.932 -2.718 3.403 1.00 . A A . 23 PRO HB2 1 1 20 12247 1 1 23 PRO HB3 H -6.911 -2.578 4.891 1.00 . A A . 23 PRO HB3 1 1 20 12248 1 1 23 PRO HD2 H -4.756 0.672 5.052 1.00 . A A . 23 PRO HD2 1 1 20 12249 1 1 23 PRO HD3 H -6.134 0.364 6.077 1.00 . A A . 23 PRO HD3 1 1 20 12250 1 1 23 PRO HG2 H -5.569 -0.413 3.285 1.00 . A A . 23 PRO HG2 1 1 20 12251 1 1 23 PRO HG3 H -7.145 -0.355 4.105 1.00 . A A . 23 PRO HG3 1 1 20 12252 1 1 23 PRO N N -4.666 -1.189 6.004 1.00 . A A . 23 PRO N 1 1 20 12253 1 1 23 PRO O O -2.887 -3.648 4.372 1.00 . A A . 23 PRO O 1 1 20 12254 1 1 24 CYS C C -0.717 -1.241 3.780 1.00 . A A . 24 CYS C 1 1 20 12255 1 1 24 CYS CA C -1.953 -1.409 2.868 1.00 . A A . 24 CYS CA 1 1 20 12256 1 1 24 CYS CB C -2.113 -0.173 1.965 1.00 . A A . 24 CYS CB 1 1 20 12257 1 1 24 CYS H H -3.710 -0.701 3.746 1.00 . A A . 24 CYS H 1 1 20 12258 1 1 24 CYS HA H -1.816 -2.291 2.244 1.00 . A A . 24 CYS HA 1 1 20 12259 1 1 24 CYS HB2 H -2.284 0.675 2.612 1.00 . A A . 24 CYS HB2 1 1 20 12260 1 1 24 CYS HB3 H -1.185 -0.030 1.424 1.00 . A A . 24 CYS HB3 1 1 20 12261 1 1 24 CYS N N -3.161 -1.543 3.649 1.00 . A A . 24 CYS N 1 1 20 12262 1 1 24 CYS O O 0.236 -0.607 3.348 1.00 . A A . 24 CYS O 1 1 20 12263 1 1 24 CYS SG S -3.404 -0.070 0.715 1.00 . A A . 24 CYS SG 1 1 20 12264 1 1 25 ALA C C 1.570 -2.455 5.723 1.00 . A A . 25 ALA C 1 1 20 12265 1 1 25 ALA CA C 0.429 -1.466 5.943 1.00 . A A . 25 ALA CA 1 1 20 12266 1 1 25 ALA CB C 0.000 -1.464 7.408 1.00 . A A . 25 ALA CB 1 1 20 12267 1 1 25 ALA H H -1.460 -2.300 5.359 1.00 . A A . 25 ALA H 1 1 20 12268 1 1 25 ALA HA H 0.831 -0.482 5.733 1.00 . A A . 25 ALA HA 1 1 20 12269 1 1 25 ALA HB1 H -0.492 -2.401 7.664 1.00 . A A . 25 ALA HB1 1 1 20 12270 1 1 25 ALA HB2 H -0.659 -0.617 7.594 1.00 . A A . 25 ALA HB2 1 1 20 12271 1 1 25 ALA HB3 H 0.885 -1.363 8.036 1.00 . A A . 25 ALA HB3 1 1 20 12272 1 1 25 ALA N N -0.705 -1.705 5.042 1.00 . A A . 25 ALA N 1 1 20 12273 1 1 25 ALA O O 2.730 -2.044 5.654 1.00 . A A . 25 ALA O 1 1 20 12274 1 1 26 ASN C C 2.934 -4.567 3.944 1.00 . A A . 26 ASN C 1 1 20 12275 1 1 26 ASN CA C 2.310 -4.742 5.335 1.00 . A A . 26 ASN CA 1 1 20 12276 1 1 26 ASN CB C 1.781 -6.167 5.538 1.00 . A A . 26 ASN CB 1 1 20 12277 1 1 26 ASN CG C 1.699 -6.534 7.010 1.00 . A A . 26 ASN CG 1 1 20 12278 1 1 26 ASN H H 0.301 -4.043 5.625 1.00 . A A . 26 ASN H 1 1 20 12279 1 1 26 ASN HA H 3.115 -4.581 6.054 1.00 . A A . 26 ASN HA 1 1 20 12280 1 1 26 ASN HB2 H 0.808 -6.266 5.065 1.00 . A A . 26 ASN HB2 1 1 20 12281 1 1 26 ASN HB3 H 2.464 -6.869 5.057 1.00 . A A . 26 ASN HB3 1 1 20 12282 1 1 26 ASN HD21 H -0.320 -6.855 6.928 1.00 . A A . 26 ASN HD21 1 1 20 12283 1 1 26 ASN HD22 H 0.443 -7.049 8.493 1.00 . A A . 26 ASN HD22 1 1 20 12284 1 1 26 ASN N N 1.267 -3.748 5.590 1.00 . A A . 26 ASN N 1 1 20 12285 1 1 26 ASN ND2 N 0.514 -6.839 7.511 1.00 . A A . 26 ASN ND2 1 1 20 12286 1 1 26 ASN O O 4.020 -5.091 3.709 1.00 . A A . 26 ASN O 1 1 20 12287 1 1 26 ASN OD1 O 2.707 -6.522 7.718 1.00 . A A . 26 ASN OD1 1 1 20 12288 1 1 27 CYS C C 4.227 -2.568 1.983 1.00 . A A . 27 CYS C 1 1 20 12289 1 1 27 CYS CA C 2.928 -3.379 1.790 1.00 . A A . 27 CYS CA 1 1 20 12290 1 1 27 CYS CB C 1.952 -2.583 0.896 1.00 . A A . 27 CYS CB 1 1 20 12291 1 1 27 CYS H H 1.395 -3.428 3.277 1.00 . A A . 27 CYS H 1 1 20 12292 1 1 27 CYS HA H 3.185 -4.288 1.248 1.00 . A A . 27 CYS HA 1 1 20 12293 1 1 27 CYS HB2 H 1.818 -1.582 1.301 1.00 . A A . 27 CYS HB2 1 1 20 12294 1 1 27 CYS HB3 H 2.443 -2.441 -0.066 1.00 . A A . 27 CYS HB3 1 1 20 12295 1 1 27 CYS N N 2.316 -3.776 3.054 1.00 . A A . 27 CYS N 1 1 20 12296 1 1 27 CYS O O 4.887 -2.315 0.985 1.00 . A A . 27 CYS O 1 1 20 12297 1 1 27 CYS SG S 0.299 -3.257 0.556 1.00 . A A . 27 CYS SG 1 1 20 12298 1 1 28 LEU C C 6.863 -1.845 4.114 1.00 . A A . 28 LEU C 1 1 20 12299 1 1 28 LEU CA C 5.695 -1.164 3.410 1.00 . A A . 28 LEU CA 1 1 20 12300 1 1 28 LEU CB C 5.231 -0.016 4.318 1.00 . A A . 28 LEU CB 1 1 20 12301 1 1 28 LEU CD1 C 4.814 1.924 2.691 1.00 . A A . 28 LEU CD1 1 1 20 12302 1 1 28 LEU CD2 C 2.989 0.378 3.152 1.00 . A A . 28 LEU CD2 1 1 20 12303 1 1 28 LEU CG C 4.241 0.989 3.740 1.00 . A A . 28 LEU CG 1 1 20 12304 1 1 28 LEU H H 3.900 -2.077 3.941 1.00 . A A . 28 LEU H 1 1 20 12305 1 1 28 LEU HA H 6.050 -0.754 2.463 1.00 . A A . 28 LEU HA 1 1 20 12306 1 1 28 LEU HB2 H 4.784 -0.433 5.223 1.00 . A A . 28 LEU HB2 1 1 20 12307 1 1 28 LEU HB3 H 6.111 0.539 4.636 1.00 . A A . 28 LEU HB3 1 1 20 12308 1 1 28 LEU HD11 H 5.852 2.158 2.924 1.00 . A A . 28 LEU HD11 1 1 20 12309 1 1 28 LEU HD12 H 4.748 1.427 1.728 1.00 . A A . 28 LEU HD12 1 1 20 12310 1 1 28 LEU HD13 H 4.227 2.840 2.648 1.00 . A A . 28 LEU HD13 1 1 20 12311 1 1 28 LEU HD21 H 2.620 -0.390 3.820 1.00 . A A . 28 LEU HD21 1 1 20 12312 1 1 28 LEU HD22 H 2.225 1.140 3.061 1.00 . A A . 28 LEU HD22 1 1 20 12313 1 1 28 LEU HD23 H 3.209 -0.050 2.171 1.00 . A A . 28 LEU HD23 1 1 20 12314 1 1 28 LEU HG H 3.932 1.569 4.586 1.00 . A A . 28 LEU HG 1 1 20 12315 1 1 28 LEU N N 4.578 -2.081 3.188 1.00 . A A . 28 LEU N 1 1 20 12316 1 1 28 LEU O O 7.992 -1.799 3.635 1.00 . A A . 28 LEU O 1 1 20 12317 1 1 29 ALA C C 8.629 -3.696 5.742 1.00 . A A . 29 ALA C 1 1 20 12318 1 1 29 ALA CA C 7.652 -2.662 6.296 1.00 . A A . 29 ALA CA 1 1 20 12319 1 1 29 ALA CB C 7.005 -3.123 7.607 1.00 . A A . 29 ALA CB 1 1 20 12320 1 1 29 ALA H H 5.652 -2.379 5.634 1.00 . A A . 29 ALA H 1 1 20 12321 1 1 29 ALA HA H 8.213 -1.747 6.488 1.00 . A A . 29 ALA HA 1 1 20 12322 1 1 29 ALA HB1 H 7.785 -3.418 8.311 1.00 . A A . 29 ALA HB1 1 1 20 12323 1 1 29 ALA HB2 H 6.350 -3.976 7.426 1.00 . A A . 29 ALA HB2 1 1 20 12324 1 1 29 ALA HB3 H 6.425 -2.309 8.043 1.00 . A A . 29 ALA HB3 1 1 20 12325 1 1 29 ALA N N 6.609 -2.370 5.319 1.00 . A A . 29 ALA N 1 1 20 12326 1 1 29 ALA O O 9.831 -3.438 5.644 1.00 . A A . 29 ALA O 1 1 20 12327 1 1 30 GLY C C 8.161 -5.780 3.153 1.00 . A A . 30 GLY C 1 1 20 12328 1 1 30 GLY CA C 8.793 -5.818 4.527 1.00 . A A . 30 GLY CA 1 1 20 12329 1 1 30 GLY H H 7.096 -4.964 5.408 1.00 . A A . 30 GLY H 1 1 20 12330 1 1 30 GLY HA2 H 8.657 -6.807 4.961 1.00 . A A . 30 GLY HA2 1 1 20 12331 1 1 30 GLY HA3 H 9.857 -5.594 4.459 1.00 . A A . 30 GLY HA3 1 1 20 12332 1 1 30 GLY N N 8.094 -4.843 5.332 1.00 . A A . 30 GLY N 1 1 20 12333 1 1 30 GLY O O 7.128 -6.423 2.953 1.00 . A A . 30 GLY O 1 1 20 12334 1 1 31 TYR C C 9.284 -5.237 -0.225 1.00 . A A . 31 TYR C 1 1 20 12335 1 1 31 TYR CA C 8.221 -4.991 0.857 1.00 . A A . 31 TYR CA 1 1 20 12336 1 1 31 TYR CB C 7.551 -3.611 0.711 1.00 . A A . 31 TYR CB 1 1 20 12337 1 1 31 TYR CD1 C 9.786 -2.374 0.496 1.00 . A A . 31 TYR CD1 1 1 20 12338 1 1 31 TYR CD2 C 7.810 -1.504 -0.611 1.00 . A A . 31 TYR CD2 1 1 20 12339 1 1 31 TYR CE1 C 10.546 -1.318 -0.041 1.00 . A A . 31 TYR CE1 1 1 20 12340 1 1 31 TYR CE2 C 8.548 -0.439 -1.147 1.00 . A A . 31 TYR CE2 1 1 20 12341 1 1 31 TYR CG C 8.415 -2.470 0.197 1.00 . A A . 31 TYR CG 1 1 20 12342 1 1 31 TYR CZ C 9.928 -0.339 -0.853 1.00 . A A . 31 TYR CZ 1 1 20 12343 1 1 31 TYR H H 9.570 -4.480 2.433 1.00 . A A . 31 TYR H 1 1 20 12344 1 1 31 TYR HA H 7.464 -5.746 0.716 1.00 . A A . 31 TYR HA 1 1 20 12345 1 1 31 TYR HB2 H 6.755 -3.764 -0.016 1.00 . A A . 31 TYR HB2 1 1 20 12346 1 1 31 TYR HB3 H 7.079 -3.272 1.639 1.00 . A A . 31 TYR HB3 1 1 20 12347 1 1 31 TYR HD1 H 10.268 -3.173 1.049 1.00 . A A . 31 TYR HD1 1 1 20 12348 1 1 31 TYR HD2 H 6.758 -1.614 -0.797 1.00 . A A . 31 TYR HD2 1 1 20 12349 1 1 31 TYR HE1 H 11.606 -1.269 0.157 1.00 . A A . 31 TYR HE1 1 1 20 12350 1 1 31 TYR HE2 H 8.019 0.300 -1.749 1.00 . A A . 31 TYR HE2 1 1 20 12351 1 1 31 TYR HH H 10.106 1.454 -1.545 1.00 . A A . 31 TYR HH 1 1 20 12352 1 1 31 TYR N N 8.740 -5.017 2.219 1.00 . A A . 31 TYR N 1 1 20 12353 1 1 31 TYR O O 9.222 -4.627 -1.299 1.00 . A A . 31 TYR O 1 1 20 12354 1 1 31 TYR OH O 10.664 0.696 -1.345 1.00 . A A . 31 TYR OH 1 1 20 12355 1 1 32 PRO C C 10.615 -6.919 -2.462 1.00 . A A . 32 PRO C 1 1 20 12356 1 1 32 PRO CA C 11.179 -6.450 -1.113 1.00 . A A . 32 PRO CA 1 1 20 12357 1 1 32 PRO CB C 12.154 -7.447 -0.488 1.00 . A A . 32 PRO CB 1 1 20 12358 1 1 32 PRO CD C 10.227 -7.253 0.939 1.00 . A A . 32 PRO CD 1 1 20 12359 1 1 32 PRO CG C 11.323 -8.225 0.530 1.00 . A A . 32 PRO CG 1 1 20 12360 1 1 32 PRO HA H 11.669 -5.476 -1.229 1.00 . A A . 32 PRO HA 1 1 20 12361 1 1 32 PRO HB2 H 12.581 -8.111 -1.230 1.00 . A A . 32 PRO HB2 1 1 20 12362 1 1 32 PRO HB3 H 12.945 -6.906 0.030 1.00 . A A . 32 PRO HB3 1 1 20 12363 1 1 32 PRO HD2 H 9.287 -7.772 1.090 1.00 . A A . 32 PRO HD2 1 1 20 12364 1 1 32 PRO HD3 H 10.536 -6.749 1.854 1.00 . A A . 32 PRO HD3 1 1 20 12365 1 1 32 PRO HG2 H 10.888 -9.111 0.067 1.00 . A A . 32 PRO HG2 1 1 20 12366 1 1 32 PRO HG3 H 11.920 -8.477 1.401 1.00 . A A . 32 PRO HG3 1 1 20 12367 1 1 32 PRO N N 10.109 -6.290 -0.139 1.00 . A A . 32 PRO N 1 1 20 12368 1 1 32 PRO O O 11.216 -6.701 -3.517 1.00 . A A . 32 PRO O 1 1 20 12369 1 1 33 ALA C C 7.356 -7.269 -3.804 1.00 . A A . 33 ALA C 1 1 20 12370 1 1 33 ALA CA C 8.663 -8.030 -3.548 1.00 . A A . 33 ALA CA 1 1 20 12371 1 1 33 ALA CB C 8.367 -9.489 -3.212 1.00 . A A . 33 ALA CB 1 1 20 12372 1 1 33 ALA H H 8.996 -7.615 -1.519 1.00 . A A . 33 ALA H 1 1 20 12373 1 1 33 ALA HA H 9.268 -8.003 -4.453 1.00 . A A . 33 ALA HA 1 1 20 12374 1 1 33 ALA HB1 H 7.841 -9.966 -4.038 1.00 . A A . 33 ALA HB1 1 1 20 12375 1 1 33 ALA HB2 H 9.295 -10.031 -3.027 1.00 . A A . 33 ALA HB2 1 1 20 12376 1 1 33 ALA HB3 H 7.743 -9.521 -2.319 1.00 . A A . 33 ALA HB3 1 1 20 12377 1 1 33 ALA N N 9.407 -7.488 -2.430 1.00 . A A . 33 ALA N 1 1 20 12378 1 1 33 ALA O O 6.577 -7.694 -4.654 1.00 . A A . 33 ALA O 1 1 20 12379 1 1 34 GLY C C 5.216 -5.153 -4.401 1.00 . A A . 34 GLY C 1 1 20 12380 1 1 34 GLY CA C 5.683 -5.662 -3.035 1.00 . A A . 34 GLY CA 1 1 20 12381 1 1 34 GLY H H 7.728 -5.825 -2.421 1.00 . A A . 34 GLY H 1 1 20 12382 1 1 34 GLY HA2 H 5.594 -4.861 -2.309 1.00 . A A . 34 GLY HA2 1 1 20 12383 1 1 34 GLY HA3 H 5.005 -6.453 -2.715 1.00 . A A . 34 GLY HA3 1 1 20 12384 1 1 34 GLY N N 7.038 -6.214 -3.047 1.00 . A A . 34 GLY N 1 1 20 12385 1 1 34 GLY O O 4.026 -5.237 -4.680 1.00 . A A . 34 GLY O 1 1 20 12386 1 1 35 CYS C C 5.138 -5.444 -7.470 1.00 . A A . 35 CYS C 1 1 20 12387 1 1 35 CYS CA C 5.792 -4.325 -6.655 1.00 . A A . 35 CYS CA 1 1 20 12388 1 1 35 CYS CB C 7.058 -3.889 -7.396 1.00 . A A . 35 CYS CB 1 1 20 12389 1 1 35 CYS H H 7.072 -4.576 -4.957 1.00 . A A . 35 CYS H 1 1 20 12390 1 1 35 CYS HA H 5.099 -3.483 -6.606 1.00 . A A . 35 CYS HA 1 1 20 12391 1 1 35 CYS HB2 H 7.728 -4.747 -7.478 1.00 . A A . 35 CYS HB2 1 1 20 12392 1 1 35 CYS HB3 H 6.779 -3.586 -8.405 1.00 . A A . 35 CYS HB3 1 1 20 12393 1 1 35 CYS N N 6.124 -4.717 -5.283 1.00 . A A . 35 CYS N 1 1 20 12394 1 1 35 CYS O O 4.437 -5.161 -8.445 1.00 . A A . 35 CYS O 1 1 20 12395 1 1 35 CYS SG S 7.902 -2.506 -6.602 1.00 . A A . 35 CYS SG 1 1 20 12396 1 1 36 SER C C 3.315 -8.067 -7.332 1.00 . A A . 36 SER C 1 1 20 12397 1 1 36 SER CA C 4.754 -7.842 -7.793 1.00 . A A . 36 SER CA 1 1 20 12398 1 1 36 SER CB C 5.611 -9.066 -7.495 1.00 . A A . 36 SER CB 1 1 20 12399 1 1 36 SER H H 5.981 -6.938 -6.352 1.00 . A A . 36 SER H 1 1 20 12400 1 1 36 SER HA H 4.767 -7.660 -8.868 1.00 . A A . 36 SER HA 1 1 20 12401 1 1 36 SER HB2 H 5.298 -9.868 -8.141 1.00 . A A . 36 SER HB2 1 1 20 12402 1 1 36 SER HB3 H 6.635 -8.801 -7.732 1.00 . A A . 36 SER HB3 1 1 20 12403 1 1 36 SER HG H 5.995 -8.838 -5.593 1.00 . A A . 36 SER HG 1 1 20 12404 1 1 36 SER N N 5.372 -6.712 -7.127 1.00 . A A . 36 SER N 1 1 20 12405 1 1 36 SER O O 2.512 -8.696 -8.023 1.00 . A A . 36 SER O 1 1 20 12406 1 1 36 SER OG O 5.543 -9.510 -6.147 1.00 . A A . 36 SER OG 1 1 20 12407 1 1 37 ASN C C 0.768 -6.731 -5.905 1.00 . A A . 37 ASN C 1 1 20 12408 1 1 37 ASN CA C 1.741 -7.805 -5.451 1.00 . A A . 37 ASN CA 1 1 20 12409 1 1 37 ASN CB C 1.955 -7.832 -3.918 1.00 . A A . 37 ASN CB 1 1 20 12410 1 1 37 ASN CG C 1.622 -9.213 -3.392 1.00 . A A . 37 ASN CG 1 1 20 12411 1 1 37 ASN H H 3.673 -6.974 -5.688 1.00 . A A . 37 ASN H 1 1 20 12412 1 1 37 ASN HA H 1.339 -8.765 -5.754 1.00 . A A . 37 ASN HA 1 1 20 12413 1 1 37 ASN HB2 H 2.967 -7.527 -3.633 1.00 . A A . 37 ASN HB2 1 1 20 12414 1 1 37 ASN HB3 H 1.297 -7.121 -3.418 1.00 . A A . 37 ASN HB3 1 1 20 12415 1 1 37 ASN HD21 H -0.285 -8.660 -2.980 1.00 . A A . 37 ASN HD21 1 1 20 12416 1 1 37 ASN HD22 H 0.064 -10.321 -2.655 1.00 . A A . 37 ASN HD22 1 1 20 12417 1 1 37 ASN N N 3.002 -7.591 -6.129 1.00 . A A . 37 ASN N 1 1 20 12418 1 1 37 ASN ND2 N 0.386 -9.414 -2.980 1.00 . A A . 37 ASN ND2 1 1 20 12419 1 1 37 ASN O O 0.675 -5.721 -5.227 1.00 . A A . 37 ASN O 1 1 20 12420 1 1 37 ASN OD1 O 2.451 -10.127 -3.379 1.00 . A A . 37 ASN OD1 1 1 20 12421 1 1 38 SER C C -1.774 -5.249 -6.637 1.00 . A A . 38 SER C 1 1 20 12422 1 1 38 SER CA C -0.819 -5.929 -7.647 1.00 . A A . 38 SER CA 1 1 20 12423 1 1 38 SER CB C -1.540 -6.596 -8.829 1.00 . A A . 38 SER CB 1 1 20 12424 1 1 38 SER H H 0.154 -7.806 -7.508 1.00 . A A . 38 SER H 1 1 20 12425 1 1 38 SER HA H -0.176 -5.167 -8.089 1.00 . A A . 38 SER HA 1 1 20 12426 1 1 38 SER HB2 H -0.785 -7.009 -9.501 1.00 . A A . 38 SER HB2 1 1 20 12427 1 1 38 SER HB3 H -2.173 -7.403 -8.458 1.00 . A A . 38 SER HB3 1 1 20 12428 1 1 38 SER HG H -3.166 -5.596 -9.041 1.00 . A A . 38 SER HG 1 1 20 12429 1 1 38 SER N N 0.051 -6.927 -7.018 1.00 . A A . 38 SER N 1 1 20 12430 1 1 38 SER O O -2.077 -4.067 -6.794 1.00 . A A . 38 SER O 1 1 20 12431 1 1 38 SER OG O -2.340 -5.690 -9.567 1.00 . A A . 38 SER OG 1 1 20 12432 1 1 39 ASP C C -2.311 -4.215 -3.778 1.00 . A A . 39 ASP C 1 1 20 12433 1 1 39 ASP CA C -3.028 -5.368 -4.497 1.00 . A A . 39 ASP CA 1 1 20 12434 1 1 39 ASP CB C -3.438 -6.458 -3.488 1.00 . A A . 39 ASP CB 1 1 20 12435 1 1 39 ASP CG C -4.418 -5.974 -2.400 1.00 . A A . 39 ASP CG 1 1 20 12436 1 1 39 ASP H H -1.891 -6.907 -5.475 1.00 . A A . 39 ASP H 1 1 20 12437 1 1 39 ASP HA H -3.938 -4.966 -4.942 1.00 . A A . 39 ASP HA 1 1 20 12438 1 1 39 ASP HB2 H -3.921 -7.269 -4.037 1.00 . A A . 39 ASP HB2 1 1 20 12439 1 1 39 ASP HB3 H -2.542 -6.875 -3.014 1.00 . A A . 39 ASP HB3 1 1 20 12440 1 1 39 ASP N N -2.200 -5.946 -5.571 1.00 . A A . 39 ASP N 1 1 20 12441 1 1 39 ASP O O -2.949 -3.239 -3.395 1.00 . A A . 39 ASP O 1 1 20 12442 1 1 39 ASP OD1 O -5.419 -5.297 -2.716 1.00 . A A . 39 ASP OD1 1 1 20 12443 1 1 39 ASP OD2 O -4.314 -6.429 -1.237 1.00 . A A . 39 ASP OD2 1 1 20 12444 1 1 40 CYS C C 0.600 -2.459 -4.146 1.00 . A A . 40 CYS C 1 1 20 12445 1 1 40 CYS CA C -0.075 -3.308 -3.063 1.00 . A A . 40 CYS CA 1 1 20 12446 1 1 40 CYS CB C 1.055 -4.019 -2.291 1.00 . A A . 40 CYS CB 1 1 20 12447 1 1 40 CYS H H -0.520 -5.024 -4.171 1.00 . A A . 40 CYS H 1 1 20 12448 1 1 40 CYS HA H -0.620 -2.646 -2.389 1.00 . A A . 40 CYS HA 1 1 20 12449 1 1 40 CYS HB2 H 1.520 -4.766 -2.945 1.00 . A A . 40 CYS HB2 1 1 20 12450 1 1 40 CYS HB3 H 1.828 -3.282 -2.073 1.00 . A A . 40 CYS HB3 1 1 20 12451 1 1 40 CYS N N -0.983 -4.300 -3.635 1.00 . A A . 40 CYS N 1 1 20 12452 1 1 40 CYS O O 1.112 -1.391 -3.835 1.00 . A A . 40 CYS O 1 1 20 12453 1 1 40 CYS SG S 0.611 -4.815 -0.721 1.00 . A A . 40 CYS SG 1 1 20 12454 1 1 41 THR C C 1.150 -0.878 -6.676 1.00 . A A . 41 THR C 1 1 20 12455 1 1 41 THR CA C 1.533 -2.324 -6.400 1.00 . A A . 41 THR CA 1 1 20 12456 1 1 41 THR CB C 1.481 -3.196 -7.648 1.00 . A A . 41 THR CB 1 1 20 12457 1 1 41 THR CG2 C 2.249 -2.706 -8.850 1.00 . A A . 41 THR CG2 1 1 20 12458 1 1 41 THR H H 0.372 -3.861 -5.595 1.00 . A A . 41 THR H 1 1 20 12459 1 1 41 THR HA H 2.557 -2.329 -6.023 1.00 . A A . 41 THR HA 1 1 20 12460 1 1 41 THR HB H 0.437 -3.302 -7.937 1.00 . A A . 41 THR HB 1 1 20 12461 1 1 41 THR HG1 H 2.652 -4.705 -8.046 1.00 . A A . 41 THR HG1 1 1 20 12462 1 1 41 THR HG21 H 1.885 -1.721 -9.137 1.00 . A A . 41 THR HG21 1 1 20 12463 1 1 41 THR HG22 H 3.312 -2.662 -8.618 1.00 . A A . 41 THR HG22 1 1 20 12464 1 1 41 THR HG23 H 2.040 -3.421 -9.646 1.00 . A A . 41 THR HG23 1 1 20 12465 1 1 41 THR N N 0.682 -2.921 -5.390 1.00 . A A . 41 THR N 1 1 20 12466 1 1 41 THR O O 2.025 -0.029 -6.560 1.00 . A A . 41 THR O 1 1 20 12467 1 1 41 THR OG1 O 2.044 -4.447 -7.337 1.00 . A A . 41 THR OG1 1 1 20 12468 1 1 42 ALA C C -0.250 1.775 -6.216 1.00 . A A . 42 ALA C 1 1 20 12469 1 1 42 ALA CA C -0.447 0.814 -7.391 1.00 . A A . 42 ALA CA 1 1 20 12470 1 1 42 ALA CB C -1.885 0.888 -7.902 1.00 . A A . 42 ALA CB 1 1 20 12471 1 1 42 ALA H H -0.822 -1.269 -7.016 1.00 . A A . 42 ALA H 1 1 20 12472 1 1 42 ALA HA H 0.222 1.137 -8.196 1.00 . A A . 42 ALA HA 1 1 20 12473 1 1 42 ALA HB1 H -2.040 0.153 -8.692 1.00 . A A . 42 ALA HB1 1 1 20 12474 1 1 42 ALA HB2 H -2.583 0.713 -7.086 1.00 . A A . 42 ALA HB2 1 1 20 12475 1 1 42 ALA HB3 H -2.062 1.880 -8.308 1.00 . A A . 42 ALA HB3 1 1 20 12476 1 1 42 ALA N N -0.101 -0.559 -7.021 1.00 . A A . 42 ALA N 1 1 20 12477 1 1 42 ALA O O 0.161 2.915 -6.433 1.00 . A A . 42 ALA O 1 1 20 12478 1 1 43 PHE C C 1.343 2.289 -3.724 1.00 . A A . 43 PHE C 1 1 20 12479 1 1 43 PHE CA C -0.156 2.004 -3.758 1.00 . A A . 43 PHE CA 1 1 20 12480 1 1 43 PHE CB C -0.635 1.165 -2.560 1.00 . A A . 43 PHE CB 1 1 20 12481 1 1 43 PHE CD1 C 1.049 1.390 -0.727 1.00 . A A . 43 PHE CD1 1 1 20 12482 1 1 43 PHE CD2 C -1.145 2.358 -0.354 1.00 . A A . 43 PHE CD2 1 1 20 12483 1 1 43 PHE CE1 C 1.477 1.847 0.521 1.00 . A A . 43 PHE CE1 1 1 20 12484 1 1 43 PHE CE2 C -0.735 2.760 0.932 1.00 . A A . 43 PHE CE2 1 1 20 12485 1 1 43 PHE CG C -0.245 1.669 -1.188 1.00 . A A . 43 PHE CG 1 1 20 12486 1 1 43 PHE CZ C 0.579 2.513 1.361 1.00 . A A . 43 PHE CZ 1 1 20 12487 1 1 43 PHE H H -0.849 0.362 -4.903 1.00 . A A . 43 PHE H 1 1 20 12488 1 1 43 PHE HA H -0.667 2.965 -3.752 1.00 . A A . 43 PHE HA 1 1 20 12489 1 1 43 PHE HB2 H -1.715 1.031 -2.609 1.00 . A A . 43 PHE HB2 1 1 20 12490 1 1 43 PHE HB3 H -0.198 0.179 -2.643 1.00 . A A . 43 PHE HB3 1 1 20 12491 1 1 43 PHE HD1 H 1.719 0.822 -1.343 1.00 . A A . 43 PHE HD1 1 1 20 12492 1 1 43 PHE HD2 H -2.151 2.573 -0.690 1.00 . A A . 43 PHE HD2 1 1 20 12493 1 1 43 PHE HE1 H 2.493 1.673 0.831 1.00 . A A . 43 PHE HE1 1 1 20 12494 1 1 43 PHE HE2 H -1.418 3.278 1.581 1.00 . A A . 43 PHE HE2 1 1 20 12495 1 1 43 PHE HZ H 0.927 2.835 2.327 1.00 . A A . 43 PHE HZ 1 1 20 12496 1 1 43 PHE N N -0.492 1.311 -4.988 1.00 . A A . 43 PHE N 1 1 20 12497 1 1 43 PHE O O 1.735 3.442 -3.565 1.00 . A A . 43 PHE O 1 1 20 12498 1 1 44 LEU C C 4.243 2.254 -4.900 1.00 . A A . 44 LEU C 1 1 20 12499 1 1 44 LEU CA C 3.645 1.472 -3.731 1.00 . A A . 44 LEU CA 1 1 20 12500 1 1 44 LEU CB C 4.365 0.130 -3.576 1.00 . A A . 44 LEU CB 1 1 20 12501 1 1 44 LEU CD1 C 4.570 -2.079 -2.454 1.00 . A A . 44 LEU CD1 1 1 20 12502 1 1 44 LEU CD2 C 4.288 0.018 -1.022 1.00 . A A . 44 LEU CD2 1 1 20 12503 1 1 44 LEU CG C 3.944 -0.685 -2.341 1.00 . A A . 44 LEU CG 1 1 20 12504 1 1 44 LEU H H 1.865 0.324 -3.939 1.00 . A A . 44 LEU H 1 1 20 12505 1 1 44 LEU HA H 3.792 2.060 -2.832 1.00 . A A . 44 LEU HA 1 1 20 12506 1 1 44 LEU HB2 H 4.219 -0.463 -4.474 1.00 . A A . 44 LEU HB2 1 1 20 12507 1 1 44 LEU HB3 H 5.425 0.340 -3.516 1.00 . A A . 44 LEU HB3 1 1 20 12508 1 1 44 LEU HD11 H 5.641 -1.995 -2.632 1.00 . A A . 44 LEU HD11 1 1 20 12509 1 1 44 LEU HD12 H 4.389 -2.652 -1.544 1.00 . A A . 44 LEU HD12 1 1 20 12510 1 1 44 LEU HD13 H 4.121 -2.607 -3.297 1.00 . A A . 44 LEU HD13 1 1 20 12511 1 1 44 LEU HD21 H 3.946 1.049 -1.000 1.00 . A A . 44 LEU HD21 1 1 20 12512 1 1 44 LEU HD22 H 3.784 -0.487 -0.203 1.00 . A A . 44 LEU HD22 1 1 20 12513 1 1 44 LEU HD23 H 5.357 -0.014 -0.862 1.00 . A A . 44 LEU HD23 1 1 20 12514 1 1 44 LEU HG H 2.872 -0.819 -2.337 1.00 . A A . 44 LEU HG 1 1 20 12515 1 1 44 LEU N N 2.208 1.279 -3.860 1.00 . A A . 44 LEU N 1 1 20 12516 1 1 44 LEU O O 5.153 3.055 -4.688 1.00 . A A . 44 LEU O 1 1 20 12517 1 1 45 SER C C 3.700 4.387 -6.919 1.00 . A A . 45 SER C 1 1 20 12518 1 1 45 SER CA C 3.922 2.909 -7.269 1.00 . A A . 45 SER CA 1 1 20 12519 1 1 45 SER CB C 2.940 2.421 -8.338 1.00 . A A . 45 SER CB 1 1 20 12520 1 1 45 SER H H 3.006 1.373 -6.252 1.00 . A A . 45 SER H 1 1 20 12521 1 1 45 SER HA H 4.940 2.775 -7.632 1.00 . A A . 45 SER HA 1 1 20 12522 1 1 45 SER HB2 H 1.972 2.257 -7.882 1.00 . A A . 45 SER HB2 1 1 20 12523 1 1 45 SER HB3 H 2.803 3.185 -9.080 1.00 . A A . 45 SER HB3 1 1 20 12524 1 1 45 SER HG H 2.725 1.184 -9.766 1.00 . A A . 45 SER HG 1 1 20 12525 1 1 45 SER N N 3.709 2.087 -6.105 1.00 . A A . 45 SER N 1 1 20 12526 1 1 45 SER O O 4.521 5.222 -7.307 1.00 . A A . 45 SER O 1 1 20 12527 1 1 45 SER OG O 3.331 1.235 -9.002 1.00 . A A . 45 SER OG 1 1 20 12528 1 1 46 GLN C C 3.366 6.439 -4.530 1.00 . A A . 46 GLN C 1 1 20 12529 1 1 46 GLN CA C 2.430 6.084 -5.683 1.00 . A A . 46 GLN CA 1 1 20 12530 1 1 46 GLN CB C 0.970 6.324 -5.260 1.00 . A A . 46 GLN CB 1 1 20 12531 1 1 46 GLN CD C -1.361 6.840 -6.210 1.00 . A A . 46 GLN CD 1 1 20 12532 1 1 46 GLN CG C 0.032 6.293 -6.471 1.00 . A A . 46 GLN CG 1 1 20 12533 1 1 46 GLN H H 2.006 3.999 -5.848 1.00 . A A . 46 GLN H 1 1 20 12534 1 1 46 GLN HA H 2.665 6.762 -6.505 1.00 . A A . 46 GLN HA 1 1 20 12535 1 1 46 GLN HB2 H 0.650 5.582 -4.529 1.00 . A A . 46 GLN HB2 1 1 20 12536 1 1 46 GLN HB3 H 0.911 7.307 -4.792 1.00 . A A . 46 GLN HB3 1 1 20 12537 1 1 46 GLN HE21 H -2.240 5.491 -7.482 1.00 . A A . 46 GLN HE21 1 1 20 12538 1 1 46 GLN HE22 H -3.292 6.713 -6.823 1.00 . A A . 46 GLN HE22 1 1 20 12539 1 1 46 GLN HG2 H 0.465 6.872 -7.284 1.00 . A A . 46 GLN HG2 1 1 20 12540 1 1 46 GLN HG3 H -0.068 5.268 -6.792 1.00 . A A . 46 GLN HG3 1 1 20 12541 1 1 46 GLN N N 2.648 4.722 -6.159 1.00 . A A . 46 GLN N 1 1 20 12542 1 1 46 GLN NE2 N -2.355 6.317 -6.906 1.00 . A A . 46 GLN NE2 1 1 20 12543 1 1 46 GLN O O 3.900 7.544 -4.518 1.00 . A A . 46 GLN O 1 1 20 12544 1 1 46 GLN OE1 O -1.553 7.793 -5.467 1.00 . A A . 46 GLN OE1 1 1 20 12545 1 1 47 CYS C C 5.755 5.969 -2.627 1.00 . A A . 47 CYS C 1 1 20 12546 1 1 47 CYS CA C 4.256 5.926 -2.322 1.00 . A A . 47 CYS CA 1 1 20 12547 1 1 47 CYS CB C 3.888 4.996 -1.149 1.00 . A A . 47 CYS CB 1 1 20 12548 1 1 47 CYS H H 2.991 4.712 -3.562 1.00 . A A . 47 CYS H 1 1 20 12549 1 1 47 CYS HA H 3.949 6.937 -2.043 1.00 . A A . 47 CYS HA 1 1 20 12550 1 1 47 CYS HB2 H 2.918 4.537 -1.347 1.00 . A A . 47 CYS HB2 1 1 20 12551 1 1 47 CYS HB3 H 4.625 4.197 -1.021 1.00 . A A . 47 CYS HB3 1 1 20 12552 1 1 47 CYS N N 3.518 5.577 -3.525 1.00 . A A . 47 CYS N 1 1 20 12553 1 1 47 CYS O O 6.380 7.030 -2.593 1.00 . A A . 47 CYS O 1 1 20 12554 1 1 47 CYS SG S 3.750 5.920 0.404 1.00 . A A . 47 CYS SG 1 1 20 12555 1 1 48 TYR C C 8.208 5.073 -4.535 1.00 . A A . 48 TYR C 1 1 20 12556 1 1 48 TYR CA C 7.782 4.659 -3.126 1.00 . A A . 48 TYR CA 1 1 20 12557 1 1 48 TYR CB C 8.179 3.224 -2.846 1.00 . A A . 48 TYR CB 1 1 20 12558 1 1 48 TYR CD1 C 9.256 3.241 -0.557 1.00 . A A . 48 TYR CD1 1 1 20 12559 1 1 48 TYR CD2 C 7.046 2.273 -0.805 1.00 . A A . 48 TYR CD2 1 1 20 12560 1 1 48 TYR CE1 C 9.335 2.751 0.758 1.00 . A A . 48 TYR CE1 1 1 20 12561 1 1 48 TYR CE2 C 7.165 1.719 0.476 1.00 . A A . 48 TYR CE2 1 1 20 12562 1 1 48 TYR CG C 8.147 2.934 -1.363 1.00 . A A . 48 TYR CG 1 1 20 12563 1 1 48 TYR CZ C 8.311 1.930 1.267 1.00 . A A . 48 TYR CZ 1 1 20 12564 1 1 48 TYR H H 5.766 4.010 -3.090 1.00 . A A . 48 TYR H 1 1 20 12565 1 1 48 TYR HA H 8.338 5.219 -2.385 1.00 . A A . 48 TYR HA 1 1 20 12566 1 1 48 TYR HB2 H 7.522 2.537 -3.381 1.00 . A A . 48 TYR HB2 1 1 20 12567 1 1 48 TYR HB3 H 9.194 3.056 -3.210 1.00 . A A . 48 TYR HB3 1 1 20 12568 1 1 48 TYR HD1 H 10.079 3.807 -0.961 1.00 . A A . 48 TYR HD1 1 1 20 12569 1 1 48 TYR HD2 H 6.188 2.039 -1.415 1.00 . A A . 48 TYR HD2 1 1 20 12570 1 1 48 TYR HE1 H 10.209 2.946 1.359 1.00 . A A . 48 TYR HE1 1 1 20 12571 1 1 48 TYR HE2 H 6.434 1.014 0.805 1.00 . A A . 48 TYR HE2 1 1 20 12572 1 1 48 TYR HH H 9.327 0.932 2.541 1.00 . A A . 48 TYR HH 1 1 20 12573 1 1 48 TYR N N 6.351 4.814 -2.906 1.00 . A A . 48 TYR N 1 1 20 12574 1 1 48 TYR O O 9.332 5.533 -4.720 1.00 . A A . 48 TYR O 1 1 20 12575 1 1 48 TYR OH O 8.434 1.329 2.481 1.00 . A A . 48 TYR OH 1 1 20 12576 1 1 49 GLY C C 7.675 3.584 -7.598 1.00 . A A . 49 GLY C 1 1 20 12577 1 1 49 GLY CA C 7.680 4.964 -6.940 1.00 . A A . 49 GLY CA 1 1 20 12578 1 1 49 GLY H H 6.414 4.524 -5.299 1.00 . A A . 49 GLY H 1 1 20 12579 1 1 49 GLY HA2 H 8.675 5.391 -7.065 1.00 . A A . 49 GLY HA2 1 1 20 12580 1 1 49 GLY HA3 H 6.968 5.612 -7.451 1.00 . A A . 49 GLY HA3 1 1 20 12581 1 1 49 GLY N N 7.333 4.889 -5.525 1.00 . A A . 49 GLY N 1 1 20 12582 1 1 49 GLY O O 7.725 3.512 -8.822 1.00 . A A . 49 GLY O 1 1 20 12583 1 1 50 GLY C C 9.001 0.610 -7.499 1.00 . A A . 50 GLY C 1 1 20 12584 1 1 50 GLY CA C 7.575 1.132 -7.318 1.00 . A A . 50 GLY CA 1 1 20 12585 1 1 50 GLY H H 7.458 2.641 -5.831 1.00 . A A . 50 GLY H 1 1 20 12586 1 1 50 GLY HA2 H 7.048 1.078 -8.273 1.00 . A A . 50 GLY HA2 1 1 20 12587 1 1 50 GLY HA3 H 7.056 0.498 -6.597 1.00 . A A . 50 GLY HA3 1 1 20 12588 1 1 50 GLY N N 7.564 2.501 -6.822 1.00 . A A . 50 GLY N 1 1 20 12589 1 1 50 GLY O O 9.471 0.486 -8.630 1.00 . A A . 50 GLY O 1 1 20 12590 1 1 51 CYS C C 12.103 0.353 -6.506 1.00 . A A . 51 CYS C 1 1 20 12591 1 1 51 CYS CA C 10.875 -0.501 -6.204 1.00 . A A . 51 CYS CA 1 1 20 12592 1 1 51 CYS CB C 10.886 -1.840 -6.965 1.00 . A A . 51 CYS CB 1 1 20 12593 1 1 51 CYS H H 9.071 0.338 -5.526 1.00 . A A . 51 CYS H 1 1 20 12594 1 1 51 CYS HA H 10.951 -0.749 -5.145 1.00 . A A . 51 CYS HA 1 1 20 12595 1 1 51 CYS HB2 H 10.639 -1.666 -8.013 1.00 . A A . 51 CYS HB2 1 1 20 12596 1 1 51 CYS HB3 H 11.908 -2.219 -6.929 1.00 . A A . 51 CYS HB3 1 1 20 12597 1 1 51 CYS N N 9.607 0.213 -6.373 1.00 . A A . 51 CYS N 1 1 20 12598 1 1 51 CYS O O 13.213 -0.115 -6.160 1.00 . A A . 51 CYS O 1 1 20 12599 1 1 51 CYS OXT O 11.993 1.484 -7.020 1.00 . A A . 51 CYS OXT 1 1 20 12600 1 1 51 CYS SG S 9.812 -3.132 -6.273 1.00 . A A . 51 CYS SG 1 1 stop_ save_
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